data_18003
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18003
_Entry.PDB_ID 2LKP
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 18003
_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 HIS C C 3 175.176 175.176 176.750 -1.574 18003
2 1 1 . 1 1 2 2 HIS CA C 3 55.900 55.900 55.731 0.169 18003
3 1 1 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.519 -0.490 18003
4 1 1 . 1 1 3 3 GLY N N 4 110.613 110.613 108.522 2.091 18003
5 1 1 . 1 1 3 3 GLY C C 4 174.068 174.068 173.367 0.701 18003
6 1 1 . 1 1 3 3 GLY CA C 4 45.141 45.141 45.127 0.014 18003
7 1 1 . 1 1 3 3 GLY H H 4 8.500 8.500 8.612 -0.112 18003
8 1 1 . 1 1 4 4 VAL N N 5 119.318 119.318 115.899 3.419 18003
9 1 1 . 1 1 4 4 VAL HA H 5 4.128 4.128 4.955 -0.827 18003
10 1 1 . 1 1 4 4 VAL C C 5 176.361 176.361 175.862 0.499 18003
11 1 1 . 1 1 4 4 VAL CA C 5 61.987 61.987 61.365 0.622 18003
12 1 1 . 1 1 4 4 VAL CB C 5 32.635 32.635 34.655 -2.020 18003
13 1 1 . 1 1 4 4 VAL H H 5 8.094 8.094 8.681 -0.587 18003
14 1 1 . 1 1 5 5 GLU N N 6 124.369 124.369 121.173 3.196 18003
15 1 1 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.431 -0.143 18003
16 1 1 . 1 1 5 5 GLU C C 6 177.012 177.012 176.832 0.180 18003
17 1 1 . 1 1 5 5 GLU CA C 6 56.699 56.699 55.831 0.868 18003
18 1 1 . 1 1 5 5 GLU CB C 6 30.029 30.029 30.603 -0.574 18003
19 1 1 . 1 1 5 5 GLU H H 6 8.545 8.545 8.947 -0.402 18003
20 1 1 . 1 1 6 6 GLY N N 7 109.747 109.747 109.969 -0.222 18003
21 1 1 . 1 1 6 6 GLY C C 7 174.117 174.117 173.772 0.345 18003
22 1 1 . 1 1 6 6 GLY CA C 7 45.568 45.568 44.871 0.697 18003
23 1 1 . 1 1 6 6 GLY H H 7 8.352 8.352 7.901 0.451 18003
24 1 1 . 1 1 7 7 ARG N N 8 120.059 120.059 123.326 -3.267 18003
25 1 1 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.363 -0.021 18003
26 1 1 . 1 1 7 7 ARG C C 8 176.016 176.016 175.225 0.791 18003
27 1 1 . 1 1 7 7 ARG CA C 8 55.833 55.833 56.324 -0.491 18003
28 1 1 . 1 1 7 7 ARG CB C 8 30.444 30.444 30.753 -0.308 18003
29 1 1 . 1 1 7 7 ARG H H 8 8.084 8.084 8.502 -0.418 18003
30 1 1 . 1 1 8 8 ASN N N 9 119.379 119.379 117.325 2.054 18003
31 1 1 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.793 -0.461 18003
32 1 1 . 1 1 8 8 ASN C C 9 174.667 174.667 174.673 -0.006 18003
33 1 1 . 1 1 8 8 ASN CA C 9 53.441 53.441 52.854 0.587 18003
34 1 1 . 1 1 8 8 ASN CB C 9 38.480 38.480 38.996 -0.516 18003
35 1 1 . 1 1 8 8 ASN H H 9 8.411 8.411 8.511 -0.100 18003
36 1 1 . 1 1 9 9 ARG N N 10 121.700 121.700 119.117 2.583 18003
37 1 1 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.244 0.405 18003
38 1 1 . 1 1 9 9 ARG CA C 10 53.147 53.147 56.096 -2.950 18003
39 1 1 . 1 1 9 9 ARG CB C 10 30.197 30.197 28.599 1.598 18003
40 1 1 . 1 1 9 9 ARG H H 10 8.138 8.138 8.548 -0.410 18003
41 1 1 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.497 -0.054 18003
42 1 1 . 1 1 10 10 PRO C C 11 176.815 176.815 176.909 -0.094 18003
43 1 1 . 1 1 10 10 PRO CA C 11 63.177 63.177 63.412 -0.235 18003
44 1 1 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.328 -0.507 18003
45 1 1 . 1 1 11 11 SER N N 12 116.291 116.291 118.285 -1.994 18003
46 1 1 . 1 1 11 11 SER HA H 12 4.418 4.418 4.377 0.041 18003
47 1 1 . 1 1 11 11 SER C C 12 173.702 173.702 173.068 0.634 18003
48 1 1 . 1 1 11 11 SER CA C 12 58.031 58.031 58.089 -0.058 18003
49 1 1 . 1 1 11 11 SER CB C 12 64.032 64.032 64.013 0.019 18003
50 1 1 . 1 1 11 11 SER H H 12 8.325 8.325 7.816 0.509 18003
51 1 1 . 1 1 12 12 ALA N N 13 126.862 126.862 124.389 2.473 18003
52 1 1 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.226 0.162 18003
53 1 1 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.969 -1.511 18003
54 1 1 . 1 1 12 12 ALA CB C 13 18.257 18.257 17.504 0.753 18003
55 1 1 . 1 1 12 12 ALA H H 13 8.166 8.166 8.268 -0.102 18003
56 1 1 . 1 1 13 13 PRO C C 14 176.368 176.368 176.813 -0.445 18003
57 1 1 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.314 0.623 18003
58 1 1 . 1 1 13 13 PRO CB C 14 32.022 32.022 32.453 -0.431 18003
59 1 1 . 1 1 14 14 LEU N N 15 120.969 120.969 121.340 -0.371 18003
60 1 1 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.358 -0.100 18003
61 1 1 . 1 1 14 14 LEU C C 15 176.124 176.124 177.862 -1.738 18003
62 1 1 . 1 1 14 14 LEU CA C 15 54.527 54.527 54.914 -0.388 18003
63 1 1 . 1 1 14 14 LEU CB C 15 43.418 43.418 42.132 1.286 18003
64 1 1 . 1 1 14 14 LEU H H 15 7.875 7.875 8.026 -0.151 18003
65 1 1 . 1 1 15 15 ASP N N 16 121.780 121.780 120.721 1.059 18003
66 1 1 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.597 -0.004 18003
67 1 1 . 1 1 15 15 ASP C C 16 176.208 176.208 178.204 -1.996 18003
68 1 1 . 1 1 15 15 ASP CA C 16 52.468 52.468 56.667 -4.199 18003
69 1 1 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.703 0.927 18003
70 1 1 . 1 1 15 15 ASP H H 16 7.850 7.850 8.712 -0.862 18003
71 1 1 . 1 1 16 16 SER N N 17 114.435 114.435 115.839 -1.404 18003
72 1 1 . 1 1 16 16 SER HA H 17 4.120 4.120 4.186 -0.066 18003
73 1 1 . 1 1 16 16 SER C C 17 177.207 177.207 176.676 0.531 18003
74 1 1 . 1 1 16 16 SER CA C 17 62.322 62.322 61.159 1.163 18003
75 1 1 . 1 1 16 16 SER H H 17 8.658 8.658 8.259 0.399 18003
76 1 1 . 1 1 17 17 GLN N N 18 122.403 122.403 121.543 0.860 18003
77 1 1 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.127 0.070 18003
78 1 1 . 1 1 17 17 GLN C C 18 178.715 178.715 177.358 1.357 18003
79 1 1 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.522 -0.409 18003
80 1 1 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.140 -0.100 18003
81 1 1 . 1 1 17 17 GLN H H 18 8.140 8.140 8.515 -0.375 18003
82 1 1 . 1 1 18 18 ALA N N 19 124.743 124.743 122.175 2.568 18003
83 1 1 . 1 1 18 18 ALA HA H 19 4.176 4.176 3.968 0.208 18003
84 1 1 . 1 1 18 18 ALA C C 19 180.616 180.616 179.517 1.099 18003
85 1 1 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.897 -0.292 18003
86 1 1 . 1 1 18 18 ALA CB C 19 19.028 19.028 17.880 1.148 18003
87 1 1 . 1 1 18 18 ALA H H 19 8.455 8.455 7.805 0.650 18003
88 1 1 . 1 1 19 19 ALA N N 20 119.089 119.089 120.659 -1.570 18003
89 1 1 . 1 1 19 19 ALA HA H 20 4.179 4.179 3.983 0.196 18003
90 1 1 . 1 1 19 19 ALA C C 20 179.239 179.239 179.386 -0.147 18003
91 1 1 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.955 0.317 18003
92 1 1 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.280 -0.088 18003
93 1 1 . 1 1 19 19 ALA H H 20 8.993 8.993 7.976 1.017 18003
94 1 1 . 1 1 20 20 ALA N N 21 119.226 119.226 120.977 -1.751 18003
95 1 1 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.920 0.141 18003
96 1 1 . 1 1 20 20 ALA C C 21 180.230 180.230 179.982 0.248 18003
97 1 1 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.158 -0.015 18003
98 1 1 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.022 0.006 18003
99 1 1 . 1 1 20 20 ALA H H 21 7.724 7.724 7.915 -0.191 18003
100 1 1 . 1 1 21 21 GLN N N 22 119.310 119.310 117.673 1.637 18003
101 1 1 . 1 1 21 21 GLN HA H 22 4.129 4.129 3.995 0.134 18003
102 1 1 . 1 1 21 21 GLN C C 22 179.319 179.319 178.905 0.414 18003
103 1 1 . 1 1 21 21 GLN CA C 22 58.762 58.762 58.785 -0.023 18003
104 1 1 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.272 -0.243 18003
105 1 1 . 1 1 21 21 GLN H H 22 7.638 7.638 8.435 -0.797 18003
106 1 1 . 1 1 22 22 VAL N N 23 121.565 121.565 120.149 1.416 18003
107 1 1 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.709 0.257 18003
108 1 1 . 1 1 22 22 VAL C C 23 178.026 178.026 177.954 0.072 18003
109 1 1 . 1 1 22 22 VAL CA C 23 66.142 66.142 65.783 0.359 18003
110 1 1 . 1 1 22 22 VAL CB C 23 30.966 30.966 30.877 0.089 18003
111 1 1 . 1 1 22 22 VAL H H 23 8.442 8.442 8.340 0.102 18003
112 1 1 . 1 1 23 23 ALA N N 24 121.400 121.400 122.599 -1.199 18003
113 1 1 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.878 0.218 18003
114 1 1 . 1 1 23 23 ALA C C 24 178.758 178.758 179.743 -0.985 18003
115 1 1 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.599 0.316 18003
116 1 1 . 1 1 23 23 ALA CB C 24 16.650 16.650 17.930 -1.280 18003
117 1 1 . 1 1 23 23 ALA H H 24 8.495 8.495 8.488 0.007 18003
118 1 1 . 1 1 24 24 SER N N 25 112.138 112.138 113.300 -1.162 18003
119 1 1 . 1 1 24 24 SER HA H 25 4.093 4.093 4.122 -0.029 18003
120 1 1 . 1 1 24 24 SER C C 25 177.271 177.271 176.727 0.544 18003
121 1 1 . 1 1 24 24 SER CA C 25 62.166 62.166 61.712 0.454 18003
122 1 1 . 1 1 24 24 SER CB C 25 63.032 63.032 63.086 -0.054 18003
123 1 1 . 1 1 24 24 SER H H 25 7.936 7.936 8.159 -0.223 18003
124 1 1 . 1 1 25 25 THR N N 26 119.701 119.701 119.798 -0.097 18003
125 1 1 . 1 1 25 25 THR HA H 26 4.380 4.380 3.988 0.392 18003
126 1 1 . 1 1 25 25 THR C C 26 175.456 175.456 176.512 -1.056 18003
127 1 1 . 1 1 25 25 THR CA C 26 67.129 67.129 67.219 -0.090 18003
128 1 1 . 1 1 25 25 THR CB C 26 68.800 68.800 68.640 0.160 18003
129 1 1 . 1 1 25 25 THR H H 26 7.775 7.775 7.705 0.070 18003
130 1 1 . 1 1 26 26 LEU N N 27 119.270 119.270 120.376 -1.106 18003
131 1 1 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.056 -0.493 18003
132 1 1 . 1 1 26 26 LEU C C 27 178.390 178.390 179.012 -0.622 18003
133 1 1 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.231 0.438 18003
134 1 1 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.334 0.696 18003
135 1 1 . 1 1 26 26 LEU H H 27 8.006 8.006 8.573 -0.567 18003
136 1 1 . 1 1 27 27 GLN N N 28 115.843 115.843 119.757 -3.914 18003
137 1 1 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.062 -0.258 18003
138 1 1 . 1 1 27 27 GLN C C 28 178.657 178.657 178.128 0.529 18003
139 1 1 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.794 -0.082 18003
140 1 1 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.937 -0.908 18003
141 1 1 . 1 1 27 27 GLN H H 28 8.485 8.485 8.129 0.356 18003
142 1 1 . 1 1 28 28 ALA N N 29 118.779 118.779 122.812 -4.033 18003
143 1 1 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.044 -0.036 18003
144 1 1 . 1 1 28 28 ALA C C 29 178.259 178.259 179.827 -1.568 18003
145 1 1 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.846 -0.884 18003
146 1 1 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.424 0.314 18003
147 1 1 . 1 1 28 28 ALA H H 29 7.432 7.432 8.172 -0.740 18003
148 1 1 . 1 1 29 29 LEU N N 30 113.442 113.442 117.579 -4.137 18003
149 1 1 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.858 0.138 18003
150 1 1 . 1 1 29 29 LEU C C 30 175.924 175.924 177.130 -1.206 18003
151 1 1 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.900 -1.336 18003
152 1 1 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.497 0.769 18003
153 1 1 . 1 1 29 29 LEU H H 30 7.311 7.311 7.851 -0.540 18003
154 1 1 . 1 1 30 30 ALA N N 31 119.563 119.563 118.281 1.282 18003
155 1 1 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.186 -0.014 18003
156 1 1 . 1 1 30 30 ALA C C 31 176.316 176.316 176.659 -0.343 18003
157 1 1 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.050 -1.394 18003
158 1 1 . 1 1 30 30 ALA CB C 31 18.077 18.077 19.220 -1.143 18003
159 1 1 . 1 1 30 30 ALA H H 31 7.223 7.223 7.126 0.097 18003
160 1 1 . 1 1 31 31 THR N N 32 114.613 114.613 108.712 5.901 18003
161 1 1 . 1 1 31 31 THR HA H 32 4.950 4.950 4.105 0.845 18003
162 1 1 . 1 1 31 31 THR CA C 32 58.129 58.129 62.095 -3.966 18003
163 1 1 . 1 1 31 31 THR CB C 32 69.098 69.098 67.311 1.787 18003
164 1 1 . 1 1 31 31 THR H H 32 8.399 8.399 8.245 0.154 18003
165 1 1 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.148 0.290 18003
166 1 1 . 1 1 32 32 PRO C C 33 178.207 178.207 179.094 -0.887 18003
167 1 1 . 1 1 32 32 PRO CA C 33 66.905 66.905 65.857 1.048 18003
168 1 1 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.566 -0.302 18003
169 1 1 . 1 1 33 33 SER N N 34 110.767 110.767 112.416 -1.649 18003
170 1 1 . 1 1 33 33 SER HA H 34 4.026 4.026 4.161 -0.135 18003
171 1 1 . 1 1 33 33 SER C C 34 176.742 176.742 176.449 0.293 18003
172 1 1 . 1 1 33 33 SER CA C 34 61.782 61.782 61.532 0.250 18003
173 1 1 . 1 1 33 33 SER CB C 34 62.432 62.432 62.789 -0.357 18003
174 1 1 . 1 1 33 33 SER H H 34 8.407 8.407 8.281 0.126 18003
175 1 1 . 1 1 34 34 ARG N N 35 120.135 120.135 120.830 -0.695 18003
176 1 1 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.080 -0.026 18003
177 1 1 . 1 1 34 34 ARG C C 35 178.283 178.283 178.635 -0.352 18003
178 1 1 . 1 1 34 34 ARG CA C 35 60.532 60.532 59.110 1.422 18003
179 1 1 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.805 -0.852 18003
180 1 1 . 1 1 34 34 ARG H H 35 7.341 7.341 8.230 -0.889 18003
181 1 1 . 1 1 35 35 LEU N N 36 118.454 118.454 120.241 -1.787 18003
182 1 1 . 1 1 35 35 LEU HA H 36 4.054 4.054 3.941 0.113 18003
183 1 1 . 1 1 35 35 LEU C C 36 180.643 180.643 178.960 1.683 18003
184 1 1 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.294 -0.485 18003
185 1 1 . 1 1 35 35 LEU CB C 36 41.778 41.778 42.004 -0.226 18003
186 1 1 . 1 1 35 35 LEU H H 36 8.226 8.226 8.405 -0.179 18003
187 1 1 . 1 1 36 36 MET N N 37 121.073 121.073 119.865 1.208 18003
188 1 1 . 1 1 36 36 MET HA H 37 3.928 3.928 3.962 -0.034 18003
189 1 1 . 1 1 36 36 MET C C 37 177.671 177.671 178.337 -0.666 18003
190 1 1 . 1 1 36 36 MET CA C 37 60.613 60.613 59.282 1.331 18003
191 1 1 . 1 1 36 36 MET CB C 37 33.128 33.128 32.644 0.484 18003
192 1 1 . 1 1 36 36 MET H H 37 8.447 8.447 8.102 0.345 18003
193 1 1 . 1 1 37 37 ILE N N 38 118.239 118.239 119.263 -1.024 18003
194 1 1 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.774 -0.334 18003
195 1 1 . 1 1 37 37 ILE C C 38 177.092 177.092 178.191 -1.099 18003
196 1 1 . 1 1 37 37 ILE CA C 38 65.675 65.675 63.614 2.061 18003
197 1 1 . 1 1 37 37 ILE CB C 38 38.255 38.255 36.461 1.794 18003
198 1 1 . 1 1 37 37 ILE H H 38 7.763 7.763 8.005 -0.242 18003
199 1 1 . 1 1 38 38 LEU N N 39 116.073 116.073 121.592 -5.519 18003
200 1 1 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.882 -0.056 18003
201 1 1 . 1 1 38 38 LEU C C 39 178.941 178.941 178.796 0.145 18003
202 1 1 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.753 -0.722 18003
203 1 1 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.824 -0.044 18003
204 1 1 . 1 1 38 38 LEU H H 39 8.538 8.538 8.588 -0.050 18003
205 1 1 . 1 1 39 39 THR N N 40 106.678 106.678 115.231 -8.553 18003
206 1 1 . 1 1 39 39 THR HA H 40 3.932 3.932 3.870 0.062 18003
207 1 1 . 1 1 39 39 THR C C 40 177.747 177.747 176.428 1.319 18003
208 1 1 . 1 1 39 39 THR CA C 40 65.536 65.536 67.041 -1.505 18003
209 1 1 . 1 1 39 39 THR CB C 40 68.360 68.360 68.555 -0.195 18003
210 1 1 . 1 1 39 39 THR H H 40 8.086 8.086 8.630 -0.544 18003
211 1 1 . 1 1 40 40 GLN N N 41 122.344 122.344 121.362 0.982 18003
212 1 1 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.059 -0.053 18003
213 1 1 . 1 1 40 40 GLN C C 41 178.348 178.348 178.311 0.037 18003
214 1 1 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.707 -0.782 18003
215 1 1 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.314 -0.794 18003
216 1 1 . 1 1 40 40 GLN H H 41 7.593 7.593 7.694 -0.101 18003
217 1 1 . 1 1 41 41 LEU N N 42 116.302 116.302 120.290 -3.988 18003
218 1 1 . 1 1 41 41 LEU C C 42 178.418 178.418 179.533 -1.115 18003
219 1 1 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.115 -1.584 18003
220 1 1 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.120 0.229 18003
221 1 1 . 1 1 41 41 LEU H H 42 7.570 7.570 7.972 -0.402 18003
222 1 1 . 1 1 42 42 ARG N N 43 119.954 119.954 119.877 0.077 18003
223 1 1 . 1 1 42 42 ARG HA H 43 3.915 3.915 3.951 -0.036 18003
224 1 1 . 1 1 42 42 ARG C C 43 177.205 177.205 178.886 -1.681 18003
225 1 1 . 1 1 42 42 ARG CA C 43 58.704 58.704 58.778 -0.074 18003
226 1 1 . 1 1 42 42 ARG CB C 43 29.443 29.443 29.491 -0.048 18003
227 1 1 . 1 1 42 42 ARG H H 43 7.612 7.612 8.683 -1.071 18003
228 1 1 . 1 1 43 43 ASN N N 44 114.682 114.682 116.211 -1.529 18003
229 1 1 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.585 0.175 18003
230 1 1 . 1 1 43 43 ASN C C 44 174.507 174.507 175.693 -1.186 18003
231 1 1 . 1 1 43 43 ASN CA C 44 53.953 53.953 54.821 -0.868 18003
232 1 1 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.264 -0.234 18003
233 1 1 . 1 1 43 43 ASN H H 44 7.567 7.567 7.697 -0.130 18003
234 1 1 . 1 1 44 44 GLY N N 45 109.113 109.113 106.231 2.882 18003
235 1 1 . 1 1 44 44 GLY CA C 45 44.268 44.268 44.663 -0.394 18003
236 1 1 . 1 1 44 44 GLY H H 45 7.361 7.361 7.805 -0.444 18003
237 1 1 . 1 1 45 45 PRO C C 46 178.412 178.412 176.335 2.077 18003
238 1 1 . 1 1 45 45 PRO CA C 46 62.580 62.580 63.215 -0.635 18003
239 1 1 . 1 1 45 45 PRO CB C 46 33.129 33.129 32.048 1.081 18003
240 1 1 . 1 1 46 46 LEU N N 47 120.363 120.363 117.428 2.935 18003
241 1 1 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.829 0.202 18003
242 1 1 . 1 1 46 46 LEU CA C 47 52.550 52.550 52.851 -0.301 18003
243 1 1 . 1 1 46 46 LEU CB C 47 48.210 48.210 42.998 5.212 18003
244 1 1 . 1 1 46 46 LEU H H 47 8.252 8.252 8.246 0.006 18003
245 1 1 . 1 1 47 47 PRO C C 48 177.313 177.313 178.498 -1.185 18003
246 1 1 . 1 1 47 47 PRO CA C 48 61.835 61.835 61.872 -0.037 18003
247 1 1 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.724 -0.341 18003
248 1 1 . 1 1 48 48 VAL N N 49 119.384 119.384 117.412 1.972 18003
249 1 1 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.774 -0.167 18003
250 1 1 . 1 1 48 48 VAL C C 49 176.710 176.710 177.549 -0.839 18003
251 1 1 . 1 1 48 48 VAL CA C 49 66.188 66.188 65.920 0.268 18003
252 1 1 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.209 0.372 18003
253 1 1 . 1 1 48 48 VAL H H 49 9.074 9.074 8.809 0.265 18003
254 1 1 . 1 1 49 49 THR N N 50 111.293 111.293 114.882 -3.589 18003
255 1 1 . 1 1 49 49 THR HA H 50 4.181 4.181 3.964 0.217 18003
256 1 1 . 1 1 49 49 THR C C 50 176.717 176.717 175.994 0.723 18003
257 1 1 . 1 1 49 49 THR CA C 50 65.063 65.063 66.835 -1.772 18003
258 1 1 . 1 1 49 49 THR CB C 50 68.032 68.032 68.227 -0.195 18003
259 1 1 . 1 1 49 49 THR H H 50 7.848 7.848 8.268 -0.420 18003
260 1 1 . 1 1 50 50 ASP N N 51 120.138 120.138 121.771 -1.633 18003
261 1 1 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.498 -0.293 18003
262 1 1 . 1 1 50 50 ASP C C 51 174.723 174.723 178.601 -3.878 18003
263 1 1 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.189 -0.408 18003
264 1 1 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.244 0.867 18003
265 1 1 . 1 1 50 50 ASP H H 51 7.108 7.108 8.265 -1.157 18003
266 1 1 . 1 1 51 51 LEU N N 52 121.089 121.089 120.736 0.353 18003
267 1 1 . 1 1 51 51 LEU HA H 52 3.985 3.985 4.013 -0.028 18003
268 1 1 . 1 1 51 51 LEU C C 52 177.089 177.089 178.564 -1.475 18003
269 1 1 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.598 0.563 18003
270 1 1 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.876 -0.096 18003
271 1 1 . 1 1 51 51 LEU H H 52 7.943 7.943 8.023 -0.080 18003
272 1 1 . 1 1 52 52 ALA N N 53 119.237 119.237 121.578 -2.341 18003
273 1 1 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.960 -0.088 18003
274 1 1 . 1 1 52 52 ALA C C 53 179.466 179.466 179.510 -0.044 18003
275 1 1 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.188 0.475 18003
276 1 1 . 1 1 52 52 ALA CB C 53 17.619 17.619 18.128 -0.509 18003
277 1 1 . 1 1 52 52 ALA H H 53 8.480 8.480 8.572 -0.092 18003
278 1 1 . 1 1 53 53 GLU N N 54 115.655 115.655 119.028 -3.373 18003
279 1 1 . 1 1 53 53 GLU HA H 54 4.054 4.054 3.961 0.093 18003
280 1 1 . 1 1 53 53 GLU C C 54 179.073 179.073 178.746 0.327 18003
281 1 1 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.993 -0.166 18003
282 1 1 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.518 -0.118 18003
283 1 1 . 1 1 53 53 GLU H H 54 7.705 7.705 7.927 -0.222 18003
284 1 1 . 1 1 54 54 ALA N N 55 120.276 120.276 120.998 -0.722 18003
285 1 1 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.153 -0.016 18003
286 1 1 . 1 1 54 54 ALA C C 55 179.771 179.771 178.556 1.215 18003
287 1 1 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.462 0.199 18003
288 1 1 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.085 -0.851 18003
289 1 1 . 1 1 54 54 ALA H H 55 7.928 7.928 7.825 0.103 18003
290 1 1 . 1 1 55 55 ILE N N 56 107.195 107.195 117.179 -9.984 18003
291 1 1 . 1 1 55 55 ILE C C 56 176.053 176.053 177.077 -1.024 18003
292 1 1 . 1 1 55 55 ILE CA C 56 60.551 60.551 62.717 -2.166 18003
293 1 1 . 1 1 55 55 ILE CB C 56 38.497 38.497 39.195 -0.698 18003
294 1 1 . 1 1 55 55 ILE H H 56 7.507 7.507 7.451 0.056 18003
295 1 1 . 1 1 56 56 GLY N N 57 111.108 111.108 107.420 3.688 18003
296 1 1 . 1 1 56 56 GLY C C 57 174.421 174.421 173.846 0.575 18003
297 1 1 . 1 1 56 56 GLY CA C 57 46.960 46.960 44.958 2.002 18003
298 1 1 . 1 1 56 56 GLY H H 57 7.757 7.757 8.363 -0.606 18003
299 1 1 . 1 1 57 57 MET N N 58 118.089 118.089 119.072 -0.983 18003
300 1 1 . 1 1 57 57 MET HA H 58 3.933 3.933 4.026 -0.093 18003
301 1 1 . 1 1 57 57 MET C C 58 174.157 174.157 174.742 -0.585 18003
302 1 1 . 1 1 57 57 MET CA C 58 54.091 54.091 57.112 -3.022 18003
303 1 1 . 1 1 57 57 MET CB C 58 38.062 38.062 32.288 5.774 18003
304 1 1 . 1 1 57 57 MET H H 58 7.659 7.659 7.886 -0.227 18003
305 1 1 . 1 1 58 58 GLU N N 59 121.656 121.656 120.080 1.576 18003
306 1 1 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.549 -0.209 18003
307 1 1 . 1 1 58 58 GLU C C 59 178.355 178.355 176.214 2.141 18003
308 1 1 . 1 1 58 58 GLU CA C 59 56.643 56.643 56.276 0.367 18003
309 1 1 . 1 1 58 58 GLU CB C 59 30.029 30.029 30.586 -0.557 18003
310 1 1 . 1 1 58 58 GLU H H 59 8.523 8.523 8.466 0.057 18003
311 1 1 . 1 1 59 59 GLN N N 60 123.686 123.686 120.068 3.618 18003
312 1 1 . 1 1 59 59 GLN HA H 60 4.214 4.214 4.044 0.170 18003
313 1 1 . 1 1 59 59 GLN C C 60 177.961 177.961 177.559 0.402 18003
314 1 1 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.588 2.028 18003
315 1 1 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.253 0.762 18003
316 1 1 . 1 1 59 59 GLN H H 60 9.009 9.009 8.658 0.351 18003
317 1 1 . 1 1 60 60 SER N N 61 115.101 115.101 116.244 -1.143 18003
318 1 1 . 1 1 60 60 SER C C 61 176.801 176.801 177.017 -0.216 18003
319 1 1 . 1 1 60 60 SER CA C 61 61.213 61.213 60.742 0.471 18003
320 1 1 . 1 1 60 60 SER H H 61 8.964 8.964 8.545 0.419 18003
321 1 1 . 1 1 61 61 ALA N N 62 126.069 126.069 124.862 1.207 18003
322 1 1 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.263 0.088 18003
323 1 1 . 1 1 61 61 ALA C C 62 180.635 180.635 179.716 0.919 18003
324 1 1 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.770 -0.512 18003
325 1 1 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.427 0.196 18003
326 1 1 . 1 1 61 61 ALA H H 62 7.103 7.103 8.349 -1.246 18003
327 1 1 . 1 1 62 62 VAL N N 63 119.252 119.252 119.088 0.164 18003
328 1 1 . 1 1 62 62 VAL C C 63 177.842 177.842 177.728 0.114 18003
329 1 1 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.179 0.619 18003
330 1 1 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.216 0.048 18003
331 1 1 . 1 1 62 62 VAL H H 63 7.971 7.971 7.867 0.104 18003
332 1 1 . 1 1 63 63 SER N N 64 115.494 115.494 116.149 -0.655 18003
333 1 1 . 1 1 63 63 SER HA H 64 4.034 4.034 3.721 0.313 18003
334 1 1 . 1 1 63 63 SER C C 64 176.835 176.835 176.787 0.048 18003
335 1 1 . 1 1 63 63 SER CA C 64 62.400 62.400 61.731 0.669 18003
336 1 1 . 1 1 63 63 SER CB C 64 62.752 62.752 62.445 0.307 18003
337 1 1 . 1 1 63 63 SER H H 64 8.743 8.743 8.117 0.626 18003
338 1 1 . 1 1 64 64 HIS N N 65 120.010 120.010 121.668 -1.658 18003
339 1 1 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.291 0.069 18003
340 1 1 . 1 1 64 64 HIS C C 65 177.731 177.731 177.760 -0.029 18003
341 1 1 . 1 1 64 64 HIS CA C 65 59.998 59.998 59.995 0.003 18003
342 1 1 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.638 0.296 18003
343 1 1 . 1 1 64 64 HIS H H 65 7.804 7.804 7.901 -0.097 18003
344 1 1 . 1 1 65 65 GLN N N 66 115.590 115.590 119.897 -4.307 18003
345 1 1 . 1 1 65 65 GLN HA H 66 4.035 4.035 4.062 -0.027 18003
346 1 1 . 1 1 65 65 GLN C C 66 179.055 179.055 178.449 0.606 18003
347 1 1 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.790 -1.260 18003
348 1 1 . 1 1 65 65 GLN H H 66 7.751 7.751 8.242 -0.491 18003
349 1 1 . 1 1 66 66 LEU N N 67 118.746 118.746 119.113 -0.367 18003
350 1 1 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.938 0.009 18003
351 1 1 . 1 1 66 66 LEU C C 67 178.334 178.334 178.980 -0.646 18003
352 1 1 . 1 1 66 66 LEU CA C 67 57.846 57.846 57.973 -0.127 18003
353 1 1 . 1 1 66 66 LEU CB C 67 41.103 41.103 40.580 0.523 18003
354 1 1 . 1 1 66 66 LEU H H 67 8.648 8.648 8.477 0.171 18003
355 1 1 . 1 1 67 67 ARG N N 68 119.610 119.610 119.536 0.074 18003
356 1 1 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.992 -0.049 18003
357 1 1 . 1 1 67 67 ARG C C 68 178.807 178.807 178.795 0.012 18003
358 1 1 . 1 1 67 67 ARG CA C 68 59.377 59.377 58.971 0.406 18003
359 1 1 . 1 1 67 67 ARG CB C 68 29.475 29.475 29.567 -0.092 18003
360 1 1 . 1 1 67 67 ARG H H 68 7.607 7.607 7.813 -0.206 18003
361 1 1 . 1 1 68 68 VAL N N 69 119.719 119.719 120.258 -0.539 18003
362 1 1 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.731 -0.098 18003
363 1 1 . 1 1 68 68 VAL C C 69 178.690 178.690 178.260 0.430 18003
364 1 1 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.652 -0.198 18003
365 1 1 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.358 0.421 18003
366 1 1 . 1 1 68 68 VAL H H 69 7.259 7.259 7.996 -0.737 18003
367 1 1 . 1 1 69 69 LEU N N 70 117.532 117.532 119.560 -2.028 18003
368 1 1 . 1 1 69 69 LEU HA H 70 3.948 3.948 4.026 -0.078 18003
369 1 1 . 1 1 69 69 LEU C C 70 179.144 179.144 179.273 -0.129 18003
370 1 1 . 1 1 69 69 LEU CA C 70 57.750 57.750 57.529 0.221 18003
371 1 1 . 1 1 69 69 LEU CB C 70 41.860 41.860 40.775 1.085 18003
372 1 1 . 1 1 69 69 LEU H H 70 8.375 8.375 8.038 0.337 18003
373 1 1 . 1 1 70 70 ARG N N 71 122.498 122.498 120.025 2.473 18003
374 1 1 . 1 1 70 70 ARG HA H 71 3.931 3.931 4.026 -0.095 18003
375 1 1 . 1 1 70 70 ARG C C 71 180.499 180.499 178.937 1.562 18003
376 1 1 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.465 -0.688 18003
377 1 1 . 1 1 70 70 ARG CB C 71 30.155 30.155 30.069 0.086 18003
378 1 1 . 1 1 70 70 ARG H H 71 8.822 8.822 8.542 0.280 18003
379 1 1 . 1 1 71 71 ASN N N 72 121.816 121.816 117.950 3.866 18003
380 1 1 . 1 1 71 71 ASN C C 72 177.170 177.170 177.378 -0.208 18003
381 1 1 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.593 0.184 18003
382 1 1 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.212 -0.478 18003
383 1 1 . 1 1 71 71 ASN H H 72 8.144 8.144 7.818 0.326 18003
384 1 1 . 1 1 72 72 LEU N N 73 117.044 117.044 116.477 0.567 18003
385 1 1 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.437 -0.092 18003
386 1 1 . 1 1 72 72 LEU C C 73 176.984 176.984 177.541 -0.557 18003
387 1 1 . 1 1 72 72 LEU CA C 73 55.125 55.125 55.121 0.004 18003
388 1 1 . 1 1 72 72 LEU CB C 73 43.269 43.269 41.964 1.305 18003
389 1 1 . 1 1 72 72 LEU H H 73 7.804 7.804 7.437 0.367 18003
390 1 1 . 1 1 73 73 GLY N N 74 106.621 106.621 106.840 -0.219 18003
391 1 1 . 1 1 73 73 GLY C C 74 173.266 173.266 175.427 -2.161 18003
392 1 1 . 1 1 73 73 GLY CA C 74 46.022 46.022 44.998 1.024 18003
393 1 1 . 1 1 73 73 GLY H H 74 7.851 7.851 7.731 0.120 18003
394 1 1 . 1 1 74 74 LEU N N 75 114.582 114.582 117.222 -2.640 18003
395 1 1 . 1 1 74 74 LEU C C 75 177.562 177.562 175.744 1.818 18003
396 1 1 . 1 1 74 74 LEU CA C 75 56.031 56.031 56.709 -0.678 18003
397 1 1 . 1 1 74 74 LEU CB C 75 44.444 44.444 40.879 3.566 18003
398 1 1 . 1 1 74 74 LEU H H 75 7.808 7.808 8.413 -0.605 18003
399 1 1 . 1 1 75 75 VAL N N 76 110.980 110.980 112.451 -1.471 18003
400 1 1 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.721 -0.194 18003
401 1 1 . 1 1 75 75 VAL C C 76 173.922 173.922 174.555 -0.633 18003
402 1 1 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.096 -2.154 18003
403 1 1 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.576 0.453 18003
404 1 1 . 1 1 75 75 VAL H H 76 7.079 7.079 7.763 -0.684 18003
405 1 1 . 1 1 76 76 VAL N N 77 118.619 118.619 121.880 -3.261 18003
406 1 1 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.500 0.802 18003
407 1 1 . 1 1 76 76 VAL C C 77 174.041 174.041 174.405 -0.364 18003
408 1 1 . 1 1 76 76 VAL CA C 77 59.999 59.999 61.120 -1.121 18003
409 1 1 . 1 1 76 76 VAL H H 77 9.024 9.024 9.263 -0.239 18003
410 1 1 . 1 1 77 77 GLY N N 78 109.451 109.451 110.535 -1.084 18003
411 1 1 . 1 1 77 77 GLY C C 78 172.225 172.225 172.521 -0.296 18003
412 1 1 . 1 1 77 77 GLY CA C 78 44.462 44.462 43.668 0.794 18003
413 1 1 . 1 1 77 77 GLY H H 78 8.265 8.265 8.431 -0.166 18003
414 1 1 . 1 1 78 78 ASP N N 79 122.826 122.826 123.480 -0.654 18003
415 1 1 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.860 -0.114 18003
416 1 1 . 1 1 78 78 ASP C C 79 174.817 174.817 175.249 -0.432 18003
417 1 1 . 1 1 78 78 ASP CA C 79 53.111 53.111 52.476 0.635 18003
418 1 1 . 1 1 78 78 ASP CB C 79 43.655 43.655 42.654 1.001 18003
419 1 1 . 1 1 78 78 ASP H H 79 8.479 8.479 8.580 -0.101 18003
420 1 1 . 1 1 79 79 ARG N N 80 122.613 122.613 125.991 -3.378 18003
421 1 1 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.050 0.362 18003
422 1 1 . 1 1 79 79 ARG C C 80 175.546 175.546 175.377 0.169 18003
423 1 1 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.842 -0.523 18003
424 1 1 . 1 1 79 79 ARG CB C 80 30.376 30.376 30.791 -0.415 18003
425 1 1 . 1 1 79 79 ARG H H 80 8.580 8.580 8.720 -0.140 18003
426 1 1 . 1 1 80 80 ALA N N 81 129.263 129.263 130.634 -1.371 18003
427 1 1 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.655 -0.203 18003
428 1 1 . 1 1 80 80 ALA C C 81 177.126 177.126 176.663 0.463 18003
429 1 1 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.290 0.330 18003
430 1 1 . 1 1 80 80 ALA CB C 81 19.260 19.260 20.108 -0.848 18003
431 1 1 . 1 1 80 80 ALA H H 81 8.396 8.396 8.849 -0.453 18003
432 1 1 . 1 1 81 81 GLY N N 82 112.739 112.739 113.932 -1.193 18003
433 1 1 . 1 1 81 81 GLY C C 82 174.856 174.856 174.700 0.156 18003
434 1 1 . 1 1 81 81 GLY CA C 82 46.392 46.392 46.896 -0.504 18003
435 1 1 . 1 1 81 81 GLY H H 82 8.641 8.641 8.667 -0.026 18003
436 1 1 . 1 1 82 82 ARG N N 83 124.780 124.780 122.624 2.156 18003
437 1 1 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.472 -0.149 18003
438 1 1 . 1 1 82 82 ARG C C 83 176.339 176.339 175.062 1.277 18003
439 1 1 . 1 1 82 82 ARG CA C 83 56.690 56.690 55.366 1.324 18003
440 1 1 . 1 1 82 82 ARG CB C 83 30.221 30.221 30.087 0.134 18003
441 1 1 . 1 1 82 82 ARG H H 83 8.728 8.728 8.260 0.468 18003
442 1 1 . 1 1 83 83 SER N N 84 114.678 114.678 114.961 -0.283 18003
443 1 1 . 1 1 83 83 SER C C 84 172.869 172.869 172.463 0.406 18003
444 1 1 . 1 1 83 83 SER CA C 84 56.834 56.834 57.271 -0.437 18003
445 1 1 . 1 1 83 83 SER CB C 84 65.191 65.191 65.842 -0.651 18003
446 1 1 . 1 1 83 83 SER H H 84 7.821 7.821 7.916 -0.095 18003
447 1 1 . 1 1 84 84 ILE N N 85 122.996 122.996 126.064 -3.068 18003
448 1 1 . 1 1 84 84 ILE C C 85 175.521 175.521 173.891 1.630 18003
449 1 1 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.547 0.688 18003
450 1 1 . 1 1 84 84 ILE CB C 85 38.136 38.136 40.059 -1.923 18003
451 1 1 . 1 1 84 84 ILE H H 85 8.232 8.232 8.634 -0.402 18003
452 1 1 . 1 1 85 85 VAL N N 86 121.845 121.845 129.119 -7.274 18003
453 1 1 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.215 0.095 18003
454 1 1 . 1 1 85 85 VAL C C 86 174.818 174.818 174.334 0.484 18003
455 1 1 . 1 1 85 85 VAL CA C 86 59.738 59.738 61.261 -1.523 18003
456 1 1 . 1 1 85 85 VAL CB C 86 34.221 34.221 32.925 1.296 18003
457 1 1 . 1 1 85 85 VAL H H 86 8.495 8.495 8.321 0.174 18003
458 1 1 . 1 1 86 86 TYR N N 87 125.020 125.020 127.708 -2.688 18003
459 1 1 . 1 1 86 86 TYR HA H 87 4.319 4.319 4.966 -0.647 18003
460 1 1 . 1 1 86 86 TYR C C 87 173.808 173.808 175.194 -1.386 18003
461 1 1 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.680 -0.215 18003
462 1 1 . 1 1 86 86 TYR CB C 87 41.480 41.480 40.102 1.378 18003
463 1 1 . 1 1 86 86 TYR H H 87 8.488 8.488 8.748 -0.260 18003
464 1 1 . 1 1 87 87 SER N N 88 110.681 110.681 115.737 -5.056 18003
465 1 1 . 1 1 87 87 SER HA H 88 5.414 5.414 4.780 0.634 18003
466 1 1 . 1 1 87 87 SER C C 88 174.693 174.693 173.055 1.638 18003
467 1 1 . 1 1 87 87 SER CA C 88 56.113 56.113 57.218 -1.105 18003
468 1 1 . 1 1 87 87 SER CB C 88 66.309 66.309 65.927 0.382 18003
469 1 1 . 1 1 87 87 SER H H 88 8.718 8.718 9.216 -0.498 18003
470 1 1 . 1 1 88 88 LEU N N 89 119.612 119.612 121.303 -1.691 18003
471 1 1 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.300 0.627 18003
472 1 1 . 1 1 88 88 LEU C C 89 179.031 179.031 177.618 1.413 18003
473 1 1 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.308 0.017 18003
474 1 1 . 1 1 88 88 LEU CB C 89 41.720 41.720 41.557 0.163 18003
475 1 1 . 1 1 88 88 LEU H H 89 9.034 9.034 8.512 0.522 18003
476 1 1 . 1 1 89 89 TYR N N 90 120.540 120.540 124.422 -3.882 18003
477 1 1 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.147 0.475 18003
478 1 1 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.870 0.842 18003
479 1 1 . 1 1 89 89 TYR H H 90 8.075 8.075 8.790 -0.715 18003
480 1 1 . 1 1 92 92 HIS C C 93 177.850 177.850 177.160 0.690 18003
481 1 1 . 1 1 93 93 VAL N N 94 120.211 120.211 118.338 1.873 18003
482 1 1 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.268 0.233 18003
483 1 1 . 1 1 93 93 VAL C C 94 176.785 176.785 177.448 -0.663 18003
484 1 1 . 1 1 93 93 VAL CA C 94 66.666 66.666 65.585 1.081 18003
485 1 1 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.493 0.144 18003
486 1 1 . 1 1 93 93 VAL H H 94 8.164 8.164 7.903 0.261 18003
487 1 1 . 1 1 94 94 ALA N N 95 119.221 119.221 121.527 -2.306 18003
488 1 1 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.877 -0.087 18003
489 1 1 . 1 1 94 94 ALA C C 95 177.979 177.979 179.718 -1.739 18003
490 1 1 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.246 0.233 18003
491 1 1 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.196 -0.086 18003
492 1 1 . 1 1 94 94 ALA H H 95 6.942 6.942 7.955 -1.013 18003
493 1 1 . 1 1 95 95 GLN N N 96 115.416 115.416 118.497 -3.081 18003
494 1 1 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.065 -0.030 18003
495 1 1 . 1 1 95 95 GLN C C 96 177.993 177.993 178.888 -0.895 18003
496 1 1 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.495 0.347 18003
497 1 1 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.345 -0.316 18003
498 1 1 . 1 1 95 95 GLN H H 96 7.795 7.795 8.484 -0.689 18003
499 1 1 . 1 1 96 96 LEU N N 97 120.758 120.758 121.497 -0.739 18003
500 1 1 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.041 -0.192 18003
501 1 1 . 1 1 96 96 LEU C C 97 177.974 177.974 178.778 -0.804 18003
502 1 1 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.070 1.212 18003
503 1 1 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.830 -0.783 18003
504 1 1 . 1 1 96 96 LEU H H 97 8.197 8.197 7.987 0.210 18003
505 1 1 . 1 1 97 97 LEU N N 98 117.567 117.567 119.565 -1.998 18003
506 1 1 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.828 0.002 18003
507 1 1 . 1 1 97 97 LEU C C 98 178.219 178.219 178.942 -0.723 18003
508 1 1 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.374 -0.644 18003
509 1 1 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.179 0.683 18003
510 1 1 . 1 1 97 97 LEU H H 98 7.660 7.660 8.465 -0.805 18003
511 1 1 . 1 1 98 98 ASP N N 99 118.607 118.607 119.937 -1.330 18003
512 1 1 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.413 -0.304 18003
513 1 1 . 1 1 98 98 ASP C C 99 179.382 179.382 179.387 -0.005 18003
514 1 1 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.656 0.379 18003
515 1 1 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.061 -0.222 18003
516 1 1 . 1 1 98 98 ASP H H 99 8.295 8.295 8.568 -0.273 18003
517 1 1 . 1 1 99 99 GLU N N 100 117.542 117.542 119.663 -2.121 18003
518 1 1 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.253 -0.404 18003
519 1 1 . 1 1 99 99 GLU C C 100 179.389 179.389 179.047 0.342 18003
520 1 1 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.059 -1.036 18003
521 1 1 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.354 -0.325 18003
522 1 1 . 1 1 99 99 GLU H H 100 8.334 8.334 8.089 0.245 18003
523 1 1 . 1 1 100 100 ALA N N 101 122.890 122.890 123.019 -0.129 18003
524 1 1 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.041 -0.043 18003
525 1 1 . 1 1 100 100 ALA C C 101 180.184 180.184 179.765 0.419 18003
526 1 1 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.368 0.152 18003
527 1 1 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.520 -0.901 18003
528 1 1 . 1 1 100 100 ALA H H 101 8.550 8.550 8.188 0.362 18003
529 1 1 . 1 1 101 101 ILE N N 102 119.952 119.952 119.766 0.186 18003
530 1 1 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.831 -0.242 18003
531 1 1 . 1 1 101 101 ILE C C 102 178.114 178.114 177.287 0.827 18003
532 1 1 . 1 1 101 101 ILE CA C 102 65.376 65.376 63.878 1.498 18003
533 1 1 . 1 1 101 101 ILE CB C 102 38.029 38.029 36.990 1.039 18003
534 1 1 . 1 1 101 101 ILE H H 102 8.493 8.493 8.657 -0.164 18003
535 1 1 . 1 1 102 102 TYR N N 103 120.625 120.625 121.559 -0.934 18003
536 1 1 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.100 0.071 18003
537 1 1 . 1 1 102 102 TYR C C 103 179.772 179.772 178.183 1.589 18003
538 1 1 . 1 1 102 102 TYR CA C 103 60.724 60.724 62.300 -1.577 18003
539 1 1 . 1 1 102 102 TYR CB C 103 37.500 37.500 38.235 -0.735 18003
540 1 1 . 1 1 102 102 TYR H H 103 8.520 8.520 8.449 0.071 18003
541 1 1 . 1 1 103 103 HIS N N 104 117.456 117.456 116.765 0.691 18003
542 1 1 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.289 0.136 18003
543 1 1 . 1 1 103 103 HIS C C 104 176.377 176.377 177.870 -1.493 18003
544 1 1 . 1 1 103 103 HIS CA C 104 60.043 60.043 60.000 0.043 18003
545 1 1 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.591 -0.562 18003
546 1 1 . 1 1 103 103 HIS H H 104 8.622 8.622 8.780 -0.158 18003
547 1 1 . 1 1 104 104 SER N N 105 113.596 113.596 113.897 -0.301 18003
548 1 1 . 1 1 104 104 SER C C 105 176.712 176.712 176.189 0.523 18003
549 1 1 . 1 1 104 104 SER CA C 105 61.852 61.852 61.035 0.817 18003
550 1 1 . 1 1 104 104 SER CB C 105 63.550 63.550 63.470 0.080 18003
551 1 1 . 1 1 104 104 SER H H 105 7.900 7.900 8.183 -0.283 18003
552 1 1 . 1 1 105 105 GLU N N 106 119.022 119.022 120.403 -1.381 18003
553 1 1 . 1 1 105 105 GLU HA H 106 4.013 4.013 4.084 -0.071 18003
554 1 1 . 1 1 105 105 GLU C C 106 177.902 177.902 178.117 -0.215 18003
555 1 1 . 1 1 105 105 GLU CA C 106 58.031 58.031 57.924 0.107 18003
556 1 1 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.632 -0.353 18003
557 1 1 . 1 1 105 105 GLU H H 106 8.181 8.181 8.264 -0.083 18003
558 1 1 . 1 1 106 106 HIS N N 107 116.482 116.482 118.922 -2.440 18003
559 1 1 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.081 0.326 18003
560 1 1 . 1 1 106 106 HIS C C 107 175.575 175.575 175.759 -0.184 18003
561 1 1 . 1 1 106 106 HIS CA C 107 57.343 57.343 58.392 -1.049 18003
562 1 1 . 1 1 106 106 HIS CB C 107 28.580 28.580 29.935 -1.355 18003
563 1 1 . 1 1 106 106 HIS H H 107 7.770 7.770 7.796 -0.026 18003
564 1 1 . 1 1 107 107 LEU N N 108 120.346 120.346 115.133 5.213 18003
565 1 1 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.413 -0.359 18003
566 1 1 . 1 1 107 107 LEU C C 108 177.404 177.404 175.447 1.957 18003
567 1 1 . 1 1 107 107 LEU CA C 108 55.991 55.991 54.100 1.891 18003
568 1 1 . 1 1 107 107 LEU CB C 108 42.030 42.030 43.315 -1.285 18003
569 1 1 . 1 1 107 107 LEU H H 108 7.682 7.682 7.617 0.065 18003
570 1 1 . 1 1 108 108 HIS N N 109 117.222 117.222 116.925 0.297 18003
571 1 1 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.763 -0.709 18003
572 1 1 . 1 1 108 108 HIS C C 109 174.606 174.606 175.573 -0.967 18003
573 1 1 . 1 1 108 108 HIS CA C 109 56.029 56.029 55.831 0.198 18003
574 1 1 . 1 1 108 108 HIS CB C 109 28.517 28.517 29.352 -0.835 18003
575 1 1 . 1 1 108 108 HIS H H 109 8.030 8.030 8.161 -0.131 18003
576 1 1 . 1 1 109 109 LEU N N 110 121.114 121.114 121.445 -0.331 18003
577 1 1 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.076 0.222 18003
578 1 1 . 1 1 109 109 LEU C C 110 178.028 178.028 177.624 0.404 18003
579 1 1 . 1 1 109 109 LEU CA C 110 55.574 55.574 55.935 -0.361 18003
580 1 1 . 1 1 109 109 LEU CB C 110 42.076 42.076 42.052 0.024 18003
581 1 1 . 1 1 109 109 LEU H H 110 7.973 7.973 8.335 -0.362 18003
582 1 1 . 1 1 110 110 GLY N N 111 108.631 108.631 105.367 3.264 18003
583 1 1 . 1 1 110 110 GLY C C 111 174.606 174.606 172.681 1.925 18003
584 1 1 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.178 1.402 18003
585 1 1 . 1 1 110 110 GLY H H 111 8.255 8.255 7.648 0.607 18003
586 1 1 . 1 1 111 111 LEU N N 112 121.022 121.022 118.399 2.623 18003
587 1 1 . 1 1 111 111 LEU HA H 112 4.359 4.359 5.030 -0.671 18003
588 1 1 . 1 1 111 111 LEU C C 112 177.701 177.701 176.331 1.370 18003
589 1 1 . 1 1 111 111 LEU CA C 112 55.476 55.476 53.742 1.734 18003
590 1 1 . 1 1 111 111 LEU CB C 112 41.899 41.899 44.226 -2.327 18003
591 1 1 . 1 1 111 111 LEU H H 112 7.981 7.981 7.761 0.220 18003
592 1 1 . 1 1 112 112 SER N N 113 115.471 115.471 117.410 -1.939 18003
593 1 1 . 1 1 112 112 SER HA H 113 4.432 4.432 4.559 -0.128 18003
594 1 1 . 1 1 112 112 SER C C 113 174.381 174.381 174.200 0.181 18003
595 1 1 . 1 1 112 112 SER CA C 113 58.527 58.527 57.776 0.751 18003
596 1 1 . 1 1 112 112 SER CB C 113 63.593 63.593 63.701 -0.108 18003
597 1 1 . 1 1 112 112 SER H H 113 8.215 8.215 8.582 -0.367 18003
598 1 1 . 1 1 113 113 ASP N N 114 121.696 121.696 124.968 -3.272 18003
599 1 1 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.641 -0.214 18003
600 1 1 . 1 1 113 113 ASP C C 114 175.958 175.958 176.200 -0.242 18003
601 1 1 . 1 1 113 113 ASP CA C 114 54.213 54.213 54.168 0.045 18003
602 1 1 . 1 1 113 113 ASP CB C 114 41.030 41.030 41.721 -0.691 18003
603 1 1 . 1 1 113 113 ASP H H 114 8.203 8.203 8.408 -0.205 18003
604 1 1 . 1 1 114 114 ARG N N 115 120.088 120.088 121.806 -1.718 18003
605 1 1 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.001 0.271 18003
606 1 1 . 1 1 114 114 ARG C C 115 175.792 175.792 176.151 -0.359 18003
607 1 1 . 1 1 114 114 ARG CA C 115 55.735 55.735 56.805 -1.070 18003
608 1 1 . 1 1 114 114 ARG CB C 115 30.586 30.586 29.525 1.061 18003
609 1 1 . 1 1 114 114 ARG H H 115 8.016 8.016 8.401 -0.385 18003
610 1 1 . 1 1 115 115 HIS N N 116 120.597 120.597 125.447 -4.850 18003
611 1 1 . 1 1 115 115 HIS CA C 116 53.697 53.697 53.271 0.426 18003
612 1 1 . 1 1 115 115 HIS CB C 116 29.299 29.299 29.665 -0.366 18003
613 1 1 . 1 1 115 115 HIS H H 116 8.385 8.385 8.168 0.217 18003
614 1 1 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.651 -0.169 18003
615 1 1 . 1 1 116 116 PRO C C 117 177.090 177.090 176.751 0.339 18003
616 1 1 . 1 1 116 116 PRO CA C 117 63.177 63.177 62.678 0.499 18003
617 1 1 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.890 -1.070 18003
618 1 1 . 1 1 117 117 SER N N 118 116.220 116.220 117.122 -0.902 18003
619 1 1 . 1 1 117 117 SER HA H 118 4.465 4.465 4.202 0.263 18003
620 1 1 . 1 1 117 117 SER C C 118 174.287 174.287 175.890 -1.603 18003
621 1 1 . 1 1 117 117 SER CA C 118 58.110 58.110 60.028 -1.918 18003
622 1 1 . 1 1 117 117 SER CB C 118 63.750 63.750 62.988 0.762 18003
623 1 1 . 1 1 117 117 SER H H 118 8.487 8.487 8.323 0.164 18003
624 1 1 . 1 1 118 118 ALA N N 119 126.082 126.082 126.060 0.022 18003
625 1 1 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.243 0.196 18003
626 1 1 . 1 1 118 118 ALA C C 119 176.879 176.879 178.802 -1.923 18003
627 1 1 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.544 -0.095 18003
628 1 1 . 1 1 118 118 ALA CB C 119 19.483 19.483 18.458 1.025 18003
629 1 1 . 1 1 118 118 ALA H H 119 8.295 8.295 8.206 0.089 18003
630 1 2 . 1 1 2 2 HIS C C 3 175.176 175.176 176.136 -0.960 18003
631 1 2 . 1 1 2 2 HIS CA C 3 55.900 55.900 55.964 -0.063 18003
632 1 2 . 1 1 2 2 HIS CB C 3 30.029 30.029 31.901 -1.872 18003
633 1 2 . 1 1 3 3 GLY N N 4 110.613 110.613 110.259 0.354 18003
634 1 2 . 1 1 3 3 GLY C C 4 174.068 174.068 173.441 0.627 18003
635 1 2 . 1 1 3 3 GLY CA C 4 45.141 45.141 45.286 -0.145 18003
636 1 2 . 1 1 3 3 GLY H H 4 8.500 8.500 8.804 -0.304 18003
637 1 2 . 1 1 4 4 VAL N N 5 119.318 119.318 118.395 0.923 18003
638 1 2 . 1 1 4 4 VAL HA H 5 4.128 4.128 4.313 -0.185 18003
639 1 2 . 1 1 4 4 VAL C C 5 176.361 176.361 175.577 0.784 18003
640 1 2 . 1 1 4 4 VAL CA C 5 61.987 61.987 60.804 1.183 18003
641 1 2 . 1 1 4 4 VAL CB C 5 32.635 32.635 33.503 -0.868 18003
642 1 2 . 1 1 4 4 VAL H H 5 8.094 8.094 7.572 0.522 18003
643 1 2 . 1 1 5 5 GLU N N 6 124.369 124.369 125.434 -1.065 18003
644 1 2 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.247 0.041 18003
645 1 2 . 1 1 5 5 GLU C C 6 177.012 177.012 176.553 0.459 18003
646 1 2 . 1 1 5 5 GLU CA C 6 56.699 56.699 57.045 -0.346 18003
647 1 2 . 1 1 5 5 GLU CB C 6 30.029 30.029 30.025 0.004 18003
648 1 2 . 1 1 5 5 GLU H H 6 8.545 8.545 8.639 -0.094 18003
649 1 2 . 1 1 6 6 GLY N N 7 109.747 109.747 107.448 2.299 18003
650 1 2 . 1 1 6 6 GLY C C 7 174.117 174.117 173.334 0.783 18003
651 1 2 . 1 1 6 6 GLY CA C 7 45.568 45.568 44.532 1.036 18003
652 1 2 . 1 1 6 6 GLY H H 7 8.352 8.352 7.714 0.638 18003
653 1 2 . 1 1 7 7 ARG N N 8 120.059 120.059 120.375 -0.316 18003
654 1 2 . 1 1 7 7 ARG HA H 8 4.342 4.342 3.920 0.422 18003
655 1 2 . 1 1 7 7 ARG C C 8 176.016 176.016 174.689 1.327 18003
656 1 2 . 1 1 7 7 ARG CA C 8 55.833 55.833 56.120 -0.286 18003
657 1 2 . 1 1 7 7 ARG CB C 8 30.444 30.444 29.593 0.851 18003
658 1 2 . 1 1 7 7 ARG H H 8 8.084 8.084 8.417 -0.333 18003
659 1 2 . 1 1 8 8 ASN N N 9 119.379 119.379 119.366 0.013 18003
660 1 2 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.646 -0.314 18003
661 1 2 . 1 1 8 8 ASN C C 9 174.667 174.667 176.469 -1.802 18003
662 1 2 . 1 1 8 8 ASN CA C 9 53.441 53.441 53.112 0.329 18003
663 1 2 . 1 1 8 8 ASN CB C 9 38.480 38.480 38.918 -0.438 18003
664 1 2 . 1 1 8 8 ASN H H 9 8.411 8.411 8.165 0.246 18003
665 1 2 . 1 1 9 9 ARG N N 10 121.700 121.700 121.215 0.485 18003
666 1 2 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.104 0.545 18003
667 1 2 . 1 1 9 9 ARG CA C 10 53.147 53.147 55.621 -2.474 18003
668 1 2 . 1 1 9 9 ARG CB C 10 30.197 30.197 29.793 0.404 18003
669 1 2 . 1 1 9 9 ARG H H 10 8.138 8.138 8.412 -0.274 18003
670 1 2 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.490 -0.047 18003
671 1 2 . 1 1 10 10 PRO C C 11 176.815 176.815 176.684 0.131 18003
672 1 2 . 1 1 10 10 PRO CA C 11 63.177 63.177 62.936 0.241 18003
673 1 2 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.311 -0.491 18003
674 1 2 . 1 1 11 11 SER N N 12 116.291 116.291 118.330 -2.039 18003
675 1 2 . 1 1 11 11 SER HA H 12 4.418 4.418 4.421 -0.003 18003
676 1 2 . 1 1 11 11 SER C C 12 173.702 173.702 173.459 0.243 18003
677 1 2 . 1 1 11 11 SER CA C 12 58.031 58.031 57.927 0.104 18003
678 1 2 . 1 1 11 11 SER CB C 12 64.032 64.032 64.968 -0.936 18003
679 1 2 . 1 1 11 11 SER H H 12 8.325 8.325 8.126 0.199 18003
680 1 2 . 1 1 12 12 ALA N N 13 126.862 126.862 120.994 5.868 18003
681 1 2 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.472 -0.084 18003
682 1 2 . 1 1 12 12 ALA CA C 13 50.458 50.458 52.188 -1.730 18003
683 1 2 . 1 1 12 12 ALA CB C 13 18.257 18.257 17.400 0.857 18003
684 1 2 . 1 1 12 12 ALA H H 13 8.166 8.166 8.674 -0.508 18003
685 1 2 . 1 1 13 13 PRO C C 14 176.368 176.368 176.492 -0.124 18003
686 1 2 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.920 0.017 18003
687 1 2 . 1 1 13 13 PRO CB C 14 32.022 32.022 32.089 -0.067 18003
688 1 2 . 1 1 14 14 LEU N N 15 120.969 120.969 122.418 -1.449 18003
689 1 2 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.467 -0.209 18003
690 1 2 . 1 1 14 14 LEU C C 15 176.124 176.124 178.250 -2.126 18003
691 1 2 . 1 1 14 14 LEU CA C 15 54.527 54.527 56.774 -2.247 18003
692 1 2 . 1 1 14 14 LEU CB C 15 43.418 43.418 41.670 1.748 18003
693 1 2 . 1 1 14 14 LEU H H 15 7.875 7.875 8.104 -0.229 18003
694 1 2 . 1 1 15 15 ASP N N 16 121.780 121.780 120.937 0.843 18003
695 1 2 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.247 0.346 18003
696 1 2 . 1 1 15 15 ASP C C 16 176.208 176.208 178.692 -2.484 18003
697 1 2 . 1 1 15 15 ASP CA C 16 52.468 52.468 57.389 -4.921 18003
698 1 2 . 1 1 15 15 ASP CB C 16 41.629 41.629 39.723 1.906 18003
699 1 2 . 1 1 15 15 ASP H H 16 7.850 7.850 8.728 -0.878 18003
700 1 2 . 1 1 16 16 SER N N 17 114.435 114.435 114.125 0.310 18003
701 1 2 . 1 1 16 16 SER HA H 17 4.120 4.120 4.189 -0.069 18003
702 1 2 . 1 1 16 16 SER C C 17 177.207 177.207 176.471 0.736 18003
703 1 2 . 1 1 16 16 SER CA C 17 62.322 62.322 61.309 1.013 18003
704 1 2 . 1 1 16 16 SER H H 17 8.658 8.658 8.296 0.362 18003
705 1 2 . 1 1 17 17 GLN N N 18 122.403 122.403 121.011 1.392 18003
706 1 2 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.028 0.169 18003
707 1 2 . 1 1 17 17 GLN C C 18 178.715 178.715 178.251 0.464 18003
708 1 2 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.772 -0.659 18003
709 1 2 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.637 -0.598 18003
710 1 2 . 1 1 17 17 GLN H H 18 8.140 8.140 8.054 0.086 18003
711 1 2 . 1 1 18 18 ALA N N 19 124.743 124.743 122.669 2.074 18003
712 1 2 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.018 0.158 18003
713 1 2 . 1 1 18 18 ALA C C 19 180.616 180.616 179.400 1.216 18003
714 1 2 . 1 1 18 18 ALA CA C 19 54.605 54.605 55.035 -0.430 18003
715 1 2 . 1 1 18 18 ALA CB C 19 19.028 19.028 18.329 0.699 18003
716 1 2 . 1 1 18 18 ALA H H 19 8.455 8.455 8.859 -0.404 18003
717 1 2 . 1 1 19 19 ALA N N 20 119.089 119.089 120.935 -1.846 18003
718 1 2 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.004 0.175 18003
719 1 2 . 1 1 19 19 ALA C C 20 179.239 179.239 179.443 -0.204 18003
720 1 2 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.865 0.405 18003
721 1 2 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.323 -0.131 18003
722 1 2 . 1 1 19 19 ALA H H 20 8.993 8.993 7.898 1.095 18003
723 1 2 . 1 1 20 20 ALA N N 21 119.226 119.226 121.281 -2.055 18003
724 1 2 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.901 0.159 18003
725 1 2 . 1 1 20 20 ALA C C 21 180.230 180.230 179.525 0.705 18003
726 1 2 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.147 -0.004 18003
727 1 2 . 1 1 20 20 ALA CB C 21 18.028 18.028 17.963 0.065 18003
728 1 2 . 1 1 20 20 ALA H H 21 7.724 7.724 7.999 -0.275 18003
729 1 2 . 1 1 21 21 GLN N N 22 119.310 119.310 118.758 0.552 18003
730 1 2 . 1 1 21 21 GLN HA H 22 4.129 4.129 3.981 0.148 18003
731 1 2 . 1 1 21 21 GLN C C 22 179.319 179.319 178.485 0.834 18003
732 1 2 . 1 1 21 21 GLN CA C 22 58.762 58.762 59.077 -0.315 18003
733 1 2 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.754 -0.725 18003
734 1 2 . 1 1 21 21 GLN H H 22 7.638 7.638 8.485 -0.847 18003
735 1 2 . 1 1 22 22 VAL N N 23 121.565 121.565 120.027 1.538 18003
736 1 2 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.736 0.230 18003
737 1 2 . 1 1 22 22 VAL C C 23 178.026 178.026 178.192 -0.166 18003
738 1 2 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.162 -0.020 18003
739 1 2 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.201 -0.235 18003
740 1 2 . 1 1 22 22 VAL H H 23 8.442 8.442 8.064 0.378 18003
741 1 2 . 1 1 23 23 ALA N N 24 121.400 121.400 122.427 -1.027 18003
742 1 2 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.888 0.208 18003
743 1 2 . 1 1 23 23 ALA C C 24 178.758 178.758 179.753 -0.995 18003
744 1 2 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.495 0.420 18003
745 1 2 . 1 1 23 23 ALA CB C 24 16.650 16.650 17.945 -1.295 18003
746 1 2 . 1 1 23 23 ALA H H 24 8.495 8.495 8.418 0.077 18003
747 1 2 . 1 1 24 24 SER N N 25 112.138 112.138 113.214 -1.076 18003
748 1 2 . 1 1 24 24 SER HA H 25 4.093 4.093 4.104 -0.011 18003
749 1 2 . 1 1 24 24 SER C C 25 177.271 177.271 176.785 0.486 18003
750 1 2 . 1 1 24 24 SER CA C 25 62.166 62.166 61.173 0.993 18003
751 1 2 . 1 1 24 24 SER CB C 25 63.032 63.032 63.104 -0.072 18003
752 1 2 . 1 1 24 24 SER H H 25 7.936 7.936 8.412 -0.476 18003
753 1 2 . 1 1 25 25 THR N N 26 119.701 119.701 117.759 1.942 18003
754 1 2 . 1 1 25 25 THR HA H 26 4.380 4.380 4.043 0.337 18003
755 1 2 . 1 1 25 25 THR C C 26 175.456 175.456 176.641 -1.185 18003
756 1 2 . 1 1 25 25 THR CA C 26 67.129 67.129 65.939 1.190 18003
757 1 2 . 1 1 25 25 THR CB C 26 68.800 68.800 68.598 0.202 18003
758 1 2 . 1 1 25 25 THR H H 26 7.775 7.775 7.727 0.048 18003
759 1 2 . 1 1 26 26 LEU N N 27 119.270 119.270 121.769 -2.499 18003
760 1 2 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.111 -0.548 18003
761 1 2 . 1 1 26 26 LEU C C 27 178.390 178.390 179.394 -1.004 18003
762 1 2 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.484 0.185 18003
763 1 2 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.032 0.998 18003
764 1 2 . 1 1 26 26 LEU H H 27 8.006 8.006 8.620 -0.614 18003
765 1 2 . 1 1 27 27 GLN N N 28 115.843 115.843 120.037 -4.194 18003
766 1 2 . 1 1 27 27 GLN HA H 28 3.804 3.804 3.999 -0.195 18003
767 1 2 . 1 1 27 27 GLN C C 28 178.657 178.657 177.849 0.808 18003
768 1 2 . 1 1 27 27 GLN CA C 28 58.712 58.712 59.048 -0.336 18003
769 1 2 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.827 -0.798 18003
770 1 2 . 1 1 27 27 GLN H H 28 8.485 8.485 8.238 0.247 18003
771 1 2 . 1 1 28 28 ALA N N 29 118.779 118.779 122.943 -4.164 18003
772 1 2 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.006 0.002 18003
773 1 2 . 1 1 28 28 ALA C C 29 178.259 178.259 179.997 -1.738 18003
774 1 2 . 1 1 28 28 ALA CA C 29 53.962 53.962 55.143 -1.181 18003
775 1 2 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.297 0.441 18003
776 1 2 . 1 1 28 28 ALA H H 29 7.432 7.432 7.997 -0.565 18003
777 1 2 . 1 1 29 29 LEU N N 30 113.442 113.442 117.476 -4.034 18003
778 1 2 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.975 0.021 18003
779 1 2 . 1 1 29 29 LEU C C 30 175.924 175.924 178.454 -2.530 18003
780 1 2 . 1 1 29 29 LEU CA C 30 55.564 55.564 57.472 -1.908 18003
781 1 2 . 1 1 29 29 LEU CB C 30 42.266 42.266 40.418 1.848 18003
782 1 2 . 1 1 29 29 LEU H H 30 7.311 7.311 7.865 -0.554 18003
783 1 2 . 1 1 30 30 ALA N N 31 119.563 119.563 119.227 0.336 18003
784 1 2 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.033 0.139 18003
785 1 2 . 1 1 30 30 ALA C C 31 176.316 176.316 177.904 -1.588 18003
786 1 2 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.913 -2.257 18003
787 1 2 . 1 1 30 30 ALA CB C 31 18.077 18.077 18.779 -0.702 18003
788 1 2 . 1 1 30 30 ALA H H 31 7.223 7.223 7.407 -0.184 18003
789 1 2 . 1 1 31 31 THR N N 32 114.613 114.613 111.629 2.984 18003
790 1 2 . 1 1 31 31 THR HA H 32 4.950 4.950 4.047 0.903 18003
791 1 2 . 1 1 31 31 THR CA C 32 58.129 58.129 62.426 -4.298 18003
792 1 2 . 1 1 31 31 THR CB C 32 69.098 69.098 67.988 1.110 18003
793 1 2 . 1 1 31 31 THR H H 32 8.399 8.399 7.612 0.787 18003
794 1 2 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.173 0.265 18003
795 1 2 . 1 1 32 32 PRO C C 33 178.207 178.207 178.899 -0.692 18003
796 1 2 . 1 1 32 32 PRO CA C 33 66.905 66.905 66.137 0.768 18003
797 1 2 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.822 -0.558 18003
798 1 2 . 1 1 33 33 SER N N 34 110.767 110.767 113.669 -2.902 18003
799 1 2 . 1 1 33 33 SER HA H 34 4.026 4.026 4.213 -0.187 18003
800 1 2 . 1 1 33 33 SER C C 34 176.742 176.742 176.780 -0.038 18003
801 1 2 . 1 1 33 33 SER CA C 34 61.782 61.782 62.573 -0.791 18003
802 1 2 . 1 1 33 33 SER CB C 34 62.432 62.432 62.547 -0.115 18003
803 1 2 . 1 1 33 33 SER H H 34 8.407 8.407 8.544 -0.137 18003
804 1 2 . 1 1 34 34 ARG N N 35 120.135 120.135 121.526 -1.391 18003
805 1 2 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.132 -0.078 18003
806 1 2 . 1 1 34 34 ARG C C 35 178.283 178.283 178.903 -0.620 18003
807 1 2 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.376 2.156 18003
808 1 2 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.647 -0.694 18003
809 1 2 . 1 1 34 34 ARG H H 35 7.341 7.341 7.532 -0.191 18003
810 1 2 . 1 1 35 35 LEU N N 36 118.454 118.454 121.131 -2.677 18003
811 1 2 . 1 1 35 35 LEU HA H 36 4.054 4.054 3.978 0.076 18003
812 1 2 . 1 1 35 35 LEU C C 36 180.643 180.643 179.230 1.413 18003
813 1 2 . 1 1 35 35 LEU CA C 36 57.809 57.809 57.882 -0.073 18003
814 1 2 . 1 1 35 35 LEU CB C 36 41.778 41.778 41.716 0.062 18003
815 1 2 . 1 1 35 35 LEU H H 36 8.226 8.226 7.965 0.261 18003
816 1 2 . 1 1 36 36 MET N N 37 121.073 121.073 119.072 2.001 18003
817 1 2 . 1 1 36 36 MET HA H 37 3.928 3.928 4.077 -0.149 18003
818 1 2 . 1 1 36 36 MET C C 37 177.671 177.671 178.456 -0.785 18003
819 1 2 . 1 1 36 36 MET CA C 37 60.613 60.613 58.364 2.249 18003
820 1 2 . 1 1 36 36 MET CB C 37 33.128 33.128 32.395 0.733 18003
821 1 2 . 1 1 36 36 MET H H 37 8.447 8.447 8.196 0.251 18003
822 1 2 . 1 1 37 37 ILE N N 38 118.239 118.239 119.126 -0.887 18003
823 1 2 . 1 1 37 37 ILE HA H 38 3.440 3.440 4.076 -0.636 18003
824 1 2 . 1 1 37 37 ILE C C 38 177.092 177.092 178.675 -1.583 18003
825 1 2 . 1 1 37 37 ILE CA C 38 65.675 65.675 64.425 1.250 18003
826 1 2 . 1 1 37 37 ILE CB C 38 38.255 38.255 36.912 1.343 18003
827 1 2 . 1 1 37 37 ILE H H 38 7.763 7.763 7.978 -0.215 18003
828 1 2 . 1 1 38 38 LEU N N 39 116.073 116.073 120.436 -4.363 18003
829 1 2 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.907 -0.081 18003
830 1 2 . 1 1 38 38 LEU C C 39 178.941 178.941 179.076 -0.135 18003
831 1 2 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.392 -0.361 18003
832 1 2 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.606 0.174 18003
833 1 2 . 1 1 38 38 LEU H H 39 8.538 8.538 8.459 0.079 18003
834 1 2 . 1 1 39 39 THR N N 40 106.678 106.678 115.517 -8.839 18003
835 1 2 . 1 1 39 39 THR HA H 40 3.932 3.932 3.860 0.072 18003
836 1 2 . 1 1 39 39 THR C C 40 177.747 177.747 176.645 1.102 18003
837 1 2 . 1 1 39 39 THR CA C 40 65.536 65.536 66.819 -1.283 18003
838 1 2 . 1 1 39 39 THR CB C 40 68.360 68.360 68.636 -0.276 18003
839 1 2 . 1 1 39 39 THR H H 40 8.086 8.086 8.366 -0.280 18003
840 1 2 . 1 1 40 40 GLN N N 41 122.344 122.344 120.319 2.025 18003
841 1 2 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.054 -0.048 18003
842 1 2 . 1 1 40 40 GLN C C 41 178.348 178.348 178.868 -0.520 18003
843 1 2 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.787 -0.862 18003
844 1 2 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.591 -1.071 18003
845 1 2 . 1 1 40 40 GLN H H 41 7.593 7.593 7.562 0.031 18003
846 1 2 . 1 1 41 41 LEU N N 42 116.302 116.302 121.159 -4.857 18003
847 1 2 . 1 1 41 41 LEU C C 42 178.418 178.418 179.018 -0.600 18003
848 1 2 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.111 -1.580 18003
849 1 2 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.813 -0.464 18003
850 1 2 . 1 1 41 41 LEU H H 42 7.570 7.570 7.847 -0.277 18003
851 1 2 . 1 1 42 42 ARG N N 43 119.954 119.954 119.179 0.775 18003
852 1 2 . 1 1 42 42 ARG HA H 43 3.915 3.915 3.907 0.008 18003
853 1 2 . 1 1 42 42 ARG C C 43 177.205 177.205 178.015 -0.810 18003
854 1 2 . 1 1 42 42 ARG CA C 43 58.704 58.704 59.271 -0.567 18003
855 1 2 . 1 1 42 42 ARG CB C 43 29.443 29.443 29.925 -0.482 18003
856 1 2 . 1 1 42 42 ARG H H 43 7.612 7.612 8.221 -0.609 18003
857 1 2 . 1 1 43 43 ASN N N 44 114.682 114.682 115.393 -0.711 18003
858 1 2 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.616 0.144 18003
859 1 2 . 1 1 43 43 ASN C C 44 174.507 174.507 175.969 -1.462 18003
860 1 2 . 1 1 43 43 ASN CA C 44 53.953 53.953 54.831 -0.878 18003
861 1 2 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.097 -0.067 18003
862 1 2 . 1 1 43 43 ASN H H 44 7.567 7.567 7.783 -0.216 18003
863 1 2 . 1 1 44 44 GLY N N 45 109.113 109.113 106.523 2.590 18003
864 1 2 . 1 1 44 44 GLY CA C 45 44.268 44.268 45.410 -1.142 18003
865 1 2 . 1 1 44 44 GLY H H 45 7.361 7.361 8.377 -1.016 18003
866 1 2 . 1 1 45 45 PRO C C 46 178.412 178.412 175.408 3.004 18003
867 1 2 . 1 1 45 45 PRO CA C 46 62.580 62.580 62.827 -0.247 18003
868 1 2 . 1 1 45 45 PRO CB C 46 33.129 33.129 32.784 0.345 18003
869 1 2 . 1 1 46 46 LEU N N 47 120.363 120.363 118.255 2.108 18003
870 1 2 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.904 0.127 18003
871 1 2 . 1 1 46 46 LEU CA C 47 52.550 52.550 52.601 -0.051 18003
872 1 2 . 1 1 46 46 LEU CB C 47 48.210 48.210 43.543 4.667 18003
873 1 2 . 1 1 46 46 LEU H H 47 8.252 8.252 8.325 -0.073 18003
874 1 2 . 1 1 47 47 PRO C C 48 177.313 177.313 177.113 0.200 18003
875 1 2 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.867 -1.032 18003
876 1 2 . 1 1 47 47 PRO CB C 48 32.383 32.383 31.090 1.292 18003
877 1 2 . 1 1 48 48 VAL N N 49 119.384 119.384 125.867 -6.483 18003
878 1 2 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.654 -0.047 18003
879 1 2 . 1 1 48 48 VAL C C 49 176.710 176.710 177.718 -1.008 18003
880 1 2 . 1 1 48 48 VAL CA C 49 66.188 66.188 66.730 -0.542 18003
881 1 2 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.454 0.127 18003
882 1 2 . 1 1 48 48 VAL H H 49 9.074 9.074 8.123 0.951 18003
883 1 2 . 1 1 49 49 THR N N 50 111.293 111.293 110.203 1.090 18003
884 1 2 . 1 1 49 49 THR HA H 50 4.181 4.181 3.944 0.237 18003
885 1 2 . 1 1 49 49 THR C C 50 176.717 176.717 176.228 0.489 18003
886 1 2 . 1 1 49 49 THR CA C 50 65.063 65.063 66.440 -1.377 18003
887 1 2 . 1 1 49 49 THR CB C 50 68.032 68.032 68.278 -0.246 18003
888 1 2 . 1 1 49 49 THR H H 50 7.848 7.848 7.956 -0.108 18003
889 1 2 . 1 1 50 50 ASP N N 51 120.138 120.138 122.284 -2.146 18003
890 1 2 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.362 -0.157 18003
891 1 2 . 1 1 50 50 ASP C C 51 174.723 174.723 178.909 -4.186 18003
892 1 2 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.587 -0.806 18003
893 1 2 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.566 0.545 18003
894 1 2 . 1 1 50 50 ASP H H 51 7.108 7.108 8.474 -1.366 18003
895 1 2 . 1 1 51 51 LEU N N 52 121.089 121.089 119.474 1.615 18003
896 1 2 . 1 1 51 51 LEU HA H 52 3.985 3.985 3.974 0.011 18003
897 1 2 . 1 1 51 51 LEU C C 52 177.089 177.089 178.862 -1.773 18003
898 1 2 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.730 0.431 18003
899 1 2 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.688 0.092 18003
900 1 2 . 1 1 51 51 LEU H H 52 7.943 7.943 8.241 -0.298 18003
901 1 2 . 1 1 52 52 ALA N N 53 119.237 119.237 122.440 -3.203 18003
902 1 2 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.998 -0.126 18003
903 1 2 . 1 1 52 52 ALA C C 53 179.466 179.466 180.307 -0.841 18003
904 1 2 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.331 0.332 18003
905 1 2 . 1 1 52 52 ALA CB C 53 17.619 17.619 17.858 -0.239 18003
906 1 2 . 1 1 52 52 ALA H H 53 8.480 8.480 8.215 0.265 18003
907 1 2 . 1 1 53 53 GLU N N 54 115.655 115.655 119.168 -3.513 18003
908 1 2 . 1 1 53 53 GLU HA H 54 4.054 4.054 4.043 0.011 18003
909 1 2 . 1 1 53 53 GLU C C 54 179.073 179.073 178.778 0.295 18003
910 1 2 . 1 1 53 53 GLU CA C 54 58.827 58.827 59.042 -0.215 18003
911 1 2 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.269 0.131 18003
912 1 2 . 1 1 53 53 GLU H H 54 7.705 7.705 8.127 -0.422 18003
913 1 2 . 1 1 54 54 ALA N N 55 120.276 120.276 121.046 -0.770 18003
914 1 2 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.155 -0.018 18003
915 1 2 . 1 1 54 54 ALA C C 55 179.771 179.771 178.736 1.035 18003
916 1 2 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.714 -0.053 18003
917 1 2 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.517 -1.282 18003
918 1 2 . 1 1 54 54 ALA H H 55 7.928 7.928 7.744 0.184 18003
919 1 2 . 1 1 55 55 ILE N N 56 107.195 107.195 109.586 -2.391 18003
920 1 2 . 1 1 55 55 ILE C C 56 176.053 176.053 177.452 -1.399 18003
921 1 2 . 1 1 55 55 ILE CA C 56 60.551 60.551 61.319 -0.768 18003
922 1 2 . 1 1 55 55 ILE CB C 56 38.497 38.497 39.137 -0.640 18003
923 1 2 . 1 1 55 55 ILE H H 56 7.507 7.507 7.922 -0.415 18003
924 1 2 . 1 1 56 56 GLY N N 57 111.108 111.108 111.449 -0.341 18003
925 1 2 . 1 1 56 56 GLY C C 57 174.421 174.421 175.332 -0.911 18003
926 1 2 . 1 1 56 56 GLY CA C 57 46.960 46.960 46.007 0.953 18003
927 1 2 . 1 1 56 56 GLY H H 57 7.757 7.757 8.429 -0.672 18003
928 1 2 . 1 1 57 57 MET N N 58 118.089 118.089 116.521 1.568 18003
929 1 2 . 1 1 57 57 MET HA H 58 3.933 3.933 3.975 -0.042 18003
930 1 2 . 1 1 57 57 MET C C 58 174.157 174.157 175.049 -0.892 18003
931 1 2 . 1 1 57 57 MET CA C 58 54.091 54.091 56.511 -2.420 18003
932 1 2 . 1 1 57 57 MET CB C 58 38.062 38.062 31.511 6.551 18003
933 1 2 . 1 1 57 57 MET H H 58 7.659 7.659 8.054 -0.395 18003
934 1 2 . 1 1 58 58 GLU N N 59 121.656 121.656 117.606 4.050 18003
935 1 2 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.396 -0.056 18003
936 1 2 . 1 1 58 58 GLU C C 59 178.355 178.355 176.013 2.342 18003
937 1 2 . 1 1 58 58 GLU CA C 59 56.643 56.643 55.980 0.663 18003
938 1 2 . 1 1 58 58 GLU CB C 59 30.029 30.029 30.407 -0.378 18003
939 1 2 . 1 1 58 58 GLU H H 59 8.523 8.523 7.898 0.625 18003
940 1 2 . 1 1 59 59 GLN N N 60 123.686 123.686 123.993 -0.307 18003
941 1 2 . 1 1 59 59 GLN HA H 60 4.214 4.214 4.022 0.192 18003
942 1 2 . 1 1 59 59 GLN C C 60 177.961 177.961 177.533 0.428 18003
943 1 2 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.372 2.244 18003
944 1 2 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.627 0.389 18003
945 1 2 . 1 1 59 59 GLN H H 60 9.009 9.009 8.785 0.224 18003
946 1 2 . 1 1 60 60 SER N N 61 115.101 115.101 114.672 0.429 18003
947 1 2 . 1 1 60 60 SER C C 61 176.801 176.801 176.208 0.593 18003
948 1 2 . 1 1 60 60 SER CA C 61 61.213 61.213 61.028 0.185 18003
949 1 2 . 1 1 60 60 SER H H 61 8.964 8.964 8.486 0.478 18003
950 1 2 . 1 1 61 61 ALA N N 62 126.069 126.069 124.169 1.900 18003
951 1 2 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.134 0.217 18003
952 1 2 . 1 1 61 61 ALA C C 62 180.635 180.635 179.648 0.987 18003
953 1 2 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.646 -0.388 18003
954 1 2 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.181 0.442 18003
955 1 2 . 1 1 61 61 ALA H H 62 7.103 7.103 7.444 -0.341 18003
956 1 2 . 1 1 62 62 VAL N N 63 119.252 119.252 119.308 -0.056 18003
957 1 2 . 1 1 62 62 VAL C C 63 177.842 177.842 177.962 -0.120 18003
958 1 2 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.350 0.448 18003
959 1 2 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.225 0.039 18003
960 1 2 . 1 1 62 62 VAL H H 63 7.971 7.971 7.428 0.543 18003
961 1 2 . 1 1 63 63 SER N N 64 115.494 115.494 116.130 -0.636 18003
962 1 2 . 1 1 63 63 SER HA H 64 4.034 4.034 3.955 0.079 18003
963 1 2 . 1 1 63 63 SER C C 64 176.835 176.835 176.721 0.114 18003
964 1 2 . 1 1 63 63 SER CA C 64 62.400 62.400 62.413 -0.013 18003
965 1 2 . 1 1 63 63 SER CB C 64 62.752 62.752 62.766 -0.014 18003
966 1 2 . 1 1 63 63 SER H H 64 8.743 8.743 8.399 0.344 18003
967 1 2 . 1 1 64 64 HIS N N 65 120.010 120.010 122.567 -2.557 18003
968 1 2 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.274 0.086 18003
969 1 2 . 1 1 64 64 HIS C C 65 177.731 177.731 177.179 0.552 18003
970 1 2 . 1 1 64 64 HIS CA C 65 59.998 59.998 60.216 -0.218 18003
971 1 2 . 1 1 64 64 HIS CB C 65 29.934 29.934 30.102 -0.168 18003
972 1 2 . 1 1 64 64 HIS H H 65 7.804 7.804 8.210 -0.406 18003
973 1 2 . 1 1 65 65 GLN N N 66 115.590 115.590 119.114 -3.524 18003
974 1 2 . 1 1 65 65 GLN HA H 66 4.035 4.035 4.037 -0.002 18003
975 1 2 . 1 1 65 65 GLN C C 66 179.055 179.055 178.341 0.714 18003
976 1 2 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.764 -1.234 18003
977 1 2 . 1 1 65 65 GLN H H 66 7.751 7.751 7.882 -0.131 18003
978 1 2 . 1 1 66 66 LEU N N 67 118.746 118.746 120.793 -2.047 18003
979 1 2 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.924 0.023 18003
980 1 2 . 1 1 66 66 LEU C C 67 178.334 178.334 178.657 -0.323 18003
981 1 2 . 1 1 66 66 LEU CA C 67 57.846 57.846 57.852 -0.007 18003
982 1 2 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.620 -0.517 18003
983 1 2 . 1 1 66 66 LEU H H 67 8.648 8.648 8.518 0.130 18003
984 1 2 . 1 1 67 67 ARG N N 68 119.610 119.610 118.542 1.068 18003
985 1 2 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.842 0.101 18003
986 1 2 . 1 1 67 67 ARG C C 68 178.807 178.807 178.724 0.083 18003
987 1 2 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.677 -0.300 18003
988 1 2 . 1 1 67 67 ARG CB C 68 29.475 29.475 29.891 -0.416 18003
989 1 2 . 1 1 67 67 ARG H H 68 7.607 7.607 7.845 -0.238 18003
990 1 2 . 1 1 68 68 VAL N N 69 119.719 119.719 120.316 -0.597 18003
991 1 2 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.624 0.009 18003
992 1 2 . 1 1 68 68 VAL C C 69 178.690 178.690 178.099 0.591 18003
993 1 2 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.479 -0.025 18003
994 1 2 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.402 0.377 18003
995 1 2 . 1 1 68 68 VAL H H 69 7.259 7.259 7.657 -0.398 18003
996 1 2 . 1 1 69 69 LEU N N 70 117.532 117.532 119.490 -1.958 18003
997 1 2 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.970 -0.022 18003
998 1 2 . 1 1 69 69 LEU C C 70 179.144 179.144 178.933 0.211 18003
999 1 2 . 1 1 69 69 LEU CA C 70 57.750 57.750 58.160 -0.410 18003
1000 1 2 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.154 0.706 18003
1001 1 2 . 1 1 69 69 LEU H H 70 8.375 8.375 8.035 0.340 18003
1002 1 2 . 1 1 70 70 ARG N N 71 122.498 122.498 119.958 2.540 18003
1003 1 2 . 1 1 70 70 ARG HA H 71 3.931 3.931 4.015 -0.084 18003
1004 1 2 . 1 1 70 70 ARG C C 71 180.499 180.499 178.491 2.008 18003
1005 1 2 . 1 1 70 70 ARG CA C 71 58.777 58.777 58.566 0.211 18003
1006 1 2 . 1 1 70 70 ARG CB C 71 30.155 30.155 29.488 0.667 18003
1007 1 2 . 1 1 70 70 ARG H H 71 8.822 8.822 8.287 0.535 18003
1008 1 2 . 1 1 71 71 ASN N N 72 121.816 121.816 117.207 4.609 18003
1009 1 2 . 1 1 71 71 ASN C C 72 177.170 177.170 177.932 -0.762 18003
1010 1 2 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.442 0.335 18003
1011 1 2 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.086 -0.352 18003
1012 1 2 . 1 1 71 71 ASN H H 72 8.144 8.144 7.830 0.314 18003
1013 1 2 . 1 1 72 72 LEU N N 73 117.044 117.044 117.771 -0.727 18003
1014 1 2 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.154 0.191 18003
1015 1 2 . 1 1 72 72 LEU C C 73 176.984 176.984 178.406 -1.422 18003
1016 1 2 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.468 -1.343 18003
1017 1 2 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.218 1.051 18003
1018 1 2 . 1 1 72 72 LEU H H 73 7.804 7.804 7.480 0.324 18003
1019 1 2 . 1 1 73 73 GLY N N 74 106.621 106.621 104.842 1.779 18003
1020 1 2 . 1 1 73 73 GLY C C 74 173.266 173.266 174.663 -1.397 18003
1021 1 2 . 1 1 73 73 GLY CA C 74 46.022 46.022 45.072 0.950 18003
1022 1 2 . 1 1 73 73 GLY H H 74 7.851 7.851 8.177 -0.326 18003
1023 1 2 . 1 1 74 74 LEU N N 75 114.582 114.582 121.357 -6.775 18003
1024 1 2 . 1 1 74 74 LEU C C 75 177.562 177.562 175.713 1.849 18003
1025 1 2 . 1 1 74 74 LEU CA C 75 56.031 56.031 56.105 -0.074 18003
1026 1 2 . 1 1 74 74 LEU CB C 75 44.444 44.444 43.147 1.297 18003
1027 1 2 . 1 1 74 74 LEU H H 75 7.808 7.808 7.772 0.036 18003
1028 1 2 . 1 1 75 75 VAL N N 76 110.980 110.980 111.267 -0.287 18003
1029 1 2 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.863 -0.336 18003
1030 1 2 . 1 1 75 75 VAL C C 76 173.922 173.922 174.049 -0.127 18003
1031 1 2 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.007 -2.064 18003
1032 1 2 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.674 0.355 18003
1033 1 2 . 1 1 75 75 VAL H H 76 7.079 7.079 7.325 -0.246 18003
1034 1 2 . 1 1 76 76 VAL N N 77 118.619 118.619 119.378 -0.759 18003
1035 1 2 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.475 0.827 18003
1036 1 2 . 1 1 76 76 VAL C C 77 174.041 174.041 174.409 -0.368 18003
1037 1 2 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.554 -0.555 18003
1038 1 2 . 1 1 76 76 VAL H H 77 9.024 9.024 9.176 -0.152 18003
1039 1 2 . 1 1 77 77 GLY N N 78 109.451 109.451 108.565 0.886 18003
1040 1 2 . 1 1 77 77 GLY C C 78 172.225 172.225 172.965 -0.740 18003
1041 1 2 . 1 1 77 77 GLY CA C 78 44.462 44.462 44.160 0.302 18003
1042 1 2 . 1 1 77 77 GLY H H 78 8.265 8.265 8.287 -0.022 18003
1043 1 2 . 1 1 78 78 ASP N N 79 122.826 122.826 122.879 -0.053 18003
1044 1 2 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.877 -0.131 18003
1045 1 2 . 1 1 78 78 ASP C C 79 174.817 174.817 175.426 -0.609 18003
1046 1 2 . 1 1 78 78 ASP CA C 79 53.111 53.111 53.059 0.052 18003
1047 1 2 . 1 1 78 78 ASP CB C 79 43.655 43.655 44.414 -0.759 18003
1048 1 2 . 1 1 78 78 ASP H H 79 8.479 8.479 8.673 -0.194 18003
1049 1 2 . 1 1 79 79 ARG N N 80 122.613 122.613 122.305 0.308 18003
1050 1 2 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.400 0.012 18003
1051 1 2 . 1 1 79 79 ARG C C 80 175.546 175.546 175.751 -0.205 18003
1052 1 2 . 1 1 79 79 ARG CA C 80 56.318 56.318 55.617 0.701 18003
1053 1 2 . 1 1 79 79 ARG CB C 80 30.376 30.376 30.531 -0.155 18003
1054 1 2 . 1 1 79 79 ARG H H 80 8.580 8.580 8.624 -0.044 18003
1055 1 2 . 1 1 80 80 ALA N N 81 129.263 129.263 129.767 -0.504 18003
1056 1 2 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.634 -0.182 18003
1057 1 2 . 1 1 80 80 ALA C C 81 177.126 177.126 177.304 -0.178 18003
1058 1 2 . 1 1 80 80 ALA CA C 81 51.620 51.620 50.880 0.740 18003
1059 1 2 . 1 1 80 80 ALA CB C 81 19.260 19.260 19.726 -0.466 18003
1060 1 2 . 1 1 80 80 ALA H H 81 8.396 8.396 8.065 0.331 18003
1061 1 2 . 1 1 81 81 GLY N N 82 112.739 112.739 112.432 0.307 18003
1062 1 2 . 1 1 81 81 GLY C C 82 174.856 174.856 176.132 -1.276 18003
1063 1 2 . 1 1 81 81 GLY CA C 82 46.392 46.392 47.332 -0.940 18003
1064 1 2 . 1 1 81 81 GLY H H 82 8.641 8.641 8.793 -0.152 18003
1065 1 2 . 1 1 82 82 ARG N N 83 124.780 124.780 121.725 3.055 18003
1066 1 2 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.094 0.229 18003
1067 1 2 . 1 1 82 82 ARG C C 83 176.339 176.339 176.716 -0.377 18003
1068 1 2 . 1 1 82 82 ARG CA C 83 56.690 56.690 58.207 -1.517 18003
1069 1 2 . 1 1 82 82 ARG CB C 83 30.221 30.221 30.477 -0.256 18003
1070 1 2 . 1 1 82 82 ARG H H 83 8.728 8.728 8.579 0.149 18003
1071 1 2 . 1 1 83 83 SER N N 84 114.678 114.678 109.584 5.094 18003
1072 1 2 . 1 1 83 83 SER C C 84 172.869 172.869 173.030 -0.161 18003
1073 1 2 . 1 1 83 83 SER CA C 84 56.834 56.834 56.955 -0.121 18003
1074 1 2 . 1 1 83 83 SER CB C 84 65.191 65.191 66.102 -0.911 18003
1075 1 2 . 1 1 83 83 SER H H 84 7.821 7.821 7.897 -0.076 18003
1076 1 2 . 1 1 84 84 ILE N N 85 122.996 122.996 118.627 4.369 18003
1077 1 2 . 1 1 84 84 ILE C C 85 175.521 175.521 175.011 0.510 18003
1078 1 2 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.858 0.377 18003
1079 1 2 . 1 1 84 84 ILE CB C 85 38.136 38.136 39.523 -1.387 18003
1080 1 2 . 1 1 84 84 ILE H H 85 8.232 8.232 8.243 -0.011 18003
1081 1 2 . 1 1 85 85 VAL N N 86 121.845 121.845 118.140 3.705 18003
1082 1 2 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.392 -0.082 18003
1083 1 2 . 1 1 85 85 VAL C C 86 174.818 174.818 174.086 0.732 18003
1084 1 2 . 1 1 85 85 VAL CA C 86 59.738 59.738 59.614 0.124 18003
1085 1 2 . 1 1 85 85 VAL CB C 86 34.221 34.221 35.138 -0.917 18003
1086 1 2 . 1 1 85 85 VAL H H 86 8.495 8.495 8.364 0.131 18003
1087 1 2 . 1 1 86 86 TYR N N 87 125.020 125.020 120.705 4.315 18003
1088 1 2 . 1 1 86 86 TYR HA H 87 4.319 4.319 5.128 -0.809 18003
1089 1 2 . 1 1 86 86 TYR C C 87 173.808 173.808 175.809 -2.001 18003
1090 1 2 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.334 0.131 18003
1091 1 2 . 1 1 86 86 TYR CB C 87 41.480 41.480 39.425 2.055 18003
1092 1 2 . 1 1 86 86 TYR H H 87 8.488 8.488 8.393 0.096 18003
1093 1 2 . 1 1 87 87 SER N N 88 110.681 110.681 115.175 -4.494 18003
1094 1 2 . 1 1 87 87 SER HA H 88 5.414 5.414 4.981 0.433 18003
1095 1 2 . 1 1 87 87 SER C C 88 174.693 174.693 173.427 1.266 18003
1096 1 2 . 1 1 87 87 SER CA C 88 56.113 56.113 55.995 0.117 18003
1097 1 2 . 1 1 87 87 SER CB C 88 66.309 66.309 66.186 0.123 18003
1098 1 2 . 1 1 87 87 SER H H 88 8.718 8.718 9.151 -0.433 18003
1099 1 2 . 1 1 88 88 LEU N N 89 119.612 119.612 121.889 -2.277 18003
1100 1 2 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.237 0.690 18003
1101 1 2 . 1 1 88 88 LEU C C 89 179.031 179.031 177.936 1.095 18003
1102 1 2 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.790 -0.465 18003
1103 1 2 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.375 -0.655 18003
1104 1 2 . 1 1 88 88 LEU H H 89 9.034 9.034 8.492 0.542 18003
1105 1 2 . 1 1 89 89 TYR N N 90 120.540 120.540 123.248 -2.708 18003
1106 1 2 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.146 0.476 18003
1107 1 2 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.755 0.957 18003
1108 1 2 . 1 1 89 89 TYR H H 90 8.075 8.075 8.317 -0.242 18003
1109 1 2 . 1 1 92 92 HIS C C 93 177.850 177.850 177.503 0.347 18003
1110 1 2 . 1 1 93 93 VAL N N 94 120.211 120.211 119.251 0.960 18003
1111 1 2 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.785 -0.284 18003
1112 1 2 . 1 1 93 93 VAL C C 94 176.785 176.785 177.500 -0.715 18003
1113 1 2 . 1 1 93 93 VAL CA C 94 66.666 66.666 65.939 0.727 18003
1114 1 2 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.154 0.483 18003
1115 1 2 . 1 1 93 93 VAL H H 94 8.164 8.164 7.951 0.213 18003
1116 1 2 . 1 1 94 94 ALA N N 95 119.221 119.221 119.782 -0.561 18003
1117 1 2 . 1 1 94 94 ALA HA H 95 3.790 3.790 4.060 -0.270 18003
1118 1 2 . 1 1 94 94 ALA C C 95 177.979 177.979 179.768 -1.789 18003
1119 1 2 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.120 0.359 18003
1120 1 2 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.177 -0.067 18003
1121 1 2 . 1 1 94 94 ALA H H 95 6.942 6.942 7.389 -0.447 18003
1122 1 2 . 1 1 95 95 GLN N N 96 115.416 115.416 119.613 -4.197 18003
1123 1 2 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.109 -0.074 18003
1124 1 2 . 1 1 95 95 GLN C C 96 177.993 177.993 178.331 -0.338 18003
1125 1 2 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.522 0.320 18003
1126 1 2 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.259 -0.230 18003
1127 1 2 . 1 1 95 95 GLN H H 96 7.795 7.795 7.939 -0.144 18003
1128 1 2 . 1 1 96 96 LEU N N 97 120.758 120.758 120.240 0.518 18003
1129 1 2 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.114 -0.265 18003
1130 1 2 . 1 1 96 96 LEU C C 97 177.974 177.974 179.403 -1.429 18003
1131 1 2 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.319 0.964 18003
1132 1 2 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.596 -0.550 18003
1133 1 2 . 1 1 96 96 LEU H H 97 8.197 8.197 7.904 0.293 18003
1134 1 2 . 1 1 97 97 LEU N N 98 117.567 117.567 119.806 -2.239 18003
1135 1 2 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.907 -0.077 18003
1136 1 2 . 1 1 97 97 LEU C C 98 178.219 178.219 179.114 -0.895 18003
1137 1 2 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.138 -0.408 18003
1138 1 2 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.128 0.734 18003
1139 1 2 . 1 1 97 97 LEU H H 98 7.660 7.660 8.233 -0.573 18003
1140 1 2 . 1 1 98 98 ASP N N 99 118.607 118.607 120.327 -1.720 18003
1141 1 2 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.402 -0.293 18003
1142 1 2 . 1 1 98 98 ASP C C 99 179.382 179.382 179.175 0.207 18003
1143 1 2 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.782 0.253 18003
1144 1 2 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.088 -0.249 18003
1145 1 2 . 1 1 98 98 ASP H H 99 8.295 8.295 8.469 -0.174 18003
1146 1 2 . 1 1 99 99 GLU N N 100 117.542 117.542 120.115 -2.573 18003
1147 1 2 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.227 -0.378 18003
1148 1 2 . 1 1 99 99 GLU C C 100 179.389 179.389 179.750 -0.361 18003
1149 1 2 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.191 -1.168 18003
1150 1 2 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.925 -0.896 18003
1151 1 2 . 1 1 99 99 GLU H H 100 8.334 8.334 8.012 0.322 18003
1152 1 2 . 1 1 100 100 ALA N N 101 122.890 122.890 124.332 -1.442 18003
1153 1 2 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.151 -0.153 18003
1154 1 2 . 1 1 100 100 ALA C C 101 180.184 180.184 179.576 0.608 18003
1155 1 2 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.469 0.051 18003
1156 1 2 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.486 -0.867 18003
1157 1 2 . 1 1 100 100 ALA H H 101 8.550 8.550 8.357 0.193 18003
1158 1 2 . 1 1 101 101 ILE N N 102 119.952 119.952 118.601 1.351 18003
1159 1 2 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.761 -0.172 18003
1160 1 2 . 1 1 101 101 ILE C C 102 178.114 178.114 177.698 0.416 18003
1161 1 2 . 1 1 101 101 ILE CA C 102 65.376 65.376 64.898 0.478 18003
1162 1 2 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.019 1.010 18003
1163 1 2 . 1 1 101 101 ILE H H 102 8.493 8.493 8.596 -0.103 18003
1164 1 2 . 1 1 102 102 TYR N N 103 120.625 120.625 122.301 -1.676 18003
1165 1 2 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.082 0.089 18003
1166 1 2 . 1 1 102 102 TYR C C 103 179.772 179.772 178.225 1.547 18003
1167 1 2 . 1 1 102 102 TYR CA C 103 60.724 60.724 61.818 -1.094 18003
1168 1 2 . 1 1 102 102 TYR CB C 103 37.500 37.500 38.110 -0.610 18003
1169 1 2 . 1 1 102 102 TYR H H 103 8.520 8.520 8.256 0.264 18003
1170 1 2 . 1 1 103 103 HIS N N 104 117.456 117.456 116.613 0.843 18003
1171 1 2 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.148 0.277 18003
1172 1 2 . 1 1 103 103 HIS C C 104 176.377 176.377 176.792 -0.415 18003
1173 1 2 . 1 1 103 103 HIS CA C 104 60.043 60.043 60.167 -0.124 18003
1174 1 2 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.876 -0.847 18003
1175 1 2 . 1 1 103 103 HIS H H 104 8.622 8.622 8.798 -0.176 18003
1176 1 2 . 1 1 104 104 SER N N 105 113.596 113.596 113.315 0.281 18003
1177 1 2 . 1 1 104 104 SER C C 105 176.712 176.712 176.565 0.147 18003
1178 1 2 . 1 1 104 104 SER CA C 105 61.852 61.852 60.271 1.581 18003
1179 1 2 . 1 1 104 104 SER CB C 105 63.550 63.550 63.815 -0.265 18003
1180 1 2 . 1 1 104 104 SER H H 105 7.900 7.900 7.978 -0.078 18003
1181 1 2 . 1 1 105 105 GLU N N 106 119.022 119.022 122.267 -3.245 18003
1182 1 2 . 1 1 105 105 GLU HA H 106 4.013 4.013 3.562 0.451 18003
1183 1 2 . 1 1 105 105 GLU C C 106 177.902 177.902 177.260 0.642 18003
1184 1 2 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.277 -0.246 18003
1185 1 2 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.500 -0.221 18003
1186 1 2 . 1 1 105 105 GLU H H 106 8.181 8.181 8.326 -0.145 18003
1187 1 2 . 1 1 106 106 HIS N N 107 116.482 116.482 115.964 0.518 18003
1188 1 2 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.248 0.159 18003
1189 1 2 . 1 1 106 106 HIS C C 107 175.575 175.575 174.783 0.792 18003
1190 1 2 . 1 1 106 106 HIS CA C 107 57.343 57.343 56.859 0.484 18003
1191 1 2 . 1 1 106 106 HIS CB C 107 28.580 28.580 30.167 -1.587 18003
1192 1 2 . 1 1 106 106 HIS H H 107 7.770 7.770 7.586 0.184 18003
1193 1 2 . 1 1 107 107 LEU N N 108 120.346 120.346 120.638 -0.292 18003
1194 1 2 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.537 -0.483 18003
1195 1 2 . 1 1 107 107 LEU C C 108 177.404 177.404 174.416 2.988 18003
1196 1 2 . 1 1 107 107 LEU CA C 108 55.991 55.991 55.685 0.306 18003
1197 1 2 . 1 1 107 107 LEU CB C 108 42.030 42.030 43.330 -1.300 18003
1198 1 2 . 1 1 107 107 LEU H H 108 7.682 7.682 7.491 0.191 18003
1199 1 2 . 1 1 108 108 HIS N N 109 117.222 117.222 119.929 -2.707 18003
1200 1 2 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.618 -0.564 18003
1201 1 2 . 1 1 108 108 HIS C C 109 174.606 174.606 174.272 0.334 18003
1202 1 2 . 1 1 108 108 HIS CA C 109 56.029 56.029 55.621 0.408 18003
1203 1 2 . 1 1 108 108 HIS CB C 109 28.517 28.517 29.441 -0.924 18003
1204 1 2 . 1 1 108 108 HIS H H 109 8.030 8.030 8.249 -0.219 18003
1205 1 2 . 1 1 109 109 LEU N N 110 121.114 121.114 122.057 -0.943 18003
1206 1 2 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.233 0.065 18003
1207 1 2 . 1 1 109 109 LEU C C 110 178.028 178.028 177.684 0.344 18003
1208 1 2 . 1 1 109 109 LEU CA C 110 55.574 55.574 56.311 -0.737 18003
1209 1 2 . 1 1 109 109 LEU CB C 110 42.076 42.076 42.254 -0.178 18003
1210 1 2 . 1 1 109 109 LEU H H 110 7.973 7.973 8.356 -0.383 18003
1211 1 2 . 1 1 110 110 GLY N N 111 108.631 108.631 106.865 1.766 18003
1212 1 2 . 1 1 110 110 GLY C C 111 174.606 174.606 173.374 1.232 18003
1213 1 2 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.391 1.189 18003
1214 1 2 . 1 1 110 110 GLY H H 111 8.255 8.255 7.927 0.328 18003
1215 1 2 . 1 1 111 111 LEU N N 112 121.022 121.022 122.821 -1.799 18003
1216 1 2 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.888 -0.529 18003
1217 1 2 . 1 1 111 111 LEU C C 112 177.701 177.701 177.083 0.618 18003
1218 1 2 . 1 1 111 111 LEU CA C 112 55.476 55.476 54.303 1.173 18003
1219 1 2 . 1 1 111 111 LEU CB C 112 41.899 41.899 44.323 -2.424 18003
1220 1 2 . 1 1 111 111 LEU H H 112 7.981 7.981 7.914 0.067 18003
1221 1 2 . 1 1 112 112 SER N N 113 115.471 115.471 121.541 -6.070 18003
1222 1 2 . 1 1 112 112 SER HA H 113 4.432 4.432 4.278 0.154 18003
1223 1 2 . 1 1 112 112 SER C C 113 174.381 174.381 174.529 -0.148 18003
1224 1 2 . 1 1 112 112 SER CA C 113 58.527 58.527 59.603 -1.076 18003
1225 1 2 . 1 1 112 112 SER CB C 113 63.593 63.593 63.493 0.099 18003
1226 1 2 . 1 1 112 112 SER H H 113 8.215 8.215 8.787 -0.572 18003
1227 1 2 . 1 1 113 113 ASP N N 114 121.696 121.696 121.022 0.674 18003
1228 1 2 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.431 -0.004 18003
1229 1 2 . 1 1 113 113 ASP C C 114 175.958 175.958 175.507 0.451 18003
1230 1 2 . 1 1 113 113 ASP CA C 114 54.213 54.213 54.251 -0.038 18003
1231 1 2 . 1 1 113 113 ASP CB C 114 41.030 41.030 40.485 0.545 18003
1232 1 2 . 1 1 113 113 ASP H H 114 8.203 8.203 8.254 -0.051 18003
1233 1 2 . 1 1 114 114 ARG N N 115 120.088 120.088 120.823 -0.735 18003
1234 1 2 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.101 0.171 18003
1235 1 2 . 1 1 114 114 ARG C C 115 175.792 175.792 175.373 0.419 18003
1236 1 2 . 1 1 114 114 ARG CA C 115 55.735 55.735 57.039 -1.304 18003
1237 1 2 . 1 1 114 114 ARG CB C 115 30.586 30.586 28.820 1.766 18003
1238 1 2 . 1 1 114 114 ARG H H 115 8.016 8.016 8.441 -0.425 18003
1239 1 2 . 1 1 115 115 HIS N N 116 120.597 120.597 125.016 -4.419 18003
1240 1 2 . 1 1 115 115 HIS CA C 116 53.697 53.697 57.365 -3.668 18003
1241 1 2 . 1 1 115 115 HIS CB C 116 29.299 29.299 29.742 -0.443 18003
1242 1 2 . 1 1 115 115 HIS H H 116 8.385 8.385 8.384 0.001 18003
1243 1 2 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.576 -0.094 18003
1244 1 2 . 1 1 116 116 PRO C C 117 177.090 177.090 176.288 0.802 18003
1245 1 2 . 1 1 116 116 PRO CA C 117 63.177 63.177 63.553 -0.376 18003
1246 1 2 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.347 -0.527 18003
1247 1 2 . 1 1 117 117 SER N N 118 116.220 116.220 116.456 -0.236 18003
1248 1 2 . 1 1 117 117 SER HA H 118 4.465 4.465 4.523 -0.058 18003
1249 1 2 . 1 1 117 117 SER C C 118 174.287 174.287 174.336 -0.049 18003
1250 1 2 . 1 1 117 117 SER CA C 118 58.110 58.110 58.372 -0.262 18003
1251 1 2 . 1 1 117 117 SER CB C 118 63.750 63.750 63.805 -0.055 18003
1252 1 2 . 1 1 117 117 SER H H 118 8.487 8.487 8.581 -0.094 18003
1253 1 2 . 1 1 118 118 ALA N N 119 126.082 126.082 125.066 1.016 18003
1254 1 2 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.443 -0.004 18003
1255 1 2 . 1 1 118 118 ALA C C 119 176.879 176.879 178.860 -1.981 18003
1256 1 2 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.249 0.200 18003
1257 1 2 . 1 1 118 118 ALA CB C 119 19.483 19.483 19.390 0.093 18003
1258 1 2 . 1 1 118 118 ALA H H 119 8.295 8.295 7.880 0.415 18003
1259 1 3 . 1 1 2 2 HIS C C 3 175.176 175.176 175.616 -0.440 18003
1260 1 3 . 1 1 2 2 HIS CA C 3 55.900 55.900 56.860 -0.960 18003
1261 1 3 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.673 -0.644 18003
1262 1 3 . 1 1 3 3 GLY N N 4 110.613 110.613 107.978 2.635 18003
1263 1 3 . 1 1 3 3 GLY C C 4 174.068 174.068 172.563 1.505 18003
1264 1 3 . 1 1 3 3 GLY CA C 4 45.141 45.141 45.191 -0.050 18003
1265 1 3 . 1 1 3 3 GLY H H 4 8.500 8.500 8.271 0.229 18003
1266 1 3 . 1 1 4 4 VAL N N 5 119.318 119.318 119.895 -0.577 18003
1267 1 3 . 1 1 4 4 VAL HA H 5 4.128 4.128 4.644 -0.516 18003
1268 1 3 . 1 1 4 4 VAL C C 5 176.361 176.361 175.287 1.074 18003
1269 1 3 . 1 1 4 4 VAL CA C 5 61.987 61.987 59.704 2.283 18003
1270 1 3 . 1 1 4 4 VAL CB C 5 32.635 32.635 34.556 -1.921 18003
1271 1 3 . 1 1 4 4 VAL H H 5 8.094 8.094 8.025 0.069 18003
1272 1 3 . 1 1 5 5 GLU N N 6 124.369 124.369 120.890 3.479 18003
1273 1 3 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.593 -0.305 18003
1274 1 3 . 1 1 5 5 GLU C C 6 177.012 177.012 176.427 0.585 18003
1275 1 3 . 1 1 5 5 GLU CA C 6 56.699 56.699 55.875 0.824 18003
1276 1 3 . 1 1 5 5 GLU CB C 6 30.029 30.029 30.752 -0.723 18003
1277 1 3 . 1 1 5 5 GLU H H 6 8.545 8.545 8.476 0.069 18003
1278 1 3 . 1 1 6 6 GLY N N 7 109.747 109.747 111.275 -1.528 18003
1279 1 3 . 1 1 6 6 GLY C C 7 174.117 174.117 174.371 -0.254 18003
1280 1 3 . 1 1 6 6 GLY CA C 7 45.568 45.568 44.560 1.008 18003
1281 1 3 . 1 1 6 6 GLY H H 7 8.352 8.352 8.558 -0.206 18003
1282 1 3 . 1 1 7 7 ARG N N 8 120.059 120.059 120.389 -0.330 18003
1283 1 3 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.244 0.098 18003
1284 1 3 . 1 1 7 7 ARG C C 8 176.016 176.016 176.307 -0.291 18003
1285 1 3 . 1 1 7 7 ARG CA C 8 55.833 55.833 56.440 -0.607 18003
1286 1 3 . 1 1 7 7 ARG CB C 8 30.444 30.444 30.766 -0.322 18003
1287 1 3 . 1 1 7 7 ARG H H 8 8.084 8.084 7.605 0.479 18003
1288 1 3 . 1 1 8 8 ASN N N 9 119.379 119.379 122.429 -3.050 18003
1289 1 3 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.785 -0.453 18003
1290 1 3 . 1 1 8 8 ASN C C 9 174.667 174.667 173.923 0.744 18003
1291 1 3 . 1 1 8 8 ASN CA C 9 53.441 53.441 53.187 0.255 18003
1292 1 3 . 1 1 8 8 ASN CB C 9 38.480 38.480 39.163 -0.683 18003
1293 1 3 . 1 1 8 8 ASN H H 9 8.411 8.411 8.530 -0.119 18003
1294 1 3 . 1 1 9 9 ARG N N 10 121.700 121.700 115.915 5.785 18003
1295 1 3 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.172 0.477 18003
1296 1 3 . 1 1 9 9 ARG CA C 10 53.147 53.147 56.081 -2.934 18003
1297 1 3 . 1 1 9 9 ARG CB C 10 30.197 30.197 27.863 2.334 18003
1298 1 3 . 1 1 9 9 ARG H H 10 8.138 8.138 8.724 -0.586 18003
1299 1 3 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.572 -0.129 18003
1300 1 3 . 1 1 10 10 PRO C C 11 176.815 176.815 176.577 0.238 18003
1301 1 3 . 1 1 10 10 PRO CA C 11 63.177 63.177 62.686 0.491 18003
1302 1 3 . 1 1 10 10 PRO CB C 11 31.820 31.820 30.525 1.295 18003
1303 1 3 . 1 1 11 11 SER N N 12 116.291 116.291 117.564 -1.273 18003
1304 1 3 . 1 1 11 11 SER HA H 12 4.418 4.418 4.401 0.017 18003
1305 1 3 . 1 1 11 11 SER C C 12 173.702 173.702 174.277 -0.575 18003
1306 1 3 . 1 1 11 11 SER CA C 12 58.031 58.031 58.864 -0.833 18003
1307 1 3 . 1 1 11 11 SER CB C 12 64.032 64.032 64.012 0.020 18003
1308 1 3 . 1 1 11 11 SER H H 12 8.325 8.325 7.842 0.483 18003
1309 1 3 . 1 1 12 12 ALA N N 13 126.862 126.862 125.821 1.041 18003
1310 1 3 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.624 -0.236 18003
1311 1 3 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.075 -0.617 18003
1312 1 3 . 1 1 12 12 ALA CB C 13 18.257 18.257 19.192 -0.935 18003
1313 1 3 . 1 1 12 12 ALA H H 13 8.166 8.166 8.400 -0.234 18003
1314 1 3 . 1 1 13 13 PRO C C 14 176.368 176.368 176.870 -0.502 18003
1315 1 3 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.443 0.494 18003
1316 1 3 . 1 1 13 13 PRO CB C 14 32.022 32.022 32.347 -0.325 18003
1317 1 3 . 1 1 14 14 LEU N N 15 120.969 120.969 117.775 3.194 18003
1318 1 3 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.608 -0.350 18003
1319 1 3 . 1 1 14 14 LEU C C 15 176.124 176.124 176.571 -0.447 18003
1320 1 3 . 1 1 14 14 LEU CA C 15 54.527 54.527 54.947 -0.420 18003
1321 1 3 . 1 1 14 14 LEU CB C 15 43.418 43.418 41.344 2.074 18003
1322 1 3 . 1 1 14 14 LEU H H 15 7.875 7.875 8.254 -0.379 18003
1323 1 3 . 1 1 15 15 ASP N N 16 121.780 121.780 121.292 0.488 18003
1324 1 3 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.701 -0.108 18003
1325 1 3 . 1 1 15 15 ASP C C 16 176.208 176.208 178.233 -2.025 18003
1326 1 3 . 1 1 15 15 ASP CA C 16 52.468 52.468 56.593 -4.125 18003
1327 1 3 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.530 1.099 18003
1328 1 3 . 1 1 15 15 ASP H H 16 7.850 7.850 8.387 -0.537 18003
1329 1 3 . 1 1 16 16 SER N N 17 114.435 114.435 115.666 -1.231 18003
1330 1 3 . 1 1 16 16 SER HA H 17 4.120 4.120 4.136 -0.016 18003
1331 1 3 . 1 1 16 16 SER C C 17 177.207 177.207 176.495 0.712 18003
1332 1 3 . 1 1 16 16 SER CA C 17 62.322 62.322 61.132 1.190 18003
1333 1 3 . 1 1 16 16 SER H H 17 8.658 8.658 8.315 0.343 18003
1334 1 3 . 1 1 17 17 GLN N N 18 122.403 122.403 121.249 1.154 18003
1335 1 3 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.022 0.175 18003
1336 1 3 . 1 1 17 17 GLN C C 18 178.715 178.715 178.071 0.644 18003
1337 1 3 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.781 -0.668 18003
1338 1 3 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.561 -0.521 18003
1339 1 3 . 1 1 17 17 GLN H H 18 8.140 8.140 8.264 -0.124 18003
1340 1 3 . 1 1 18 18 ALA N N 19 124.743 124.743 122.268 2.475 18003
1341 1 3 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.060 0.116 18003
1342 1 3 . 1 1 18 18 ALA C C 19 180.616 180.616 179.467 1.149 18003
1343 1 3 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.893 -0.288 18003
1344 1 3 . 1 1 18 18 ALA CB C 19 19.028 19.028 18.125 0.903 18003
1345 1 3 . 1 1 18 18 ALA H H 19 8.455 8.455 7.790 0.665 18003
1346 1 3 . 1 1 19 19 ALA N N 20 119.089 119.089 120.985 -1.896 18003
1347 1 3 . 1 1 19 19 ALA HA H 20 4.179 4.179 3.991 0.188 18003
1348 1 3 . 1 1 19 19 ALA C C 20 179.239 179.239 179.439 -0.200 18003
1349 1 3 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.941 0.330 18003
1350 1 3 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.272 -0.080 18003
1351 1 3 . 1 1 19 19 ALA H H 20 8.993 8.993 7.943 1.050 18003
1352 1 3 . 1 1 20 20 ALA N N 21 119.226 119.226 120.974 -1.748 18003
1353 1 3 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.915 0.145 18003
1354 1 3 . 1 1 20 20 ALA C C 21 180.230 180.230 180.026 0.204 18003
1355 1 3 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.128 0.015 18003
1356 1 3 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.111 -0.083 18003
1357 1 3 . 1 1 20 20 ALA H H 21 7.724 7.724 8.015 -0.291 18003
1358 1 3 . 1 1 21 21 GLN N N 22 119.310 119.310 118.321 0.989 18003
1359 1 3 . 1 1 21 21 GLN HA H 22 4.129 4.129 3.959 0.170 18003
1360 1 3 . 1 1 21 21 GLN C C 22 179.319 179.319 178.642 0.677 18003
1361 1 3 . 1 1 21 21 GLN CA C 22 58.762 58.762 58.967 -0.204 18003
1362 1 3 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.778 -0.749 18003
1363 1 3 . 1 1 21 21 GLN H H 22 7.638 7.638 8.394 -0.756 18003
1364 1 3 . 1 1 22 22 VAL N N 23 121.565 121.565 119.739 1.826 18003
1365 1 3 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.680 0.286 18003
1366 1 3 . 1 1 22 22 VAL C C 23 178.026 178.026 178.035 -0.009 18003
1367 1 3 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.042 0.100 18003
1368 1 3 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.049 -0.083 18003
1369 1 3 . 1 1 22 22 VAL H H 23 8.442 8.442 8.247 0.195 18003
1370 1 3 . 1 1 23 23 ALA N N 24 121.400 121.400 122.281 -0.881 18003
1371 1 3 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.958 0.138 18003
1372 1 3 . 1 1 23 23 ALA C C 24 178.758 178.758 180.085 -1.327 18003
1373 1 3 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.513 0.402 18003
1374 1 3 . 1 1 23 23 ALA CB C 24 16.650 16.650 18.181 -1.532 18003
1375 1 3 . 1 1 23 23 ALA H H 24 8.495 8.495 8.670 -0.175 18003
1376 1 3 . 1 1 24 24 SER N N 25 112.138 112.138 114.644 -2.506 18003
1377 1 3 . 1 1 24 24 SER HA H 25 4.093 4.093 4.147 -0.054 18003
1378 1 3 . 1 1 24 24 SER C C 25 177.271 177.271 176.767 0.504 18003
1379 1 3 . 1 1 24 24 SER CA C 25 62.166 62.166 62.311 -0.145 18003
1380 1 3 . 1 1 24 24 SER CB C 25 63.032 63.032 62.643 0.389 18003
1381 1 3 . 1 1 24 24 SER H H 25 7.936 7.936 8.140 -0.204 18003
1382 1 3 . 1 1 25 25 THR N N 26 119.701 119.701 119.459 0.242 18003
1383 1 3 . 1 1 25 25 THR HA H 26 4.380 4.380 4.035 0.345 18003
1384 1 3 . 1 1 25 25 THR C C 26 175.456 175.456 176.589 -1.133 18003
1385 1 3 . 1 1 25 25 THR CA C 26 67.129 67.129 67.084 0.045 18003
1386 1 3 . 1 1 25 25 THR CB C 26 68.800 68.800 68.742 0.058 18003
1387 1 3 . 1 1 25 25 THR H H 26 7.775 7.775 7.740 0.035 18003
1388 1 3 . 1 1 26 26 LEU N N 27 119.270 119.270 120.530 -1.260 18003
1389 1 3 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.068 -0.505 18003
1390 1 3 . 1 1 26 26 LEU C C 27 178.390 178.390 179.104 -0.714 18003
1391 1 3 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.294 0.375 18003
1392 1 3 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.383 0.647 18003
1393 1 3 . 1 1 26 26 LEU H H 27 8.006 8.006 8.292 -0.286 18003
1394 1 3 . 1 1 27 27 GLN N N 28 115.843 115.843 119.864 -4.021 18003
1395 1 3 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.047 -0.243 18003
1396 1 3 . 1 1 27 27 GLN C C 28 178.657 178.657 177.909 0.748 18003
1397 1 3 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.825 -0.113 18003
1398 1 3 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.927 -0.898 18003
1399 1 3 . 1 1 27 27 GLN H H 28 8.485 8.485 8.069 0.416 18003
1400 1 3 . 1 1 28 28 ALA N N 29 118.779 118.779 122.187 -3.408 18003
1401 1 3 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.045 -0.037 18003
1402 1 3 . 1 1 28 28 ALA C C 29 178.259 178.259 179.776 -1.517 18003
1403 1 3 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.634 -0.672 18003
1404 1 3 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.676 0.062 18003
1405 1 3 . 1 1 28 28 ALA H H 29 7.432 7.432 7.799 -0.367 18003
1406 1 3 . 1 1 29 29 LEU N N 30 113.442 113.442 117.556 -4.114 18003
1407 1 3 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.879 0.117 18003
1408 1 3 . 1 1 29 29 LEU C C 30 175.924 175.924 177.659 -1.735 18003
1409 1 3 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.924 -1.360 18003
1410 1 3 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.655 0.611 18003
1411 1 3 . 1 1 29 29 LEU H H 30 7.311 7.311 7.737 -0.426 18003
1412 1 3 . 1 1 30 30 ALA N N 31 119.563 119.563 119.892 -0.329 18003
1413 1 3 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.115 0.057 18003
1414 1 3 . 1 1 30 30 ALA C C 31 176.316 176.316 176.364 -0.048 18003
1415 1 3 . 1 1 30 30 ALA CA C 31 51.656 51.656 52.941 -1.285 18003
1416 1 3 . 1 1 30 30 ALA CB C 31 18.077 18.077 19.160 -1.083 18003
1417 1 3 . 1 1 30 30 ALA H H 31 7.223 7.223 7.203 0.020 18003
1418 1 3 . 1 1 31 31 THR N N 32 114.613 114.613 111.370 3.243 18003
1419 1 3 . 1 1 31 31 THR HA H 32 4.950 4.950 4.171 0.779 18003
1420 1 3 . 1 1 31 31 THR CA C 32 58.129 58.129 62.975 -4.846 18003
1421 1 3 . 1 1 31 31 THR CB C 32 69.098 69.098 68.556 0.542 18003
1422 1 3 . 1 1 31 31 THR H H 32 8.399 8.399 8.123 0.276 18003
1423 1 3 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.140 0.298 18003
1424 1 3 . 1 1 32 32 PRO C C 33 178.207 178.207 178.537 -0.330 18003
1425 1 3 . 1 1 32 32 PRO CA C 33 66.905 66.905 66.221 0.684 18003
1426 1 3 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.386 -0.122 18003
1427 1 3 . 1 1 33 33 SER N N 34 110.767 110.767 112.905 -2.138 18003
1428 1 3 . 1 1 33 33 SER HA H 34 4.026 4.026 4.144 -0.118 18003
1429 1 3 . 1 1 33 33 SER C C 34 176.742 176.742 176.852 -0.110 18003
1430 1 3 . 1 1 33 33 SER CA C 34 61.782 61.782 61.580 0.203 18003
1431 1 3 . 1 1 33 33 SER CB C 34 62.432 62.432 62.002 0.430 18003
1432 1 3 . 1 1 33 33 SER H H 34 8.407 8.407 8.390 0.017 18003
1433 1 3 . 1 1 34 34 ARG N N 35 120.135 120.135 120.666 -0.531 18003
1434 1 3 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.212 -0.158 18003
1435 1 3 . 1 1 34 34 ARG C C 35 178.283 178.283 178.657 -0.374 18003
1436 1 3 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.486 2.046 18003
1437 1 3 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.886 -0.933 18003
1438 1 3 . 1 1 34 34 ARG H H 35 7.341 7.341 7.700 -0.359 18003
1439 1 3 . 1 1 35 35 LEU N N 36 118.454 118.454 122.807 -4.353 18003
1440 1 3 . 1 1 35 35 LEU HA H 36 4.054 4.054 4.174 -0.120 18003
1441 1 3 . 1 1 35 35 LEU C C 36 180.643 180.643 178.945 1.698 18003
1442 1 3 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.055 -0.246 18003
1443 1 3 . 1 1 35 35 LEU CB C 36 41.778 41.778 41.684 0.094 18003
1444 1 3 . 1 1 35 35 LEU H H 36 8.226 8.226 8.173 0.053 18003
1445 1 3 . 1 1 36 36 MET N N 37 121.073 121.073 117.140 3.933 18003
1446 1 3 . 1 1 36 36 MET HA H 37 3.928 3.928 4.140 -0.212 18003
1447 1 3 . 1 1 36 36 MET C C 37 177.671 177.671 178.826 -1.155 18003
1448 1 3 . 1 1 36 36 MET CA C 37 60.613 60.613 59.335 1.278 18003
1449 1 3 . 1 1 36 36 MET CB C 37 33.128 33.128 32.106 1.022 18003
1450 1 3 . 1 1 36 36 MET H H 37 8.447 8.447 8.070 0.377 18003
1451 1 3 . 1 1 37 37 ILE N N 38 118.239 118.239 121.110 -2.871 18003
1452 1 3 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.730 -0.290 18003
1453 1 3 . 1 1 37 37 ILE C C 38 177.092 177.092 178.537 -1.445 18003
1454 1 3 . 1 1 37 37 ILE CA C 38 65.675 65.675 65.156 0.520 18003
1455 1 3 . 1 1 37 37 ILE CB C 38 38.255 38.255 37.720 0.535 18003
1456 1 3 . 1 1 37 37 ILE H H 38 7.763 7.763 7.827 -0.064 18003
1457 1 3 . 1 1 38 38 LEU N N 39 116.073 116.073 120.778 -4.705 18003
1458 1 3 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.969 -0.143 18003
1459 1 3 . 1 1 38 38 LEU C C 39 178.941 178.941 178.416 0.525 18003
1460 1 3 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.683 -0.652 18003
1461 1 3 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.947 -0.167 18003
1462 1 3 . 1 1 38 38 LEU H H 39 8.538 8.538 8.300 0.238 18003
1463 1 3 . 1 1 39 39 THR N N 40 106.678 106.678 116.211 -9.533 18003
1464 1 3 . 1 1 39 39 THR HA H 40 3.932 3.932 3.908 0.024 18003
1465 1 3 . 1 1 39 39 THR C C 40 177.747 177.747 176.857 0.890 18003
1466 1 3 . 1 1 39 39 THR CA C 40 65.536 65.536 67.194 -1.658 18003
1467 1 3 . 1 1 39 39 THR CB C 40 68.360 68.360 68.290 0.071 18003
1468 1 3 . 1 1 39 39 THR H H 40 8.086 8.086 8.397 -0.311 18003
1469 1 3 . 1 1 40 40 GLN N N 41 122.344 122.344 120.456 1.888 18003
1470 1 3 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.039 -0.033 18003
1471 1 3 . 1 1 40 40 GLN C C 41 178.348 178.348 178.631 -0.283 18003
1472 1 3 . 1 1 40 40 GLN CA C 41 57.925 57.925 59.008 -1.083 18003
1473 1 3 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.354 -0.834 18003
1474 1 3 . 1 1 40 40 GLN H H 41 7.593 7.593 7.958 -0.365 18003
1475 1 3 . 1 1 41 41 LEU N N 42 116.302 116.302 119.389 -3.087 18003
1476 1 3 . 1 1 41 41 LEU C C 42 178.418 178.418 180.024 -1.606 18003
1477 1 3 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.320 -1.789 18003
1478 1 3 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.894 -0.545 18003
1479 1 3 . 1 1 41 41 LEU H H 42 7.570 7.570 7.775 -0.205 18003
1480 1 3 . 1 1 42 42 ARG N N 43 119.954 119.954 119.458 0.496 18003
1481 1 3 . 1 1 42 42 ARG HA H 43 3.915 3.915 3.997 -0.082 18003
1482 1 3 . 1 1 42 42 ARG C C 43 177.205 177.205 178.784 -1.579 18003
1483 1 3 . 1 1 42 42 ARG CA C 43 58.704 58.704 59.125 -0.421 18003
1484 1 3 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.001 -0.558 18003
1485 1 3 . 1 1 42 42 ARG H H 43 7.612 7.612 8.424 -0.812 18003
1486 1 3 . 1 1 43 43 ASN N N 44 114.682 114.682 117.031 -2.349 18003
1487 1 3 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.553 0.207 18003
1488 1 3 . 1 1 43 43 ASN C C 44 174.507 174.507 175.398 -0.891 18003
1489 1 3 . 1 1 43 43 ASN CA C 44 53.953 53.953 54.899 -0.946 18003
1490 1 3 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.559 -0.529 18003
1491 1 3 . 1 1 43 43 ASN H H 44 7.567 7.567 8.036 -0.469 18003
1492 1 3 . 1 1 44 44 GLY N N 45 109.113 109.113 106.851 2.262 18003
1493 1 3 . 1 1 44 44 GLY CA C 45 44.268 44.268 44.537 -0.269 18003
1494 1 3 . 1 1 44 44 GLY H H 45 7.361 7.361 7.459 -0.098 18003
1495 1 3 . 1 1 45 45 PRO C C 46 178.412 178.412 176.320 2.092 18003
1496 1 3 . 1 1 45 45 PRO CA C 46 62.580 62.580 62.769 -0.189 18003
1497 1 3 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.997 1.132 18003
1498 1 3 . 1 1 46 46 LEU N N 47 120.363 120.363 118.168 2.195 18003
1499 1 3 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.816 0.215 18003
1500 1 3 . 1 1 46 46 LEU CA C 47 52.550 52.550 52.694 -0.144 18003
1501 1 3 . 1 1 46 46 LEU CB C 47 48.210 48.210 42.693 5.517 18003
1502 1 3 . 1 1 46 46 LEU H H 47 8.252 8.252 7.954 0.298 18003
1503 1 3 . 1 1 47 47 PRO C C 48 177.313 177.313 178.123 -0.810 18003
1504 1 3 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.592 -0.756 18003
1505 1 3 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.862 -0.479 18003
1506 1 3 . 1 1 48 48 VAL N N 49 119.384 119.384 117.344 2.040 18003
1507 1 3 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.770 -0.163 18003
1508 1 3 . 1 1 48 48 VAL C C 49 176.710 176.710 177.886 -1.176 18003
1509 1 3 . 1 1 48 48 VAL CA C 49 66.188 66.188 66.138 0.050 18003
1510 1 3 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.056 0.525 18003
1511 1 3 . 1 1 48 48 VAL H H 49 9.074 9.074 8.531 0.543 18003
1512 1 3 . 1 1 49 49 THR N N 50 111.293 111.293 115.714 -4.421 18003
1513 1 3 . 1 1 49 49 THR HA H 50 4.181 4.181 4.061 0.120 18003
1514 1 3 . 1 1 49 49 THR C C 50 176.717 176.717 176.630 0.087 18003
1515 1 3 . 1 1 49 49 THR CA C 50 65.063 65.063 66.917 -1.854 18003
1516 1 3 . 1 1 49 49 THR CB C 50 68.032 68.032 67.703 0.329 18003
1517 1 3 . 1 1 49 49 THR H H 50 7.848 7.848 8.354 -0.506 18003
1518 1 3 . 1 1 50 50 ASP N N 51 120.138 120.138 122.031 -1.893 18003
1519 1 3 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.472 -0.267 18003
1520 1 3 . 1 1 50 50 ASP C C 51 174.723 174.723 178.363 -3.640 18003
1521 1 3 . 1 1 50 50 ASP CA C 51 56.781 56.781 56.816 -0.035 18003
1522 1 3 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.527 0.584 18003
1523 1 3 . 1 1 50 50 ASP H H 51 7.108 7.108 8.358 -1.250 18003
1524 1 3 . 1 1 51 51 LEU N N 52 121.089 121.089 121.395 -0.306 18003
1525 1 3 . 1 1 51 51 LEU HA H 52 3.985 3.985 4.100 -0.115 18003
1526 1 3 . 1 1 51 51 LEU C C 52 177.089 177.089 178.446 -1.357 18003
1527 1 3 . 1 1 51 51 LEU CA C 52 58.161 58.161 58.028 0.133 18003
1528 1 3 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.163 0.618 18003
1529 1 3 . 1 1 51 51 LEU H H 52 7.943 7.943 8.006 -0.063 18003
1530 1 3 . 1 1 52 52 ALA N N 53 119.237 119.237 120.857 -1.620 18003
1531 1 3 . 1 1 52 52 ALA HA H 53 3.872 3.872 4.109 -0.237 18003
1532 1 3 . 1 1 52 52 ALA C C 53 179.466 179.466 180.165 -0.699 18003
1533 1 3 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.084 0.579 18003
1534 1 3 . 1 1 52 52 ALA CB C 53 17.619 17.619 18.058 -0.439 18003
1535 1 3 . 1 1 52 52 ALA H H 53 8.480 8.480 8.535 -0.055 18003
1536 1 3 . 1 1 53 53 GLU N N 54 115.655 115.655 119.742 -4.087 18003
1537 1 3 . 1 1 53 53 GLU HA H 54 4.054 4.054 4.048 0.006 18003
1538 1 3 . 1 1 53 53 GLU C C 54 179.073 179.073 178.420 0.653 18003
1539 1 3 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.776 0.051 18003
1540 1 3 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.692 -0.291 18003
1541 1 3 . 1 1 53 53 GLU H H 54 7.705 7.705 7.915 -0.210 18003
1542 1 3 . 1 1 54 54 ALA N N 55 120.276 120.276 121.318 -1.042 18003
1543 1 3 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.201 -0.064 18003
1544 1 3 . 1 1 54 54 ALA C C 55 179.771 179.771 177.837 1.934 18003
1545 1 3 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.255 0.406 18003
1546 1 3 . 1 1 54 54 ALA CB C 55 18.235 18.235 20.270 -2.035 18003
1547 1 3 . 1 1 54 54 ALA H H 55 7.928 7.928 7.952 -0.024 18003
1548 1 3 . 1 1 55 55 ILE N N 56 107.195 107.195 116.034 -8.839 18003
1549 1 3 . 1 1 55 55 ILE C C 56 176.053 176.053 173.658 2.395 18003
1550 1 3 . 1 1 55 55 ILE CA C 56 60.551 60.551 61.565 -1.014 18003
1551 1 3 . 1 1 55 55 ILE CB C 56 38.497 38.497 38.058 0.439 18003
1552 1 3 . 1 1 55 55 ILE H H 56 7.507 7.507 8.188 -0.681 18003
1553 1 3 . 1 1 56 56 GLY N N 57 111.108 111.108 112.808 -1.700 18003
1554 1 3 . 1 1 56 56 GLY C C 57 174.421 174.421 174.480 -0.059 18003
1555 1 3 . 1 1 56 56 GLY CA C 57 46.960 46.960 46.208 0.752 18003
1556 1 3 . 1 1 56 56 GLY H H 57 7.757 7.757 7.924 -0.167 18003
1557 1 3 . 1 1 57 57 MET N N 58 118.089 118.089 118.453 -0.364 18003
1558 1 3 . 1 1 57 57 MET HA H 58 3.933 3.933 4.010 -0.077 18003
1559 1 3 . 1 1 57 57 MET C C 58 174.157 174.157 174.892 -0.735 18003
1560 1 3 . 1 1 57 57 MET CA C 58 54.091 54.091 56.596 -2.505 18003
1561 1 3 . 1 1 57 57 MET CB C 58 38.062 38.062 31.610 6.452 18003
1562 1 3 . 1 1 57 57 MET H H 58 7.659 7.659 7.572 0.087 18003
1563 1 3 . 1 1 58 58 GLU N N 59 121.656 121.656 118.321 3.335 18003
1564 1 3 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.492 -0.152 18003
1565 1 3 . 1 1 58 58 GLU C C 59 178.355 178.355 175.907 2.448 18003
1566 1 3 . 1 1 58 58 GLU CA C 59 56.643 56.643 55.898 0.745 18003
1567 1 3 . 1 1 58 58 GLU CB C 59 30.029 30.029 30.940 -0.911 18003
1568 1 3 . 1 1 58 58 GLU H H 59 8.523 8.523 8.053 0.470 18003
1569 1 3 . 1 1 59 59 GLN N N 60 123.686 123.686 123.306 0.380 18003
1570 1 3 . 1 1 59 59 GLN HA H 60 4.214 4.214 4.150 0.064 18003
1571 1 3 . 1 1 59 59 GLN C C 60 177.961 177.961 176.993 0.968 18003
1572 1 3 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.038 2.579 18003
1573 1 3 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.698 0.317 18003
1574 1 3 . 1 1 59 59 GLN H H 60 9.009 9.009 8.764 0.245 18003
1575 1 3 . 1 1 60 60 SER N N 61 115.101 115.101 116.172 -1.071 18003
1576 1 3 . 1 1 60 60 SER C C 61 176.801 176.801 176.264 0.537 18003
1577 1 3 . 1 1 60 60 SER CA C 61 61.213 61.213 60.794 0.419 18003
1578 1 3 . 1 1 60 60 SER H H 61 8.964 8.964 8.324 0.640 18003
1579 1 3 . 1 1 61 61 ALA N N 62 126.069 126.069 123.798 2.271 18003
1580 1 3 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.171 0.180 18003
1581 1 3 . 1 1 61 61 ALA C C 62 180.635 180.635 179.781 0.854 18003
1582 1 3 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.681 -0.423 18003
1583 1 3 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.314 0.309 18003
1584 1 3 . 1 1 61 61 ALA H H 62 7.103 7.103 8.233 -1.130 18003
1585 1 3 . 1 1 62 62 VAL N N 63 119.252 119.252 119.086 0.166 18003
1586 1 3 . 1 1 62 62 VAL C C 63 177.842 177.842 177.914 -0.072 18003
1587 1 3 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.691 0.107 18003
1588 1 3 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.617 -0.353 18003
1589 1 3 . 1 1 62 62 VAL H H 63 7.971 7.971 7.414 0.557 18003
1590 1 3 . 1 1 63 63 SER N N 64 115.494 115.494 115.507 -0.013 18003
1591 1 3 . 1 1 63 63 SER HA H 64 4.034 4.034 3.914 0.120 18003
1592 1 3 . 1 1 63 63 SER C C 64 176.835 176.835 176.696 0.139 18003
1593 1 3 . 1 1 63 63 SER CA C 64 62.400 62.400 62.265 0.135 18003
1594 1 3 . 1 1 63 63 SER CB C 64 62.752 62.752 62.804 -0.052 18003
1595 1 3 . 1 1 63 63 SER H H 64 8.743 8.743 8.229 0.514 18003
1596 1 3 . 1 1 64 64 HIS N N 65 120.010 120.010 122.721 -2.711 18003
1597 1 3 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.327 0.033 18003
1598 1 3 . 1 1 64 64 HIS C C 65 177.731 177.731 177.545 0.186 18003
1599 1 3 . 1 1 64 64 HIS CA C 65 59.998 59.998 60.390 -0.392 18003
1600 1 3 . 1 1 64 64 HIS CB C 65 29.934 29.934 30.187 -0.253 18003
1601 1 3 . 1 1 64 64 HIS H H 65 7.804 7.804 8.139 -0.335 18003
1602 1 3 . 1 1 65 65 GLN N N 66 115.590 115.590 118.360 -2.770 18003
1603 1 3 . 1 1 65 65 GLN HA H 66 4.035 4.035 4.078 -0.043 18003
1604 1 3 . 1 1 65 65 GLN C C 66 179.055 179.055 178.573 0.482 18003
1605 1 3 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.517 -0.987 18003
1606 1 3 . 1 1 65 65 GLN H H 66 7.751 7.751 8.194 -0.443 18003
1607 1 3 . 1 1 66 66 LEU N N 67 118.746 118.746 121.672 -2.926 18003
1608 1 3 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.922 0.025 18003
1609 1 3 . 1 1 66 66 LEU C C 67 178.334 178.334 178.355 -0.021 18003
1610 1 3 . 1 1 66 66 LEU CA C 67 57.846 57.846 58.092 -0.246 18003
1611 1 3 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.770 -0.667 18003
1612 1 3 . 1 1 66 66 LEU H H 67 8.648 8.648 8.589 0.059 18003
1613 1 3 . 1 1 67 67 ARG N N 68 119.610 119.610 119.319 0.291 18003
1614 1 3 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.891 0.052 18003
1615 1 3 . 1 1 67 67 ARG C C 68 178.807 178.807 178.585 0.222 18003
1616 1 3 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.657 -0.281 18003
1617 1 3 . 1 1 67 67 ARG CB C 68 29.475 29.475 29.997 -0.522 18003
1618 1 3 . 1 1 67 67 ARG H H 68 7.607 7.607 7.849 -0.242 18003
1619 1 3 . 1 1 68 68 VAL N N 69 119.719 119.719 119.910 -0.191 18003
1620 1 3 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.612 0.021 18003
1621 1 3 . 1 1 68 68 VAL C C 69 178.690 178.690 178.110 0.580 18003
1622 1 3 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.679 -0.225 18003
1623 1 3 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.597 0.182 18003
1624 1 3 . 1 1 68 68 VAL H H 69 7.259 7.259 7.710 -0.451 18003
1625 1 3 . 1 1 69 69 LEU N N 70 117.532 117.532 118.957 -1.425 18003
1626 1 3 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.893 0.055 18003
1627 1 3 . 1 1 69 69 LEU C C 70 179.144 179.144 178.981 0.163 18003
1628 1 3 . 1 1 69 69 LEU CA C 70 57.750 57.750 58.001 -0.251 18003
1629 1 3 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.245 0.615 18003
1630 1 3 . 1 1 69 69 LEU H H 70 8.375 8.375 8.402 -0.027 18003
1631 1 3 . 1 1 70 70 ARG N N 71 122.498 122.498 119.857 2.641 18003
1632 1 3 . 1 1 70 70 ARG HA H 71 3.931 3.931 3.990 -0.059 18003
1633 1 3 . 1 1 70 70 ARG C C 71 180.499 180.499 178.751 1.748 18003
1634 1 3 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.428 -0.652 18003
1635 1 3 . 1 1 70 70 ARG CB C 71 30.155 30.155 30.023 0.132 18003
1636 1 3 . 1 1 70 70 ARG H H 71 8.822 8.822 8.465 0.357 18003
1637 1 3 . 1 1 71 71 ASN N N 72 121.816 121.816 118.132 3.684 18003
1638 1 3 . 1 1 71 71 ASN C C 72 177.170 177.170 177.359 -0.189 18003
1639 1 3 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.578 0.199 18003
1640 1 3 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.208 -0.474 18003
1641 1 3 . 1 1 71 71 ASN H H 72 8.144 8.144 7.744 0.400 18003
1642 1 3 . 1 1 72 72 LEU N N 73 117.044 117.044 118.321 -1.277 18003
1643 1 3 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.269 0.076 18003
1644 1 3 . 1 1 72 72 LEU C C 73 176.984 176.984 178.150 -1.166 18003
1645 1 3 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.164 -1.039 18003
1646 1 3 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.503 0.766 18003
1647 1 3 . 1 1 72 72 LEU H H 73 7.804 7.804 7.647 0.157 18003
1648 1 3 . 1 1 73 73 GLY N N 74 106.621 106.621 104.910 1.711 18003
1649 1 3 . 1 1 73 73 GLY C C 74 173.266 173.266 174.754 -1.488 18003
1650 1 3 . 1 1 73 73 GLY CA C 74 46.022 46.022 45.224 0.798 18003
1651 1 3 . 1 1 73 73 GLY H H 74 7.851 7.851 8.363 -0.512 18003
1652 1 3 . 1 1 74 74 LEU N N 75 114.582 114.582 119.304 -4.722 18003
1653 1 3 . 1 1 74 74 LEU C C 75 177.562 177.562 176.445 1.117 18003
1654 1 3 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.656 0.375 18003
1655 1 3 . 1 1 74 74 LEU CB C 75 44.444 44.444 43.011 1.433 18003
1656 1 3 . 1 1 74 74 LEU H H 75 7.808 7.808 8.085 -0.277 18003
1657 1 3 . 1 1 75 75 VAL N N 76 110.980 110.980 112.806 -1.826 18003
1658 1 3 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.689 -0.163 18003
1659 1 3 . 1 1 75 75 VAL C C 76 173.922 173.922 174.120 -0.198 18003
1660 1 3 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.518 -2.575 18003
1661 1 3 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.562 0.467 18003
1662 1 3 . 1 1 75 75 VAL H H 76 7.079 7.079 7.365 -0.286 18003
1663 1 3 . 1 1 76 76 VAL N N 77 118.619 118.619 120.775 -2.156 18003
1664 1 3 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.455 0.847 18003
1665 1 3 . 1 1 76 76 VAL C C 77 174.041 174.041 174.309 -0.268 18003
1666 1 3 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.599 -0.600 18003
1667 1 3 . 1 1 76 76 VAL H H 77 9.024 9.024 9.206 -0.182 18003
1668 1 3 . 1 1 77 77 GLY N N 78 109.451 109.451 110.113 -0.662 18003
1669 1 3 . 1 1 77 77 GLY C C 78 172.225 172.225 172.901 -0.676 18003
1670 1 3 . 1 1 77 77 GLY CA C 78 44.462 44.462 44.208 0.254 18003
1671 1 3 . 1 1 77 77 GLY H H 78 8.265 8.265 8.385 -0.120 18003
1672 1 3 . 1 1 78 78 ASP N N 79 122.826 122.826 124.159 -1.333 18003
1673 1 3 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.744 0.002 18003
1674 1 3 . 1 1 78 78 ASP C C 79 174.817 174.817 175.185 -0.368 18003
1675 1 3 . 1 1 78 78 ASP CA C 79 53.111 53.111 53.415 -0.304 18003
1676 1 3 . 1 1 78 78 ASP CB C 79 43.655 43.655 42.915 0.740 18003
1677 1 3 . 1 1 78 78 ASP H H 79 8.479 8.479 8.614 -0.135 18003
1678 1 3 . 1 1 79 79 ARG N N 80 122.613 122.613 126.392 -3.779 18003
1679 1 3 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.144 0.268 18003
1680 1 3 . 1 1 79 79 ARG C C 80 175.546 175.546 174.917 0.629 18003
1681 1 3 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.369 -0.051 18003
1682 1 3 . 1 1 79 79 ARG CB C 80 30.376 30.376 30.909 -0.533 18003
1683 1 3 . 1 1 79 79 ARG H H 80 8.580 8.580 8.714 -0.134 18003
1684 1 3 . 1 1 80 80 ALA N N 81 129.263 129.263 130.016 -0.753 18003
1685 1 3 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.679 -0.227 18003
1686 1 3 . 1 1 80 80 ALA C C 81 177.126 177.126 176.721 0.405 18003
1687 1 3 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.190 0.430 18003
1688 1 3 . 1 1 80 80 ALA CB C 81 19.260 19.260 21.248 -1.988 18003
1689 1 3 . 1 1 80 80 ALA H H 81 8.396 8.396 8.919 -0.523 18003
1690 1 3 . 1 1 81 81 GLY N N 82 112.739 112.739 110.822 1.917 18003
1691 1 3 . 1 1 81 81 GLY C C 82 174.856 174.856 175.019 -0.163 18003
1692 1 3 . 1 1 81 81 GLY CA C 82 46.392 46.392 46.921 -0.529 18003
1693 1 3 . 1 1 81 81 GLY H H 82 8.641 8.641 8.598 0.043 18003
1694 1 3 . 1 1 82 82 ARG N N 83 124.780 124.780 123.626 1.154 18003
1695 1 3 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.601 -0.278 18003
1696 1 3 . 1 1 82 82 ARG C C 83 176.339 176.339 175.079 1.260 18003
1697 1 3 . 1 1 82 82 ARG CA C 83 56.690 56.690 55.797 0.893 18003
1698 1 3 . 1 1 82 82 ARG CB C 83 30.221 30.221 30.939 -0.718 18003
1699 1 3 . 1 1 82 82 ARG H H 83 8.728 8.728 8.595 0.133 18003
1700 1 3 . 1 1 83 83 SER N N 84 114.678 114.678 115.031 -0.353 18003
1701 1 3 . 1 1 83 83 SER C C 84 172.869 172.869 171.776 1.093 18003
1702 1 3 . 1 1 83 83 SER CA C 84 56.834 56.834 57.978 -1.144 18003
1703 1 3 . 1 1 83 83 SER CB C 84 65.191 65.191 66.829 -1.638 18003
1704 1 3 . 1 1 83 83 SER H H 84 7.821 7.821 8.383 -0.562 18003
1705 1 3 . 1 1 84 84 ILE N N 85 122.996 122.996 122.877 0.119 18003
1706 1 3 . 1 1 84 84 ILE C C 85 175.521 175.521 174.123 1.398 18003
1707 1 3 . 1 1 84 84 ILE CA C 85 60.235 60.235 58.484 1.751 18003
1708 1 3 . 1 1 84 84 ILE CB C 85 38.136 38.136 41.622 -3.486 18003
1709 1 3 . 1 1 84 84 ILE H H 85 8.232 8.232 8.297 -0.065 18003
1710 1 3 . 1 1 85 85 VAL N N 86 121.845 121.845 118.226 3.619 18003
1711 1 3 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.373 -0.063 18003
1712 1 3 . 1 1 85 85 VAL C C 86 174.818 174.818 173.804 1.014 18003
1713 1 3 . 1 1 85 85 VAL CA C 86 59.738 59.738 59.558 0.180 18003
1714 1 3 . 1 1 85 85 VAL CB C 86 34.221 34.221 34.638 -0.417 18003
1715 1 3 . 1 1 85 85 VAL H H 86 8.495 8.495 8.219 0.276 18003
1716 1 3 . 1 1 86 86 TYR N N 87 125.020 125.020 122.033 2.987 18003
1717 1 3 . 1 1 86 86 TYR HA H 87 4.319 4.319 5.149 -0.830 18003
1718 1 3 . 1 1 86 86 TYR C C 87 173.808 173.808 175.825 -2.017 18003
1719 1 3 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.203 0.262 18003
1720 1 3 . 1 1 86 86 TYR CB C 87 41.480 41.480 40.061 1.419 18003
1721 1 3 . 1 1 86 86 TYR H H 87 8.488 8.488 8.348 0.140 18003
1722 1 3 . 1 1 87 87 SER N N 88 110.681 110.681 114.856 -4.175 18003
1723 1 3 . 1 1 87 87 SER HA H 88 5.414 5.414 4.903 0.511 18003
1724 1 3 . 1 1 87 87 SER C C 88 174.693 174.693 173.087 1.606 18003
1725 1 3 . 1 1 87 87 SER CA C 88 56.113 56.113 57.264 -1.151 18003
1726 1 3 . 1 1 87 87 SER CB C 88 66.309 66.309 67.202 -0.893 18003
1727 1 3 . 1 1 87 87 SER H H 88 8.718 8.718 9.293 -0.575 18003
1728 1 3 . 1 1 88 88 LEU N N 89 119.612 119.612 122.579 -2.967 18003
1729 1 3 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.245 0.682 18003
1730 1 3 . 1 1 88 88 LEU C C 89 179.031 179.031 177.792 1.239 18003
1731 1 3 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.971 -0.646 18003
1732 1 3 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.277 -0.557 18003
1733 1 3 . 1 1 88 88 LEU H H 89 9.034 9.034 8.538 0.496 18003
1734 1 3 . 1 1 89 89 TYR N N 90 120.540 120.540 123.625 -3.085 18003
1735 1 3 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.172 0.450 18003
1736 1 3 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.965 0.747 18003
1737 1 3 . 1 1 89 89 TYR H H 90 8.075 8.075 8.338 -0.263 18003
1738 1 3 . 1 1 92 92 HIS C C 93 177.850 177.850 177.764 0.086 18003
1739 1 3 . 1 1 93 93 VAL N N 94 120.211 120.211 115.419 4.792 18003
1740 1 3 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.708 -0.207 18003
1741 1 3 . 1 1 93 93 VAL C C 94 176.785 176.785 177.308 -0.523 18003
1742 1 3 . 1 1 93 93 VAL CA C 94 66.666 66.666 65.521 1.145 18003
1743 1 3 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.212 0.425 18003
1744 1 3 . 1 1 93 93 VAL H H 94 8.164 8.164 8.008 0.156 18003
1745 1 3 . 1 1 94 94 ALA N N 95 119.221 119.221 122.099 -2.878 18003
1746 1 3 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.914 -0.124 18003
1747 1 3 . 1 1 94 94 ALA C C 95 177.979 177.979 179.603 -1.624 18003
1748 1 3 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.118 0.361 18003
1749 1 3 . 1 1 94 94 ALA CB C 95 18.110 18.110 17.996 0.114 18003
1750 1 3 . 1 1 94 94 ALA H H 95 6.942 6.942 7.925 -0.983 18003
1751 1 3 . 1 1 95 95 GLN N N 96 115.416 115.416 119.036 -3.620 18003
1752 1 3 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.077 -0.042 18003
1753 1 3 . 1 1 95 95 GLN C C 96 177.993 177.993 178.298 -0.305 18003
1754 1 3 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.546 0.296 18003
1755 1 3 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.496 -0.467 18003
1756 1 3 . 1 1 95 95 GLN H H 96 7.795 7.795 8.173 -0.378 18003
1757 1 3 . 1 1 96 96 LEU N N 97 120.758 120.758 121.574 -0.816 18003
1758 1 3 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.074 -0.225 18003
1759 1 3 . 1 1 96 96 LEU C C 97 177.974 177.974 178.722 -0.748 18003
1760 1 3 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.245 1.038 18003
1761 1 3 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.820 -0.774 18003
1762 1 3 . 1 1 96 96 LEU H H 97 8.197 8.197 7.825 0.372 18003
1763 1 3 . 1 1 97 97 LEU N N 98 117.567 117.567 119.032 -1.465 18003
1764 1 3 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.998 -0.168 18003
1765 1 3 . 1 1 97 97 LEU C C 98 178.219 178.219 179.267 -1.048 18003
1766 1 3 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.258 -0.528 18003
1767 1 3 . 1 1 97 97 LEU CB C 98 41.862 41.862 40.221 1.641 18003
1768 1 3 . 1 1 97 97 LEU H H 98 7.660 7.660 8.274 -0.614 18003
1769 1 3 . 1 1 98 98 ASP N N 99 118.607 118.607 120.222 -1.615 18003
1770 1 3 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.356 -0.247 18003
1771 1 3 . 1 1 98 98 ASP C C 99 179.382 179.382 178.912 0.470 18003
1772 1 3 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.843 0.192 18003
1773 1 3 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.600 -0.761 18003
1774 1 3 . 1 1 98 98 ASP H H 99 8.295 8.295 8.282 0.013 18003
1775 1 3 . 1 1 99 99 GLU N N 100 117.542 117.542 119.864 -2.322 18003
1776 1 3 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.195 -0.346 18003
1777 1 3 . 1 1 99 99 GLU C C 100 179.389 179.389 178.991 0.398 18003
1778 1 3 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.286 -1.263 18003
1779 1 3 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.353 -0.324 18003
1780 1 3 . 1 1 99 99 GLU H H 100 8.334 8.334 8.024 0.310 18003
1781 1 3 . 1 1 100 100 ALA N N 101 122.890 122.890 122.944 -0.054 18003
1782 1 3 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.119 -0.121 18003
1783 1 3 . 1 1 100 100 ALA C C 101 180.184 180.184 179.724 0.460 18003
1784 1 3 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.481 0.039 18003
1785 1 3 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.482 -0.863 18003
1786 1 3 . 1 1 100 100 ALA H H 101 8.550 8.550 8.130 0.420 18003
1787 1 3 . 1 1 101 101 ILE N N 102 119.952 119.952 118.827 1.125 18003
1788 1 3 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.754 -0.165 18003
1789 1 3 . 1 1 101 101 ILE C C 102 178.114 178.114 177.715 0.399 18003
1790 1 3 . 1 1 101 101 ILE CA C 102 65.376 65.376 65.013 0.363 18003
1791 1 3 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.048 0.980 18003
1792 1 3 . 1 1 101 101 ILE H H 102 8.493 8.493 8.665 -0.172 18003
1793 1 3 . 1 1 102 102 TYR N N 103 120.625 120.625 121.743 -1.118 18003
1794 1 3 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.112 0.059 18003
1795 1 3 . 1 1 102 102 TYR C C 103 179.772 179.772 177.954 1.818 18003
1796 1 3 . 1 1 102 102 TYR CA C 103 60.724 60.724 61.906 -1.182 18003
1797 1 3 . 1 1 102 102 TYR CB C 103 37.500 37.500 38.350 -0.850 18003
1798 1 3 . 1 1 102 102 TYR H H 103 8.520 8.520 8.401 0.119 18003
1799 1 3 . 1 1 103 103 HIS N N 104 117.456 117.456 118.472 -1.016 18003
1800 1 3 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.216 0.209 18003
1801 1 3 . 1 1 103 103 HIS C C 104 176.377 176.377 177.327 -0.950 18003
1802 1 3 . 1 1 103 103 HIS CA C 104 60.043 60.043 59.150 0.893 18003
1803 1 3 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.726 -0.697 18003
1804 1 3 . 1 1 103 103 HIS H H 104 8.622 8.622 8.880 -0.258 18003
1805 1 3 . 1 1 104 104 SER N N 105 113.596 113.596 113.584 0.012 18003
1806 1 3 . 1 1 104 104 SER C C 105 176.712 176.712 176.335 0.377 18003
1807 1 3 . 1 1 104 104 SER CA C 105 61.852 61.852 60.455 1.397 18003
1808 1 3 . 1 1 104 104 SER CB C 105 63.550 63.550 63.321 0.229 18003
1809 1 3 . 1 1 104 104 SER H H 105 7.900 7.900 7.957 -0.057 18003
1810 1 3 . 1 1 105 105 GLU N N 106 119.022 119.022 120.416 -1.394 18003
1811 1 3 . 1 1 105 105 GLU HA H 106 4.013 4.013 3.939 0.074 18003
1812 1 3 . 1 1 105 105 GLU C C 106 177.902 177.902 178.093 -0.191 18003
1813 1 3 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.614 -0.583 18003
1814 1 3 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.713 -0.434 18003
1815 1 3 . 1 1 105 105 GLU H H 106 8.181 8.181 8.097 0.084 18003
1816 1 3 . 1 1 106 106 HIS N N 107 116.482 116.482 118.012 -1.530 18003
1817 1 3 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.152 0.255 18003
1818 1 3 . 1 1 106 106 HIS C C 107 175.575 175.575 175.903 -0.328 18003
1819 1 3 . 1 1 106 106 HIS CA C 107 57.343 57.343 58.320 -0.977 18003
1820 1 3 . 1 1 106 106 HIS CB C 107 28.580 28.580 30.009 -1.429 18003
1821 1 3 . 1 1 106 106 HIS H H 107 7.770 7.770 7.697 0.073 18003
1822 1 3 . 1 1 107 107 LEU N N 108 120.346 120.346 115.345 5.001 18003
1823 1 3 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.431 -0.377 18003
1824 1 3 . 1 1 107 107 LEU C C 108 177.404 177.404 175.078 2.326 18003
1825 1 3 . 1 1 107 107 LEU CA C 108 55.991 55.991 54.055 1.936 18003
1826 1 3 . 1 1 107 107 LEU CB C 108 42.030 42.030 43.451 -1.421 18003
1827 1 3 . 1 1 107 107 LEU H H 108 7.682 7.682 7.776 -0.094 18003
1828 1 3 . 1 1 108 108 HIS N N 109 117.222 117.222 113.486 3.736 18003
1829 1 3 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.719 -0.665 18003
1830 1 3 . 1 1 108 108 HIS C C 109 174.606 174.606 175.946 -1.340 18003
1831 1 3 . 1 1 108 108 HIS CA C 109 56.029 56.029 55.081 0.948 18003
1832 1 3 . 1 1 108 108 HIS CB C 109 28.517 28.517 30.908 -2.391 18003
1833 1 3 . 1 1 108 108 HIS H H 109 8.030 8.030 7.662 0.368 18003
1834 1 3 . 1 1 109 109 LEU N N 110 121.114 121.114 122.963 -1.849 18003
1835 1 3 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.050 0.248 18003
1836 1 3 . 1 1 109 109 LEU C C 110 178.028 178.028 178.468 -0.440 18003
1837 1 3 . 1 1 109 109 LEU CA C 110 55.574 55.574 56.224 -0.649 18003
1838 1 3 . 1 1 109 109 LEU CB C 110 42.076 42.076 40.779 1.297 18003
1839 1 3 . 1 1 109 109 LEU H H 110 7.973 7.973 8.965 -0.992 18003
1840 1 3 . 1 1 110 110 GLY N N 111 108.631 108.631 106.827 1.804 18003
1841 1 3 . 1 1 110 110 GLY C C 111 174.606 174.606 175.231 -0.625 18003
1842 1 3 . 1 1 110 110 GLY CA C 111 45.580 45.580 45.802 -0.222 18003
1843 1 3 . 1 1 110 110 GLY H H 111 8.255 8.255 8.415 -0.160 18003
1844 1 3 . 1 1 111 111 LEU N N 112 121.022 121.022 120.560 0.462 18003
1845 1 3 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.298 0.061 18003
1846 1 3 . 1 1 111 111 LEU C C 112 177.701 177.701 177.810 -0.109 18003
1847 1 3 . 1 1 111 111 LEU CA C 112 55.476 55.476 54.830 0.646 18003
1848 1 3 . 1 1 111 111 LEU CB C 112 41.899 41.899 41.835 0.064 18003
1849 1 3 . 1 1 111 111 LEU H H 112 7.981 7.981 7.525 0.456 18003
1850 1 3 . 1 1 112 112 SER N N 113 115.471 115.471 113.819 1.652 18003
1851 1 3 . 1 1 112 112 SER HA H 113 4.432 4.432 4.358 0.074 18003
1852 1 3 . 1 1 112 112 SER C C 113 174.381 174.381 173.592 0.789 18003
1853 1 3 . 1 1 112 112 SER CA C 113 58.527 58.527 58.704 -0.177 18003
1854 1 3 . 1 1 112 112 SER CB C 113 63.593 63.593 62.694 0.899 18003
1855 1 3 . 1 1 112 112 SER H H 113 8.215 8.215 8.062 0.153 18003
1856 1 3 . 1 1 113 113 ASP N N 114 121.696 121.696 121.149 0.547 18003
1857 1 3 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.785 -0.358 18003
1858 1 3 . 1 1 113 113 ASP C C 114 175.958 175.958 175.621 0.337 18003
1859 1 3 . 1 1 113 113 ASP CA C 114 54.213 54.213 53.706 0.507 18003
1860 1 3 . 1 1 113 113 ASP CB C 114 41.030 41.030 40.170 0.860 18003
1861 1 3 . 1 1 113 113 ASP H H 114 8.203 8.203 8.393 -0.190 18003
1862 1 3 . 1 1 114 114 ARG N N 115 120.088 120.088 120.340 -0.252 18003
1863 1 3 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.346 -0.074 18003
1864 1 3 . 1 1 114 114 ARG C C 115 175.792 175.792 176.428 -0.636 18003
1865 1 3 . 1 1 114 114 ARG CA C 115 55.735 55.735 56.727 -0.992 18003
1866 1 3 . 1 1 114 114 ARG CB C 115 30.586 30.586 30.662 -0.076 18003
1867 1 3 . 1 1 114 114 ARG H H 115 8.016 8.016 8.125 -0.109 18003
1868 1 3 . 1 1 115 115 HIS N N 116 120.597 120.597 124.274 -3.677 18003
1869 1 3 . 1 1 115 115 HIS CA C 116 53.697 53.697 56.521 -2.824 18003
1870 1 3 . 1 1 115 115 HIS CB C 116 29.299 29.299 30.172 -0.873 18003
1871 1 3 . 1 1 115 115 HIS H H 116 8.385 8.385 8.621 -0.236 18003
1872 1 3 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.497 -0.015 18003
1873 1 3 . 1 1 116 116 PRO C C 117 177.090 177.090 176.081 1.009 18003
1874 1 3 . 1 1 116 116 PRO CA C 117 63.177 63.177 63.304 -0.127 18003
1875 1 3 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.573 -0.753 18003
1876 1 3 . 1 1 117 117 SER N N 118 116.220 116.220 117.557 -1.337 18003
1877 1 3 . 1 1 117 117 SER HA H 118 4.465 4.465 4.340 0.125 18003
1878 1 3 . 1 1 117 117 SER C C 118 174.287 174.287 176.145 -1.858 18003
1879 1 3 . 1 1 117 117 SER CA C 118 58.110 58.110 59.636 -1.526 18003
1880 1 3 . 1 1 117 117 SER CB C 118 63.750 63.750 63.517 0.233 18003
1881 1 3 . 1 1 117 117 SER H H 118 8.487 8.487 8.316 0.171 18003
1882 1 3 . 1 1 118 118 ALA N N 119 126.082 126.082 124.199 1.883 18003
1883 1 3 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.276 0.163 18003
1884 1 3 . 1 1 118 118 ALA C C 119 176.879 176.879 178.471 -1.592 18003
1885 1 3 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.527 -0.078 18003
1886 1 3 . 1 1 118 118 ALA CB C 119 19.483 19.483 18.503 0.980 18003
1887 1 3 . 1 1 118 118 ALA H H 119 8.295 8.295 8.156 0.139 18003
1888 1 4 . 1 1 2 2 HIS C C 3 175.176 175.176 176.949 -1.773 18003
1889 1 4 . 1 1 2 2 HIS CA C 3 55.900 55.900 56.763 -0.863 18003
1890 1 4 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.620 -0.591 18003
1891 1 4 . 1 1 3 3 GLY N N 4 110.613 110.613 107.866 2.747 18003
1892 1 4 . 1 1 3 3 GLY C C 4 174.068 174.068 175.072 -1.004 18003
1893 1 4 . 1 1 3 3 GLY CA C 4 45.141 45.141 44.527 0.614 18003
1894 1 4 . 1 1 3 3 GLY H H 4 8.500 8.500 8.243 0.257 18003
1895 1 4 . 1 1 4 4 VAL N N 5 119.318 119.318 123.896 -4.578 18003
1896 1 4 . 1 1 4 4 VAL HA H 5 4.128 4.128 3.779 0.349 18003
1897 1 4 . 1 1 4 4 VAL C C 5 176.361 176.361 177.489 -1.128 18003
1898 1 4 . 1 1 4 4 VAL CA C 5 61.987 61.987 64.516 -2.529 18003
1899 1 4 . 1 1 4 4 VAL CB C 5 32.635 32.635 32.184 0.451 18003
1900 1 4 . 1 1 4 4 VAL H H 5 8.094 8.094 8.438 -0.344 18003
1901 1 4 . 1 1 5 5 GLU N N 6 124.369 124.369 120.386 3.983 18003
1902 1 4 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.277 0.011 18003
1903 1 4 . 1 1 5 5 GLU C C 6 177.012 177.012 176.197 0.815 18003
1904 1 4 . 1 1 5 5 GLU CA C 6 56.699 56.699 55.481 1.218 18003
1905 1 4 . 1 1 5 5 GLU CB C 6 30.029 30.029 27.780 2.248 18003
1906 1 4 . 1 1 5 5 GLU H H 6 8.545 8.545 8.493 0.052 18003
1907 1 4 . 1 1 6 6 GLY N N 7 109.747 109.747 108.558 1.189 18003
1908 1 4 . 1 1 6 6 GLY C C 7 174.117 174.117 174.386 -0.269 18003
1909 1 4 . 1 1 6 6 GLY CA C 7 45.568 45.568 44.812 0.756 18003
1910 1 4 . 1 1 6 6 GLY H H 7 8.352 8.352 7.764 0.588 18003
1911 1 4 . 1 1 7 7 ARG N N 8 120.059 120.059 121.682 -1.623 18003
1912 1 4 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.370 -0.028 18003
1913 1 4 . 1 1 7 7 ARG C C 8 176.016 176.016 175.811 0.205 18003
1914 1 4 . 1 1 7 7 ARG CA C 8 55.833 55.833 55.825 0.008 18003
1915 1 4 . 1 1 7 7 ARG CB C 8 30.444 30.444 31.168 -0.724 18003
1916 1 4 . 1 1 7 7 ARG H H 8 8.084 8.084 8.314 -0.230 18003
1917 1 4 . 1 1 8 8 ASN N N 9 119.379 119.379 119.960 -0.581 18003
1918 1 4 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.709 -0.377 18003
1919 1 4 . 1 1 8 8 ASN C C 9 174.667 174.667 175.128 -0.461 18003
1920 1 4 . 1 1 8 8 ASN CA C 9 53.441 53.441 53.686 -0.245 18003
1921 1 4 . 1 1 8 8 ASN CB C 9 38.480 38.480 39.044 -0.564 18003
1922 1 4 . 1 1 8 8 ASN H H 9 8.411 8.411 8.519 -0.108 18003
1923 1 4 . 1 1 9 9 ARG N N 10 121.700 121.700 120.700 1.000 18003
1924 1 4 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.602 0.047 18003
1925 1 4 . 1 1 9 9 ARG CA C 10 53.147 53.147 54.618 -1.471 18003
1926 1 4 . 1 1 9 9 ARG CB C 10 30.197 30.197 29.619 0.578 18003
1927 1 4 . 1 1 9 9 ARG H H 10 8.138 8.138 8.341 -0.203 18003
1928 1 4 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.532 -0.089 18003
1929 1 4 . 1 1 10 10 PRO C C 11 176.815 176.815 176.569 0.246 18003
1930 1 4 . 1 1 10 10 PRO CA C 11 63.177 63.177 62.624 0.553 18003
1931 1 4 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.400 -0.580 18003
1932 1 4 . 1 1 11 11 SER N N 12 116.291 116.291 116.983 -0.692 18003
1933 1 4 . 1 1 11 11 SER HA H 12 4.418 4.418 4.217 0.201 18003
1934 1 4 . 1 1 11 11 SER C C 12 173.702 173.702 173.767 -0.065 18003
1935 1 4 . 1 1 11 11 SER CA C 12 58.031 58.031 59.659 -1.628 18003
1936 1 4 . 1 1 11 11 SER CB C 12 64.032 64.032 63.133 0.899 18003
1937 1 4 . 1 1 11 11 SER H H 12 8.325 8.325 8.460 -0.135 18003
1938 1 4 . 1 1 12 12 ALA N N 13 126.862 126.862 127.312 -0.450 18003
1939 1 4 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.477 -0.089 18003
1940 1 4 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.412 -0.954 18003
1941 1 4 . 1 1 12 12 ALA CB C 13 18.257 18.257 19.446 -1.189 18003
1942 1 4 . 1 1 12 12 ALA H H 13 8.166 8.166 8.486 -0.320 18003
1943 1 4 . 1 1 13 13 PRO C C 14 176.368 176.368 176.095 0.273 18003
1944 1 4 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.859 0.078 18003
1945 1 4 . 1 1 13 13 PRO CB C 14 32.022 32.022 30.881 1.141 18003
1946 1 4 . 1 1 14 14 LEU N N 15 120.969 120.969 124.894 -3.925 18003
1947 1 4 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.450 -0.192 18003
1948 1 4 . 1 1 14 14 LEU C C 15 176.124 176.124 177.960 -1.836 18003
1949 1 4 . 1 1 14 14 LEU CA C 15 54.527 54.527 55.368 -0.841 18003
1950 1 4 . 1 1 14 14 LEU CB C 15 43.418 43.418 41.823 1.595 18003
1951 1 4 . 1 1 14 14 LEU H H 15 7.875 7.875 7.681 0.194 18003
1952 1 4 . 1 1 15 15 ASP N N 16 121.780 121.780 118.075 3.705 18003
1953 1 4 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.721 -0.128 18003
1954 1 4 . 1 1 15 15 ASP C C 16 176.208 176.208 178.148 -1.940 18003
1955 1 4 . 1 1 15 15 ASP CA C 16 52.468 52.468 56.407 -3.939 18003
1956 1 4 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.086 1.543 18003
1957 1 4 . 1 1 15 15 ASP H H 16 7.850 7.850 8.410 -0.560 18003
1958 1 4 . 1 1 16 16 SER N N 17 114.435 114.435 116.221 -1.786 18003
1959 1 4 . 1 1 16 16 SER HA H 17 4.120 4.120 4.218 -0.098 18003
1960 1 4 . 1 1 16 16 SER C C 17 177.207 177.207 176.307 0.900 18003
1961 1 4 . 1 1 16 16 SER CA C 17 62.322 62.322 61.318 1.004 18003
1962 1 4 . 1 1 16 16 SER H H 17 8.658 8.658 8.396 0.262 18003
1963 1 4 . 1 1 17 17 GLN N N 18 122.403 122.403 120.958 1.445 18003
1964 1 4 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.075 0.122 18003
1965 1 4 . 1 1 17 17 GLN C C 18 178.715 178.715 177.375 1.340 18003
1966 1 4 . 1 1 17 17 GLN CA C 18 58.113 58.113 59.228 -1.115 18003
1967 1 4 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.440 -0.400 18003
1968 1 4 . 1 1 17 17 GLN H H 18 8.140 8.140 8.352 -0.212 18003
1969 1 4 . 1 1 18 18 ALA N N 19 124.743 124.743 121.719 3.024 18003
1970 1 4 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.041 0.135 18003
1971 1 4 . 1 1 18 18 ALA C C 19 180.616 180.616 179.317 1.299 18003
1972 1 4 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.799 -0.194 18003
1973 1 4 . 1 1 18 18 ALA CB C 19 19.028 19.028 18.069 0.959 18003
1974 1 4 . 1 1 18 18 ALA H H 19 8.455 8.455 8.069 0.386 18003
1975 1 4 . 1 1 19 19 ALA N N 20 119.089 119.089 120.770 -1.681 18003
1976 1 4 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.026 0.153 18003
1977 1 4 . 1 1 19 19 ALA C C 20 179.239 179.239 179.371 -0.132 18003
1978 1 4 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.871 0.400 18003
1979 1 4 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.328 -0.136 18003
1980 1 4 . 1 1 19 19 ALA H H 20 8.993 8.993 7.903 1.090 18003
1981 1 4 . 1 1 20 20 ALA N N 21 119.226 119.226 121.222 -1.996 18003
1982 1 4 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.906 0.154 18003
1983 1 4 . 1 1 20 20 ALA C C 21 180.230 180.230 179.909 0.321 18003
1984 1 4 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.165 -0.022 18003
1985 1 4 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.046 -0.017 18003
1986 1 4 . 1 1 20 20 ALA H H 21 7.724 7.724 7.971 -0.247 18003
1987 1 4 . 1 1 21 21 GLN N N 22 119.310 119.310 118.353 0.957 18003
1988 1 4 . 1 1 21 21 GLN HA H 22 4.129 4.129 3.957 0.172 18003
1989 1 4 . 1 1 21 21 GLN C C 22 179.319 179.319 178.752 0.567 18003
1990 1 4 . 1 1 21 21 GLN CA C 22 58.762 58.762 58.939 -0.177 18003
1991 1 4 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.683 -0.654 18003
1992 1 4 . 1 1 21 21 GLN H H 22 7.638 7.638 8.393 -0.755 18003
1993 1 4 . 1 1 22 22 VAL N N 23 121.565 121.565 119.695 1.870 18003
1994 1 4 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.703 0.263 18003
1995 1 4 . 1 1 22 22 VAL C C 23 178.026 178.026 178.021 0.005 18003
1996 1 4 . 1 1 22 22 VAL CA C 23 66.142 66.142 65.873 0.269 18003
1997 1 4 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.025 -0.059 18003
1998 1 4 . 1 1 22 22 VAL H H 23 8.442 8.442 7.972 0.470 18003
1999 1 4 . 1 1 23 23 ALA N N 24 121.400 121.400 122.474 -1.074 18003
2000 1 4 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.873 0.223 18003
2001 1 4 . 1 1 23 23 ALA C C 24 178.758 178.758 179.766 -1.008 18003
2002 1 4 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.554 0.361 18003
2003 1 4 . 1 1 23 23 ALA CB C 24 16.650 16.650 17.902 -1.252 18003
2004 1 4 . 1 1 23 23 ALA H H 24 8.495 8.495 8.542 -0.047 18003
2005 1 4 . 1 1 24 24 SER N N 25 112.138 112.138 113.423 -1.285 18003
2006 1 4 . 1 1 24 24 SER HA H 25 4.093 4.093 4.132 -0.039 18003
2007 1 4 . 1 1 24 24 SER C C 25 177.271 177.271 176.726 0.545 18003
2008 1 4 . 1 1 24 24 SER CA C 25 62.166 62.166 61.447 0.719 18003
2009 1 4 . 1 1 24 24 SER CB C 25 63.032 63.032 63.114 -0.082 18003
2010 1 4 . 1 1 24 24 SER H H 25 7.936 7.936 8.192 -0.256 18003
2011 1 4 . 1 1 25 25 THR N N 26 119.701 119.701 119.602 0.099 18003
2012 1 4 . 1 1 25 25 THR HA H 26 4.380 4.380 4.036 0.344 18003
2013 1 4 . 1 1 25 25 THR C C 26 175.456 175.456 176.456 -1.000 18003
2014 1 4 . 1 1 25 25 THR CA C 26 67.129 67.129 67.061 0.068 18003
2015 1 4 . 1 1 25 25 THR CB C 26 68.800 68.800 68.628 0.172 18003
2016 1 4 . 1 1 25 25 THR H H 26 7.775 7.775 7.669 0.106 18003
2017 1 4 . 1 1 26 26 LEU N N 27 119.270 119.270 120.672 -1.402 18003
2018 1 4 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.106 -0.543 18003
2019 1 4 . 1 1 26 26 LEU C C 27 178.390 178.390 179.159 -0.769 18003
2020 1 4 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.731 -0.062 18003
2021 1 4 . 1 1 26 26 LEU CB C 27 42.030 42.030 40.879 1.151 18003
2022 1 4 . 1 1 26 26 LEU H H 27 8.006 8.006 8.694 -0.688 18003
2023 1 4 . 1 1 27 27 GLN N N 28 115.843 115.843 119.588 -3.745 18003
2024 1 4 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.105 -0.301 18003
2025 1 4 . 1 1 27 27 GLN C C 28 178.657 178.657 177.753 0.904 18003
2026 1 4 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.401 0.311 18003
2027 1 4 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.990 -0.961 18003
2028 1 4 . 1 1 27 27 GLN H H 28 8.485 8.485 8.166 0.319 18003
2029 1 4 . 1 1 28 28 ALA N N 29 118.779 118.779 122.426 -3.647 18003
2030 1 4 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.053 -0.045 18003
2031 1 4 . 1 1 28 28 ALA C C 29 178.259 178.259 179.901 -1.642 18003
2032 1 4 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.644 -0.682 18003
2033 1 4 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.760 -0.022 18003
2034 1 4 . 1 1 28 28 ALA H H 29 7.432 7.432 8.108 -0.676 18003
2035 1 4 . 1 1 29 29 LEU N N 30 113.442 113.442 118.360 -4.918 18003
2036 1 4 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.940 0.056 18003
2037 1 4 . 1 1 29 29 LEU C C 30 175.924 175.924 177.012 -1.088 18003
2038 1 4 . 1 1 29 29 LEU CA C 30 55.564 55.564 57.113 -1.549 18003
2039 1 4 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.324 0.942 18003
2040 1 4 . 1 1 29 29 LEU H H 30 7.311 7.311 7.967 -0.656 18003
2041 1 4 . 1 1 30 30 ALA N N 31 119.563 119.563 119.025 0.538 18003
2042 1 4 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.159 0.013 18003
2043 1 4 . 1 1 30 30 ALA C C 31 176.316 176.316 176.194 0.122 18003
2044 1 4 . 1 1 30 30 ALA CA C 31 51.656 51.656 52.777 -1.121 18003
2045 1 4 . 1 1 30 30 ALA CB C 31 18.077 18.077 18.953 -0.876 18003
2046 1 4 . 1 1 30 30 ALA H H 31 7.223 7.223 7.252 -0.029 18003
2047 1 4 . 1 1 31 31 THR N N 32 114.613 114.613 111.343 3.270 18003
2048 1 4 . 1 1 31 31 THR HA H 32 4.950 4.950 4.183 0.767 18003
2049 1 4 . 1 1 31 31 THR CA C 32 58.129 58.129 62.826 -4.697 18003
2050 1 4 . 1 1 31 31 THR CB C 32 69.098 69.098 67.633 1.465 18003
2051 1 4 . 1 1 31 31 THR H H 32 8.399 8.399 8.071 0.328 18003
2052 1 4 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.167 0.271 18003
2053 1 4 . 1 1 32 32 PRO C C 33 178.207 178.207 178.951 -0.744 18003
2054 1 4 . 1 1 32 32 PRO CA C 33 66.905 66.905 65.991 0.914 18003
2055 1 4 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.639 -0.375 18003
2056 1 4 . 1 1 33 33 SER N N 34 110.767 110.767 113.650 -2.883 18003
2057 1 4 . 1 1 33 33 SER HA H 34 4.026 4.026 4.073 -0.047 18003
2058 1 4 . 1 1 33 33 SER C C 34 176.742 176.742 176.735 0.007 18003
2059 1 4 . 1 1 33 33 SER CA C 34 61.782 61.782 62.182 -0.400 18003
2060 1 4 . 1 1 33 33 SER CB C 34 62.432 62.432 62.453 -0.021 18003
2061 1 4 . 1 1 33 33 SER H H 34 8.407 8.407 8.413 -0.006 18003
2062 1 4 . 1 1 34 34 ARG N N 35 120.135 120.135 121.933 -1.798 18003
2063 1 4 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.075 -0.021 18003
2064 1 4 . 1 1 34 34 ARG C C 35 178.283 178.283 178.882 -0.599 18003
2065 1 4 . 1 1 34 34 ARG CA C 35 60.532 60.532 59.299 1.233 18003
2066 1 4 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.997 -1.044 18003
2067 1 4 . 1 1 34 34 ARG H H 35 7.341 7.341 8.271 -0.930 18003
2068 1 4 . 1 1 35 35 LEU N N 36 118.454 118.454 120.645 -2.191 18003
2069 1 4 . 1 1 35 35 LEU HA H 36 4.054 4.054 3.921 0.133 18003
2070 1 4 . 1 1 35 35 LEU C C 36 180.643 180.643 178.959 1.684 18003
2071 1 4 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.474 -0.666 18003
2072 1 4 . 1 1 35 35 LEU CB C 36 41.778 41.778 42.034 -0.256 18003
2073 1 4 . 1 1 35 35 LEU H H 36 8.226 8.226 8.328 -0.102 18003
2074 1 4 . 1 1 36 36 MET N N 37 121.073 121.073 120.081 0.992 18003
2075 1 4 . 1 1 36 36 MET HA H 37 3.928 3.928 4.032 -0.104 18003
2076 1 4 . 1 1 36 36 MET C C 37 177.671 177.671 178.995 -1.324 18003
2077 1 4 . 1 1 36 36 MET CA C 37 60.613 60.613 59.199 1.414 18003
2078 1 4 . 1 1 36 36 MET CB C 37 33.128 33.128 32.778 0.350 18003
2079 1 4 . 1 1 36 36 MET H H 37 8.447 8.447 8.435 0.012 18003
2080 1 4 . 1 1 37 37 ILE N N 38 118.239 118.239 119.741 -1.502 18003
2081 1 4 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.690 -0.250 18003
2082 1 4 . 1 1 37 37 ILE C C 38 177.092 177.092 178.175 -1.083 18003
2083 1 4 . 1 1 37 37 ILE CA C 38 65.675 65.675 65.130 0.545 18003
2084 1 4 . 1 1 37 37 ILE CB C 38 38.255 38.255 37.732 0.523 18003
2085 1 4 . 1 1 37 37 ILE H H 38 7.763 7.763 8.030 -0.267 18003
2086 1 4 . 1 1 38 38 LEU N N 39 116.073 116.073 121.153 -5.080 18003
2087 1 4 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.979 -0.153 18003
2088 1 4 . 1 1 38 38 LEU C C 39 178.941 178.941 178.643 0.298 18003
2089 1 4 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.685 -0.654 18003
2090 1 4 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.844 -0.064 18003
2091 1 4 . 1 1 38 38 LEU H H 39 8.538 8.538 8.519 0.019 18003
2092 1 4 . 1 1 39 39 THR N N 40 106.678 106.678 113.026 -6.348 18003
2093 1 4 . 1 1 39 39 THR HA H 40 3.932 3.932 3.845 0.087 18003
2094 1 4 . 1 1 39 39 THR C C 40 177.747 177.747 177.080 0.667 18003
2095 1 4 . 1 1 39 39 THR CA C 40 65.536 65.536 66.627 -1.091 18003
2096 1 4 . 1 1 39 39 THR CB C 40 68.360 68.360 68.121 0.239 18003
2097 1 4 . 1 1 39 39 THR H H 40 8.086 8.086 8.635 -0.549 18003
2098 1 4 . 1 1 40 40 GLN N N 41 122.344 122.344 121.225 1.119 18003
2099 1 4 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.013 -0.007 18003
2100 1 4 . 1 1 40 40 GLN C C 41 178.348 178.348 178.548 -0.200 18003
2101 1 4 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.801 -0.876 18003
2102 1 4 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.547 -1.027 18003
2103 1 4 . 1 1 40 40 GLN H H 41 7.593 7.593 7.558 0.035 18003
2104 1 4 . 1 1 41 41 LEU N N 42 116.302 116.302 118.799 -2.497 18003
2105 1 4 . 1 1 41 41 LEU C C 42 178.418 178.418 179.983 -1.565 18003
2106 1 4 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.349 -1.817 18003
2107 1 4 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.717 -0.368 18003
2108 1 4 . 1 1 41 41 LEU H H 42 7.570 7.570 7.833 -0.263 18003
2109 1 4 . 1 1 42 42 ARG N N 43 119.954 119.954 121.190 -1.236 18003
2110 1 4 . 1 1 42 42 ARG HA H 43 3.915 3.915 4.025 -0.110 18003
2111 1 4 . 1 1 42 42 ARG C C 43 177.205 177.205 176.896 0.309 18003
2112 1 4 . 1 1 42 42 ARG CA C 43 58.704 58.704 58.906 -0.202 18003
2113 1 4 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.519 -1.076 18003
2114 1 4 . 1 1 42 42 ARG H H 43 7.612 7.612 8.400 -0.788 18003
2115 1 4 . 1 1 43 43 ASN N N 44 114.682 114.682 115.857 -1.175 18003
2116 1 4 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.888 -0.128 18003
2117 1 4 . 1 1 43 43 ASN C C 44 174.507 174.507 173.754 0.753 18003
2118 1 4 . 1 1 43 43 ASN CA C 44 53.953 53.953 52.670 1.283 18003
2119 1 4 . 1 1 43 43 ASN CB C 44 39.030 39.030 40.038 -1.008 18003
2120 1 4 . 1 1 43 43 ASN H H 44 7.567 7.567 7.711 -0.144 18003
2121 1 4 . 1 1 44 44 GLY N N 45 109.113 109.113 108.843 0.270 18003
2122 1 4 . 1 1 44 44 GLY CA C 45 44.268 44.268 45.231 -0.963 18003
2123 1 4 . 1 1 44 44 GLY H H 45 7.361 7.361 7.584 -0.223 18003
2124 1 4 . 1 1 45 45 PRO C C 46 178.412 178.412 175.797 2.615 18003
2125 1 4 . 1 1 45 45 PRO CA C 46 62.580 62.580 62.368 0.212 18003
2126 1 4 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.593 1.536 18003
2127 1 4 . 1 1 46 46 LEU N N 47 120.363 120.363 122.511 -2.148 18003
2128 1 4 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.818 0.213 18003
2129 1 4 . 1 1 46 46 LEU CA C 47 52.550 52.550 51.233 1.317 18003
2130 1 4 . 1 1 46 46 LEU CB C 47 48.210 48.210 42.160 6.050 18003
2131 1 4 . 1 1 46 46 LEU H H 47 8.252 8.252 7.820 0.432 18003
2132 1 4 . 1 1 47 47 PRO C C 48 177.313 177.313 177.711 -0.398 18003
2133 1 4 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.179 -0.344 18003
2134 1 4 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.505 -0.122 18003
2135 1 4 . 1 1 48 48 VAL N N 49 119.384 119.384 116.741 2.643 18003
2136 1 4 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.824 -0.217 18003
2137 1 4 . 1 1 48 48 VAL C C 49 176.710 176.710 177.402 -0.692 18003
2138 1 4 . 1 1 48 48 VAL CA C 49 66.188 66.188 66.622 -0.434 18003
2139 1 4 . 1 1 48 48 VAL CB C 49 31.581 31.581 30.772 0.809 18003
2140 1 4 . 1 1 48 48 VAL H H 49 9.074 9.074 8.488 0.586 18003
2141 1 4 . 1 1 49 49 THR N N 50 111.293 111.293 111.239 0.054 18003
2142 1 4 . 1 1 49 49 THR HA H 50 4.181 4.181 3.999 0.182 18003
2143 1 4 . 1 1 49 49 THR C C 50 176.717 176.717 176.201 0.516 18003
2144 1 4 . 1 1 49 49 THR CA C 50 65.063 65.063 66.191 -1.128 18003
2145 1 4 . 1 1 49 49 THR CB C 50 68.032 68.032 68.220 -0.188 18003
2146 1 4 . 1 1 49 49 THR H H 50 7.848 7.848 8.013 -0.165 18003
2147 1 4 . 1 1 50 50 ASP N N 51 120.138 120.138 122.312 -2.174 18003
2148 1 4 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.458 -0.253 18003
2149 1 4 . 1 1 50 50 ASP C C 51 174.723 174.723 178.014 -3.291 18003
2150 1 4 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.031 -0.250 18003
2151 1 4 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.285 0.826 18003
2152 1 4 . 1 1 50 50 ASP H H 51 7.108 7.108 8.058 -0.950 18003
2153 1 4 . 1 1 51 51 LEU N N 52 121.089 121.089 121.472 -0.383 18003
2154 1 4 . 1 1 51 51 LEU HA H 52 3.985 3.985 3.946 0.039 18003
2155 1 4 . 1 1 51 51 LEU C C 52 177.089 177.089 178.530 -1.441 18003
2156 1 4 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.938 0.223 18003
2157 1 4 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.830 -0.050 18003
2158 1 4 . 1 1 51 51 LEU H H 52 7.943 7.943 8.146 -0.203 18003
2159 1 4 . 1 1 52 52 ALA N N 53 119.237 119.237 121.251 -2.014 18003
2160 1 4 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.953 -0.081 18003
2161 1 4 . 1 1 52 52 ALA C C 53 179.466 179.466 178.994 0.472 18003
2162 1 4 . 1 1 52 52 ALA CA C 53 55.663 55.663 54.966 0.697 18003
2163 1 4 . 1 1 52 52 ALA CB C 53 17.619 17.619 18.174 -0.555 18003
2164 1 4 . 1 1 52 52 ALA H H 53 8.480 8.480 8.563 -0.083 18003
2165 1 4 . 1 1 53 53 GLU N N 54 115.655 115.655 119.693 -4.038 18003
2166 1 4 . 1 1 53 53 GLU HA H 54 4.054 4.054 3.987 0.067 18003
2167 1 4 . 1 1 53 53 GLU C C 54 179.073 179.073 178.627 0.446 18003
2168 1 4 . 1 1 53 53 GLU CA C 54 58.827 58.827 59.113 -0.286 18003
2169 1 4 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.528 -0.128 18003
2170 1 4 . 1 1 53 53 GLU H H 54 7.705 7.705 7.875 -0.170 18003
2171 1 4 . 1 1 54 54 ALA N N 55 120.276 120.276 121.296 -1.020 18003
2172 1 4 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.140 -0.003 18003
2173 1 4 . 1 1 54 54 ALA C C 55 179.771 179.771 179.014 0.757 18003
2174 1 4 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.501 0.160 18003
2175 1 4 . 1 1 54 54 ALA CB C 55 18.235 18.235 18.953 -0.718 18003
2176 1 4 . 1 1 54 54 ALA H H 55 7.928 7.928 7.846 0.082 18003
2177 1 4 . 1 1 55 55 ILE N N 56 107.195 107.195 116.864 -9.669 18003
2178 1 4 . 1 1 55 55 ILE C C 56 176.053 176.053 176.948 -0.895 18003
2179 1 4 . 1 1 55 55 ILE CA C 56 60.551 60.551 63.004 -2.453 18003
2180 1 4 . 1 1 55 55 ILE CB C 56 38.497 38.497 39.083 -0.585 18003
2181 1 4 . 1 1 55 55 ILE H H 56 7.507 7.507 7.579 -0.072 18003
2182 1 4 . 1 1 56 56 GLY N N 57 111.108 111.108 107.626 3.482 18003
2183 1 4 . 1 1 56 56 GLY C C 57 174.421 174.421 173.855 0.566 18003
2184 1 4 . 1 1 56 56 GLY CA C 57 46.960 46.960 44.977 1.983 18003
2185 1 4 . 1 1 56 56 GLY H H 57 7.757 7.757 8.568 -0.811 18003
2186 1 4 . 1 1 57 57 MET N N 58 118.089 118.089 120.016 -1.927 18003
2187 1 4 . 1 1 57 57 MET HA H 58 3.933 3.933 4.059 -0.126 18003
2188 1 4 . 1 1 57 57 MET C C 58 174.157 174.157 174.852 -0.695 18003
2189 1 4 . 1 1 57 57 MET CA C 58 54.091 54.091 56.416 -2.325 18003
2190 1 4 . 1 1 57 57 MET CB C 58 38.062 38.062 32.325 5.737 18003
2191 1 4 . 1 1 57 57 MET H H 58 7.659 7.659 7.889 -0.230 18003
2192 1 4 . 1 1 58 58 GLU N N 59 121.656 121.656 123.272 -1.616 18003
2193 1 4 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.369 -0.029 18003
2194 1 4 . 1 1 58 58 GLU C C 59 178.355 178.355 176.198 2.157 18003
2195 1 4 . 1 1 58 58 GLU CA C 59 56.643 56.643 56.782 -0.139 18003
2196 1 4 . 1 1 58 58 GLU CB C 59 30.029 30.029 29.888 0.141 18003
2197 1 4 . 1 1 58 58 GLU H H 59 8.523 8.523 8.566 -0.043 18003
2198 1 4 . 1 1 59 59 GLN N N 60 123.686 123.686 118.568 5.118 18003
2199 1 4 . 1 1 59 59 GLN HA H 60 4.214 4.214 4.088 0.126 18003
2200 1 4 . 1 1 59 59 GLN C C 60 177.961 177.961 177.469 0.492 18003
2201 1 4 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.559 2.057 18003
2202 1 4 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.428 0.587 18003
2203 1 4 . 1 1 59 59 GLN H H 60 9.009 9.009 8.558 0.451 18003
2204 1 4 . 1 1 60 60 SER N N 61 115.101 115.101 116.471 -1.370 18003
2205 1 4 . 1 1 60 60 SER C C 61 176.801 176.801 175.728 1.073 18003
2206 1 4 . 1 1 60 60 SER CA C 61 61.213 61.213 61.315 -0.102 18003
2207 1 4 . 1 1 60 60 SER H H 61 8.964 8.964 8.467 0.497 18003
2208 1 4 . 1 1 61 61 ALA N N 62 126.069 126.069 123.163 2.906 18003
2209 1 4 . 1 1 61 61 ALA HA H 62 4.351 4.351 3.993 0.358 18003
2210 1 4 . 1 1 61 61 ALA C C 62 180.635 180.635 179.386 1.249 18003
2211 1 4 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.766 -0.508 18003
2212 1 4 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.262 0.361 18003
2213 1 4 . 1 1 61 61 ALA H H 62 7.103 7.103 8.314 -1.211 18003
2214 1 4 . 1 1 62 62 VAL N N 63 119.252 119.252 119.155 0.097 18003
2215 1 4 . 1 1 62 62 VAL C C 63 177.842 177.842 178.157 -0.315 18003
2216 1 4 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.015 0.783 18003
2217 1 4 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.622 -0.358 18003
2218 1 4 . 1 1 62 62 VAL H H 63 7.971 7.971 7.371 0.600 18003
2219 1 4 . 1 1 63 63 SER N N 64 115.494 115.494 115.758 -0.264 18003
2220 1 4 . 1 1 63 63 SER HA H 64 4.034 4.034 3.996 0.038 18003
2221 1 4 . 1 1 63 63 SER C C 64 176.835 176.835 176.804 0.031 18003
2222 1 4 . 1 1 63 63 SER CA C 64 62.400 62.400 62.211 0.189 18003
2223 1 4 . 1 1 63 63 SER CB C 64 62.752 62.752 62.716 0.036 18003
2224 1 4 . 1 1 63 63 SER H H 64 8.743 8.743 7.934 0.809 18003
2225 1 4 . 1 1 64 64 HIS N N 65 120.010 120.010 120.710 -0.700 18003
2226 1 4 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.241 0.119 18003
2227 1 4 . 1 1 64 64 HIS C C 65 177.731 177.731 177.194 0.537 18003
2228 1 4 . 1 1 64 64 HIS CA C 65 59.998 59.998 59.940 0.058 18003
2229 1 4 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.986 -0.052 18003
2230 1 4 . 1 1 64 64 HIS H H 65 7.804 7.804 8.011 -0.207 18003
2231 1 4 . 1 1 65 65 GLN N N 66 115.590 115.590 118.685 -3.095 18003
2232 1 4 . 1 1 65 65 GLN HA H 66 4.035 4.035 4.004 0.031 18003
2233 1 4 . 1 1 65 65 GLN C C 66 179.055 179.055 178.298 0.757 18003
2234 1 4 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.975 -1.445 18003
2235 1 4 . 1 1 65 65 GLN H H 66 7.751 7.751 7.592 0.159 18003
2236 1 4 . 1 1 66 66 LEU N N 67 118.746 118.746 119.803 -1.057 18003
2237 1 4 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.886 0.061 18003
2238 1 4 . 1 1 66 66 LEU C C 67 178.334 178.334 179.040 -0.706 18003
2239 1 4 . 1 1 66 66 LEU CA C 67 57.846 57.846 57.900 -0.054 18003
2240 1 4 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.242 -0.139 18003
2241 1 4 . 1 1 66 66 LEU H H 67 8.648 8.648 7.943 0.705 18003
2242 1 4 . 1 1 67 67 ARG N N 68 119.610 119.610 119.033 0.577 18003
2243 1 4 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.910 0.033 18003
2244 1 4 . 1 1 67 67 ARG C C 68 178.807 178.807 178.900 -0.093 18003
2245 1 4 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.609 -0.232 18003
2246 1 4 . 1 1 67 67 ARG CB C 68 29.475 29.475 29.891 -0.416 18003
2247 1 4 . 1 1 67 67 ARG H H 68 7.607 7.607 7.765 -0.158 18003
2248 1 4 . 1 1 68 68 VAL N N 69 119.719 119.719 119.229 0.490 18003
2249 1 4 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.677 -0.044 18003
2250 1 4 . 1 1 68 68 VAL C C 69 178.690 178.690 177.943 0.747 18003
2251 1 4 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.192 0.262 18003
2252 1 4 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.390 0.389 18003
2253 1 4 . 1 1 68 68 VAL H H 69 7.259 7.259 7.526 -0.267 18003
2254 1 4 . 1 1 69 69 LEU N N 70 117.532 117.532 121.328 -3.796 18003
2255 1 4 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.883 0.065 18003
2256 1 4 . 1 1 69 69 LEU C C 70 179.144 179.144 178.625 0.519 18003
2257 1 4 . 1 1 69 69 LEU CA C 70 57.750 57.750 58.633 -0.883 18003
2258 1 4 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.503 0.357 18003
2259 1 4 . 1 1 69 69 LEU H H 70 8.375 8.375 8.427 -0.052 18003
2260 1 4 . 1 1 70 70 ARG N N 71 122.498 122.498 117.274 5.224 18003
2261 1 4 . 1 1 70 70 ARG HA H 71 3.931 3.931 3.959 -0.028 18003
2262 1 4 . 1 1 70 70 ARG C C 71 180.499 180.499 178.583 1.916 18003
2263 1 4 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.219 -0.442 18003
2264 1 4 . 1 1 70 70 ARG CB C 71 30.155 30.155 30.121 0.034 18003
2265 1 4 . 1 1 70 70 ARG H H 71 8.822 8.822 8.328 0.494 18003
2266 1 4 . 1 1 71 71 ASN N N 72 121.816 121.816 116.505 5.311 18003
2267 1 4 . 1 1 71 71 ASN C C 72 177.170 177.170 176.686 0.484 18003
2268 1 4 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.297 0.480 18003
2269 1 4 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.637 -0.903 18003
2270 1 4 . 1 1 71 71 ASN H H 72 8.144 8.144 7.798 0.346 18003
2271 1 4 . 1 1 72 72 LEU N N 73 117.044 117.044 117.143 -0.099 18003
2272 1 4 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.571 -0.226 18003
2273 1 4 . 1 1 72 72 LEU C C 73 176.984 176.984 177.488 -0.504 18003
2274 1 4 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.258 -1.133 18003
2275 1 4 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.767 0.502 18003
2276 1 4 . 1 1 72 72 LEU H H 73 7.804 7.804 8.439 -0.635 18003
2277 1 4 . 1 1 73 73 GLY N N 74 106.621 106.621 106.584 0.037 18003
2278 1 4 . 1 1 73 73 GLY C C 74 173.266 173.266 173.658 -0.392 18003
2279 1 4 . 1 1 73 73 GLY CA C 74 46.022 46.022 45.178 0.844 18003
2280 1 4 . 1 1 73 73 GLY H H 74 7.851 7.851 8.050 -0.199 18003
2281 1 4 . 1 1 74 74 LEU N N 75 114.582 114.582 121.059 -6.477 18003
2282 1 4 . 1 1 74 74 LEU C C 75 177.562 177.562 175.589 1.973 18003
2283 1 4 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.158 0.873 18003
2284 1 4 . 1 1 74 74 LEU CB C 75 44.444 44.444 43.428 1.016 18003
2285 1 4 . 1 1 74 74 LEU H H 75 7.808 7.808 8.263 -0.455 18003
2286 1 4 . 1 1 75 75 VAL N N 76 110.980 110.980 111.936 -0.956 18003
2287 1 4 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.514 0.013 18003
2288 1 4 . 1 1 75 75 VAL C C 76 173.922 173.922 173.581 0.341 18003
2289 1 4 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.682 -2.740 18003
2290 1 4 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.539 0.490 18003
2291 1 4 . 1 1 75 75 VAL H H 76 7.079 7.079 7.275 -0.196 18003
2292 1 4 . 1 1 76 76 VAL N N 77 118.619 118.619 118.866 -0.247 18003
2293 1 4 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.479 0.823 18003
2294 1 4 . 1 1 76 76 VAL C C 77 174.041 174.041 174.427 -0.386 18003
2295 1 4 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.719 -0.720 18003
2296 1 4 . 1 1 76 76 VAL H H 77 9.024 9.024 9.161 -0.137 18003
2297 1 4 . 1 1 77 77 GLY N N 78 109.451 109.451 110.990 -1.539 18003
2298 1 4 . 1 1 77 77 GLY C C 78 172.225 172.225 172.645 -0.420 18003
2299 1 4 . 1 1 77 77 GLY CA C 78 44.462 44.462 44.242 0.221 18003
2300 1 4 . 1 1 77 77 GLY H H 78 8.265 8.265 8.370 -0.105 18003
2301 1 4 . 1 1 78 78 ASP N N 79 122.826 122.826 123.530 -0.704 18003
2302 1 4 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.932 -0.186 18003
2303 1 4 . 1 1 78 78 ASP C C 79 174.817 174.817 175.593 -0.776 18003
2304 1 4 . 1 1 78 78 ASP CA C 79 53.111 53.111 52.700 0.411 18003
2305 1 4 . 1 1 78 78 ASP CB C 79 43.655 43.655 42.899 0.756 18003
2306 1 4 . 1 1 78 78 ASP H H 79 8.479 8.479 8.324 0.155 18003
2307 1 4 . 1 1 79 79 ARG N N 80 122.613 122.613 122.816 -0.203 18003
2308 1 4 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.419 -0.007 18003
2309 1 4 . 1 1 79 79 ARG C C 80 175.546 175.546 175.471 0.075 18003
2310 1 4 . 1 1 79 79 ARG CA C 80 56.318 56.318 55.746 0.572 18003
2311 1 4 . 1 1 79 79 ARG CB C 80 30.376 30.376 31.075 -0.699 18003
2312 1 4 . 1 1 79 79 ARG H H 80 8.580 8.580 8.651 -0.071 18003
2313 1 4 . 1 1 80 80 ALA N N 81 129.263 129.263 126.349 2.914 18003
2314 1 4 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.470 -0.018 18003
2315 1 4 . 1 1 80 80 ALA C C 81 177.126 177.126 177.339 -0.213 18003
2316 1 4 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.822 -0.202 18003
2317 1 4 . 1 1 80 80 ALA CB C 81 19.260 19.260 19.546 -0.286 18003
2318 1 4 . 1 1 80 80 ALA H H 81 8.396 8.396 8.416 -0.020 18003
2319 1 4 . 1 1 81 81 GLY N N 82 112.739 112.739 113.969 -1.230 18003
2320 1 4 . 1 1 81 81 GLY C C 82 174.856 174.856 174.879 -0.023 18003
2321 1 4 . 1 1 81 81 GLY CA C 82 46.392 46.392 46.767 -0.374 18003
2322 1 4 . 1 1 81 81 GLY H H 82 8.641 8.641 8.674 -0.033 18003
2323 1 4 . 1 1 82 82 ARG N N 83 124.780 124.780 121.791 2.989 18003
2324 1 4 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.657 -0.334 18003
2325 1 4 . 1 1 82 82 ARG C C 83 176.339 176.339 174.772 1.567 18003
2326 1 4 . 1 1 82 82 ARG CA C 83 56.690 56.690 55.337 1.353 18003
2327 1 4 . 1 1 82 82 ARG CB C 83 30.221 30.221 31.602 -1.381 18003
2328 1 4 . 1 1 82 82 ARG H H 83 8.728 8.728 8.306 0.422 18003
2329 1 4 . 1 1 83 83 SER N N 84 114.678 114.678 116.270 -1.592 18003
2330 1 4 . 1 1 83 83 SER C C 84 172.869 172.869 172.431 0.438 18003
2331 1 4 . 1 1 83 83 SER CA C 84 56.834 56.834 57.875 -1.041 18003
2332 1 4 . 1 1 83 83 SER CB C 84 65.191 65.191 65.582 -0.391 18003
2333 1 4 . 1 1 83 83 SER H H 84 7.821 7.821 8.175 -0.354 18003
2334 1 4 . 1 1 84 84 ILE N N 85 122.996 122.996 127.127 -4.131 18003
2335 1 4 . 1 1 84 84 ILE C C 85 175.521 175.521 173.531 1.990 18003
2336 1 4 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.151 1.084 18003
2337 1 4 . 1 1 84 84 ILE CB C 85 38.136 38.136 40.746 -2.610 18003
2338 1 4 . 1 1 84 84 ILE H H 85 8.232 8.232 8.382 -0.150 18003
2339 1 4 . 1 1 85 85 VAL N N 86 121.845 121.845 129.025 -7.180 18003
2340 1 4 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.258 0.052 18003
2341 1 4 . 1 1 85 85 VAL C C 86 174.818 174.818 174.449 0.369 18003
2342 1 4 . 1 1 85 85 VAL CA C 86 59.738 59.738 60.845 -1.107 18003
2343 1 4 . 1 1 85 85 VAL CB C 86 34.221 34.221 33.608 0.614 18003
2344 1 4 . 1 1 85 85 VAL H H 86 8.495 8.495 8.317 0.178 18003
2345 1 4 . 1 1 86 86 TYR N N 87 125.020 125.020 127.748 -2.728 18003
2346 1 4 . 1 1 86 86 TYR HA H 87 4.319 4.319 4.851 -0.532 18003
2347 1 4 . 1 1 86 86 TYR C C 87 173.808 173.808 175.437 -1.629 18003
2348 1 4 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.874 -0.409 18003
2349 1 4 . 1 1 86 86 TYR CB C 87 41.480 41.480 39.566 1.915 18003
2350 1 4 . 1 1 86 86 TYR H H 87 8.488 8.488 8.912 -0.424 18003
2351 1 4 . 1 1 87 87 SER N N 88 110.681 110.681 114.103 -3.422 18003
2352 1 4 . 1 1 87 87 SER HA H 88 5.414 5.414 4.903 0.511 18003
2353 1 4 . 1 1 87 87 SER C C 88 174.693 174.693 173.197 1.496 18003
2354 1 4 . 1 1 87 87 SER CA C 88 56.113 56.113 56.232 -0.119 18003
2355 1 4 . 1 1 87 87 SER CB C 88 66.309 66.309 65.926 0.383 18003
2356 1 4 . 1 1 87 87 SER H H 88 8.718 8.718 9.210 -0.492 18003
2357 1 4 . 1 1 88 88 LEU N N 89 119.612 119.612 121.034 -1.422 18003
2358 1 4 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.239 0.688 18003
2359 1 4 . 1 1 88 88 LEU C C 89 179.031 179.031 178.279 0.752 18003
2360 1 4 . 1 1 88 88 LEU CA C 89 55.325 55.325 54.987 0.338 18003
2361 1 4 . 1 1 88 88 LEU CB C 89 41.720 41.720 41.256 0.464 18003
2362 1 4 . 1 1 88 88 LEU H H 89 9.034 9.034 8.511 0.523 18003
2363 1 4 . 1 1 89 89 TYR N N 90 120.540 120.540 123.445 -2.905 18003
2364 1 4 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.124 0.498 18003
2365 1 4 . 1 1 89 89 TYR CA C 90 61.712 61.712 61.035 0.677 18003
2366 1 4 . 1 1 89 89 TYR H H 90 8.075 8.075 8.285 -0.210 18003
2367 1 4 . 1 1 92 92 HIS C C 93 177.850 177.850 177.026 0.824 18003
2368 1 4 . 1 1 93 93 VAL N N 94 120.211 120.211 119.118 1.093 18003
2369 1 4 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.375 0.126 18003
2370 1 4 . 1 1 93 93 VAL C C 94 176.785 176.785 177.257 -0.472 18003
2371 1 4 . 1 1 93 93 VAL CA C 94 66.666 66.666 64.996 1.671 18003
2372 1 4 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.033 0.604 18003
2373 1 4 . 1 1 93 93 VAL H H 94 8.164 8.164 8.098 0.066 18003
2374 1 4 . 1 1 94 94 ALA N N 95 119.221 119.221 121.924 -2.703 18003
2375 1 4 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.882 -0.092 18003
2376 1 4 . 1 1 94 94 ALA C C 95 177.979 177.979 179.357 -1.378 18003
2377 1 4 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.280 0.199 18003
2378 1 4 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.124 -0.014 18003
2379 1 4 . 1 1 94 94 ALA H H 95 6.942 6.942 7.662 -0.720 18003
2380 1 4 . 1 1 95 95 GLN N N 96 115.416 115.416 119.510 -4.094 18003
2381 1 4 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.031 0.004 18003
2382 1 4 . 1 1 95 95 GLN C C 96 177.993 177.993 178.254 -0.261 18003
2383 1 4 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.866 -0.024 18003
2384 1 4 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.856 -0.827 18003
2385 1 4 . 1 1 95 95 GLN H H 96 7.795 7.795 8.342 -0.547 18003
2386 1 4 . 1 1 96 96 LEU N N 97 120.758 120.758 121.463 -0.705 18003
2387 1 4 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.026 -0.177 18003
2388 1 4 . 1 1 96 96 LEU C C 97 177.974 177.974 178.847 -0.873 18003
2389 1 4 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.151 1.131 18003
2390 1 4 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.862 -0.816 18003
2391 1 4 . 1 1 96 96 LEU H H 97 8.197 8.197 7.980 0.217 18003
2392 1 4 . 1 1 97 97 LEU N N 98 117.567 117.567 118.982 -1.415 18003
2393 1 4 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.833 -0.003 18003
2394 1 4 . 1 1 97 97 LEU C C 98 178.219 178.219 178.773 -0.554 18003
2395 1 4 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.461 -0.731 18003
2396 1 4 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.112 0.750 18003
2397 1 4 . 1 1 97 97 LEU H H 98 7.660 7.660 8.375 -0.715 18003
2398 1 4 . 1 1 98 98 ASP N N 99 118.607 118.607 119.842 -1.235 18003
2399 1 4 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.276 -0.167 18003
2400 1 4 . 1 1 98 98 ASP C C 99 179.382 179.382 178.943 0.439 18003
2401 1 4 . 1 1 98 98 ASP CA C 99 58.035 58.035 58.078 -0.043 18003
2402 1 4 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.633 -0.794 18003
2403 1 4 . 1 1 98 98 ASP H H 99 8.295 8.295 8.202 0.093 18003
2404 1 4 . 1 1 99 99 GLU N N 100 117.542 117.542 120.080 -2.538 18003
2405 1 4 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.002 -0.153 18003
2406 1 4 . 1 1 99 99 GLU C C 100 179.389 179.389 179.124 0.265 18003
2407 1 4 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.254 -1.231 18003
2408 1 4 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.324 -0.295 18003
2409 1 4 . 1 1 99 99 GLU H H 100 8.334 8.334 7.880 0.454 18003
2410 1 4 . 1 1 100 100 ALA N N 101 122.890 122.890 123.239 -0.349 18003
2411 1 4 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.182 -0.184 18003
2412 1 4 . 1 1 100 100 ALA C C 101 180.184 180.184 180.069 0.115 18003
2413 1 4 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.288 0.232 18003
2414 1 4 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.434 -0.815 18003
2415 1 4 . 1 1 100 100 ALA H H 101 8.550 8.550 8.119 0.431 18003
2416 1 4 . 1 1 101 101 ILE N N 102 119.952 119.952 119.118 0.834 18003
2417 1 4 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.765 -0.176 18003
2418 1 4 . 1 1 101 101 ILE C C 102 178.114 178.114 177.564 0.550 18003
2419 1 4 . 1 1 101 101 ILE CA C 102 65.376 65.376 63.959 1.417 18003
2420 1 4 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.276 0.753 18003
2421 1 4 . 1 1 101 101 ILE H H 102 8.493 8.493 8.666 -0.173 18003
2422 1 4 . 1 1 102 102 TYR N N 103 120.625 120.625 121.578 -0.953 18003
2423 1 4 . 1 1 102 102 TYR HA H 103 4.171 4.171 3.971 0.200 18003
2424 1 4 . 1 1 102 102 TYR C C 103 179.772 179.772 177.764 2.008 18003
2425 1 4 . 1 1 102 102 TYR CA C 103 60.724 60.724 61.955 -1.231 18003
2426 1 4 . 1 1 102 102 TYR CB C 103 37.500 37.500 38.261 -0.761 18003
2427 1 4 . 1 1 102 102 TYR H H 103 8.520 8.520 8.037 0.483 18003
2428 1 4 . 1 1 103 103 HIS N N 104 117.456 117.456 116.562 0.894 18003
2429 1 4 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.339 0.086 18003
2430 1 4 . 1 1 103 103 HIS C C 104 176.377 176.377 177.070 -0.693 18003
2431 1 4 . 1 1 103 103 HIS CA C 104 60.043 60.043 59.675 0.368 18003
2432 1 4 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.788 -0.759 18003
2433 1 4 . 1 1 103 103 HIS H H 104 8.622 8.622 8.495 0.127 18003
2434 1 4 . 1 1 104 104 SER N N 105 113.596 113.596 114.215 -0.619 18003
2435 1 4 . 1 1 104 104 SER C C 105 176.712 176.712 176.654 0.058 18003
2436 1 4 . 1 1 104 104 SER CA C 105 61.852 61.852 60.597 1.255 18003
2437 1 4 . 1 1 104 104 SER CB C 105 63.550 63.550 63.764 -0.214 18003
2438 1 4 . 1 1 104 104 SER H H 105 7.900 7.900 8.194 -0.294 18003
2439 1 4 . 1 1 105 105 GLU N N 106 119.022 119.022 121.445 -2.423 18003
2440 1 4 . 1 1 105 105 GLU HA H 106 4.013 4.013 4.040 -0.027 18003
2441 1 4 . 1 1 105 105 GLU C C 106 177.902 177.902 177.554 0.348 18003
2442 1 4 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.425 -0.394 18003
2443 1 4 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.500 -0.222 18003
2444 1 4 . 1 1 105 105 GLU H H 106 8.181 8.181 8.471 -0.290 18003
2445 1 4 . 1 1 106 106 HIS N N 107 116.482 116.482 116.453 0.029 18003
2446 1 4 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.272 0.135 18003
2447 1 4 . 1 1 106 106 HIS C C 107 175.575 175.575 174.470 1.105 18003
2448 1 4 . 1 1 106 106 HIS CA C 107 57.343 57.343 56.839 0.504 18003
2449 1 4 . 1 1 106 106 HIS CB C 107 28.580 28.580 30.176 -1.596 18003
2450 1 4 . 1 1 106 106 HIS H H 107 7.770 7.770 7.662 0.108 18003
2451 1 4 . 1 1 107 107 LEU N N 108 120.346 120.346 119.186 1.160 18003
2452 1 4 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.191 -0.137 18003
2453 1 4 . 1 1 107 107 LEU C C 108 177.404 177.404 175.726 1.678 18003
2454 1 4 . 1 1 107 107 LEU CA C 108 55.991 55.991 54.593 1.398 18003
2455 1 4 . 1 1 107 107 LEU CB C 108 42.030 42.030 43.510 -1.480 18003
2456 1 4 . 1 1 107 107 LEU H H 108 7.682 7.682 7.609 0.073 18003
2457 1 4 . 1 1 108 108 HIS N N 109 117.222 117.222 112.416 4.806 18003
2458 1 4 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.615 -0.561 18003
2459 1 4 . 1 1 108 108 HIS C C 109 174.606 174.606 174.899 -0.293 18003
2460 1 4 . 1 1 108 108 HIS CA C 109 56.029 56.029 54.922 1.107 18003
2461 1 4 . 1 1 108 108 HIS CB C 109 28.517 28.517 29.270 -0.753 18003
2462 1 4 . 1 1 108 108 HIS H H 109 8.030 8.030 7.937 0.093 18003
2463 1 4 . 1 1 109 109 LEU N N 110 121.114 121.114 122.351 -1.237 18003
2464 1 4 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.177 0.121 18003
2465 1 4 . 1 1 109 109 LEU C C 110 178.028 178.028 176.861 1.167 18003
2466 1 4 . 1 1 109 109 LEU CA C 110 55.574 55.574 55.540 0.034 18003
2467 1 4 . 1 1 109 109 LEU CB C 110 42.076 42.076 40.595 1.481 18003
2468 1 4 . 1 1 109 109 LEU H H 110 7.973 7.973 8.391 -0.418 18003
2469 1 4 . 1 1 110 110 GLY N N 111 108.631 108.631 107.713 0.918 18003
2470 1 4 . 1 1 110 110 GLY C C 111 174.606 174.606 175.387 -0.781 18003
2471 1 4 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.668 0.912 18003
2472 1 4 . 1 1 110 110 GLY H H 111 8.255 8.255 7.758 0.497 18003
2473 1 4 . 1 1 111 111 LEU N N 112 121.022 121.022 121.235 -0.213 18003
2474 1 4 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.556 -0.197 18003
2475 1 4 . 1 1 111 111 LEU C C 112 177.701 177.701 176.347 1.354 18003
2476 1 4 . 1 1 111 111 LEU CA C 112 55.476 55.476 54.199 1.277 18003
2477 1 4 . 1 1 111 111 LEU CB C 112 41.899 41.899 41.214 0.685 18003
2478 1 4 . 1 1 111 111 LEU H H 112 7.981 7.981 8.121 -0.140 18003
2479 1 4 . 1 1 112 112 SER N N 113 115.471 115.471 115.220 0.251 18003
2480 1 4 . 1 1 112 112 SER HA H 113 4.432 4.432 4.138 0.294 18003
2481 1 4 . 1 1 112 112 SER C C 113 174.381 174.381 173.335 1.046 18003
2482 1 4 . 1 1 112 112 SER CA C 113 58.527 58.527 59.169 -0.642 18003
2483 1 4 . 1 1 112 112 SER CB C 113 63.593 63.593 62.906 0.687 18003
2484 1 4 . 1 1 112 112 SER H H 113 8.215 8.215 7.768 0.447 18003
2485 1 4 . 1 1 113 113 ASP N N 114 121.696 121.696 122.368 -0.672 18003
2486 1 4 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.696 -0.269 18003
2487 1 4 . 1 1 113 113 ASP C C 114 175.958 175.958 176.367 -0.409 18003
2488 1 4 . 1 1 113 113 ASP CA C 114 54.213 54.213 53.266 0.947 18003
2489 1 4 . 1 1 113 113 ASP CB C 114 41.030 41.030 42.430 -1.400 18003
2490 1 4 . 1 1 113 113 ASP H H 114 8.203 8.203 8.426 -0.223 18003
2491 1 4 . 1 1 114 114 ARG N N 115 120.088 120.088 123.017 -2.929 18003
2492 1 4 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.074 0.198 18003
2493 1 4 . 1 1 114 114 ARG C C 115 175.792 175.792 175.526 0.266 18003
2494 1 4 . 1 1 114 114 ARG CA C 115 55.735 55.735 55.924 -0.189 18003
2495 1 4 . 1 1 114 114 ARG CB C 115 30.586 30.586 30.016 0.570 18003
2496 1 4 . 1 1 114 114 ARG H H 115 8.016 8.016 8.298 -0.282 18003
2497 1 4 . 1 1 115 115 HIS N N 116 120.597 120.597 114.870 5.727 18003
2498 1 4 . 1 1 115 115 HIS CA C 116 53.697 53.697 55.139 -1.442 18003
2499 1 4 . 1 1 115 115 HIS CB C 116 29.299 29.299 27.683 1.616 18003
2500 1 4 . 1 1 115 115 HIS H H 116 8.385 8.385 8.237 0.148 18003
2501 1 4 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.268 0.214 18003
2502 1 4 . 1 1 116 116 PRO C C 117 177.090 177.090 177.090 0.000 18003
2503 1 4 . 1 1 116 116 PRO CA C 117 63.177 63.177 64.033 -0.856 18003
2504 1 4 . 1 1 116 116 PRO CB C 117 31.820 31.820 31.872 -0.052 18003
2505 1 4 . 1 1 117 117 SER N N 118 116.220 116.220 114.187 2.033 18003
2506 1 4 . 1 1 117 117 SER HA H 118 4.465 4.465 4.317 0.148 18003
2507 1 4 . 1 1 117 117 SER C C 118 174.287 174.287 174.239 0.048 18003
2508 1 4 . 1 1 117 117 SER CA C 118 58.110 58.110 58.425 -0.315 18003
2509 1 4 . 1 1 117 117 SER CB C 118 63.750 63.750 63.640 0.110 18003
2510 1 4 . 1 1 117 117 SER H H 118 8.487 8.487 7.777 0.710 18003
2511 1 4 . 1 1 118 118 ALA N N 119 126.082 126.082 125.720 0.362 18003
2512 1 4 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.163 0.276 18003
2513 1 4 . 1 1 118 118 ALA C C 119 176.879 176.879 176.504 0.375 18003
2514 1 4 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.288 0.161 18003
2515 1 4 . 1 1 118 118 ALA CB C 119 19.483 19.483 18.025 1.458 18003
2516 1 4 . 1 1 118 118 ALA H H 119 8.295 8.295 8.570 -0.275 18003
2517 1 5 . 1 1 2 2 HIS C C 3 175.176 175.176 175.364 -0.188 18003
2518 1 5 . 1 1 2 2 HIS CA C 3 55.900 55.900 55.396 0.504 18003
2519 1 5 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.318 -0.289 18003
2520 1 5 . 1 1 3 3 GLY N N 4 110.613 110.613 112.032 -1.419 18003
2521 1 5 . 1 1 3 3 GLY C C 4 174.068 174.068 173.883 0.185 18003
2522 1 5 . 1 1 3 3 GLY CA C 4 45.141 45.141 44.731 0.410 18003
2523 1 5 . 1 1 3 3 GLY H H 4 8.500 8.500 8.597 -0.097 18003
2524 1 5 . 1 1 4 4 VAL N N 5 119.318 119.318 121.247 -1.929 18003
2525 1 5 . 1 1 4 4 VAL HA H 5 4.128 4.128 4.226 -0.098 18003
2526 1 5 . 1 1 4 4 VAL C C 5 176.361 176.361 175.532 0.829 18003
2527 1 5 . 1 1 4 4 VAL CA C 5 61.987 61.987 61.533 0.454 18003
2528 1 5 . 1 1 4 4 VAL CB C 5 32.635 32.635 34.844 -2.209 18003
2529 1 5 . 1 1 4 4 VAL H H 5 8.094 8.094 8.204 -0.110 18003
2530 1 5 . 1 1 5 5 GLU N N 6 124.369 124.369 127.202 -2.833 18003
2531 1 5 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.447 -0.159 18003
2532 1 5 . 1 1 5 5 GLU C C 6 177.012 177.012 176.491 0.521 18003
2533 1 5 . 1 1 5 5 GLU CA C 6 56.699 56.699 56.073 0.626 18003
2534 1 5 . 1 1 5 5 GLU CB C 6 30.029 30.029 29.803 0.226 18003
2535 1 5 . 1 1 5 5 GLU H H 6 8.545 8.545 8.789 -0.244 18003
2536 1 5 . 1 1 6 6 GLY N N 7 109.747 109.747 111.530 -1.783 18003
2537 1 5 . 1 1 6 6 GLY C C 7 174.117 174.117 173.948 0.169 18003
2538 1 5 . 1 1 6 6 GLY CA C 7 45.568 45.568 44.979 0.589 18003
2539 1 5 . 1 1 6 6 GLY H H 7 8.352 8.352 8.490 -0.138 18003
2540 1 5 . 1 1 7 7 ARG N N 8 120.059 120.059 118.355 1.704 18003
2541 1 5 . 1 1 7 7 ARG HA H 8 4.342 4.342 3.980 0.362 18003
2542 1 5 . 1 1 7 7 ARG C C 8 176.016 176.016 174.412 1.604 18003
2543 1 5 . 1 1 7 7 ARG CA C 8 55.833 55.833 56.434 -0.601 18003
2544 1 5 . 1 1 7 7 ARG CB C 8 30.444 30.444 28.910 1.534 18003
2545 1 5 . 1 1 7 7 ARG H H 8 8.084 8.084 8.082 0.002 18003
2546 1 5 . 1 1 8 8 ASN N N 9 119.379 119.379 119.952 -0.573 18003
2547 1 5 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.865 -0.533 18003
2548 1 5 . 1 1 8 8 ASN C C 9 174.667 174.667 174.118 0.549 18003
2549 1 5 . 1 1 8 8 ASN CA C 9 53.441 53.441 52.342 1.099 18003
2550 1 5 . 1 1 8 8 ASN CB C 9 38.480 38.480 40.878 -2.398 18003
2551 1 5 . 1 1 8 8 ASN H H 9 8.411 8.411 8.209 0.202 18003
2552 1 5 . 1 1 9 9 ARG N N 10 121.700 121.700 121.082 0.618 18003
2553 1 5 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.591 0.058 18003
2554 1 5 . 1 1 9 9 ARG CA C 10 53.147 53.147 54.803 -1.656 18003
2555 1 5 . 1 1 9 9 ARG CB C 10 30.197 30.197 30.115 0.082 18003
2556 1 5 . 1 1 9 9 ARG H H 10 8.138 8.138 8.669 -0.531 18003
2557 1 5 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.697 -0.254 18003
2558 1 5 . 1 1 10 10 PRO C C 11 176.815 176.815 176.563 0.252 18003
2559 1 5 . 1 1 10 10 PRO CA C 11 63.177 63.177 62.715 0.462 18003
2560 1 5 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.463 -0.643 18003
2561 1 5 . 1 1 11 11 SER N N 12 116.291 116.291 115.852 0.439 18003
2562 1 5 . 1 1 11 11 SER HA H 12 4.418 4.418 4.388 0.030 18003
2563 1 5 . 1 1 11 11 SER C C 12 173.702 173.702 173.425 0.277 18003
2564 1 5 . 1 1 11 11 SER CA C 12 58.031 58.031 58.248 -0.217 18003
2565 1 5 . 1 1 11 11 SER CB C 12 64.032 64.032 64.205 -0.173 18003
2566 1 5 . 1 1 11 11 SER H H 12 8.325 8.325 8.206 0.119 18003
2567 1 5 . 1 1 12 12 ALA N N 13 126.862 126.862 123.225 3.637 18003
2568 1 5 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.447 -0.059 18003
2569 1 5 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.123 -0.665 18003
2570 1 5 . 1 1 12 12 ALA CB C 13 18.257 18.257 19.097 -0.840 18003
2571 1 5 . 1 1 12 12 ALA H H 13 8.166 8.166 8.414 -0.248 18003
2572 1 5 . 1 1 13 13 PRO C C 14 176.368 176.368 177.367 -0.999 18003
2573 1 5 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.261 0.676 18003
2574 1 5 . 1 1 13 13 PRO CB C 14 32.022 32.022 32.541 -0.519 18003
2575 1 5 . 1 1 14 14 LEU N N 15 120.969 120.969 115.907 5.062 18003
2576 1 5 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.391 -0.133 18003
2577 1 5 . 1 1 14 14 LEU C C 15 176.124 176.124 176.747 -0.623 18003
2578 1 5 . 1 1 14 14 LEU CA C 15 54.527 54.527 56.352 -1.825 18003
2579 1 5 . 1 1 14 14 LEU CB C 15 43.418 43.418 41.329 2.089 18003
2580 1 5 . 1 1 14 14 LEU H H 15 7.875 7.875 8.415 -0.540 18003
2581 1 5 . 1 1 15 15 ASP N N 16 121.780 121.780 120.719 1.061 18003
2582 1 5 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.669 -0.076 18003
2583 1 5 . 1 1 15 15 ASP C C 16 176.208 176.208 178.239 -2.031 18003
2584 1 5 . 1 1 15 15 ASP CA C 16 52.468 52.468 56.390 -3.922 18003
2585 1 5 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.393 1.236 18003
2586 1 5 . 1 1 15 15 ASP H H 16 7.850 7.850 8.287 -0.437 18003
2587 1 5 . 1 1 16 16 SER N N 17 114.435 114.435 116.407 -1.972 18003
2588 1 5 . 1 1 16 16 SER HA H 17 4.120 4.120 4.201 -0.081 18003
2589 1 5 . 1 1 16 16 SER C C 17 177.207 177.207 176.751 0.456 18003
2590 1 5 . 1 1 16 16 SER CA C 17 62.322 62.322 61.693 0.629 18003
2591 1 5 . 1 1 16 16 SER H H 17 8.658 8.658 8.330 0.328 18003
2592 1 5 . 1 1 17 17 GLN N N 18 122.403 122.403 119.959 2.444 18003
2593 1 5 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.038 0.159 18003
2594 1 5 . 1 1 17 17 GLN C C 18 178.715 178.715 177.764 0.951 18003
2595 1 5 . 1 1 17 17 GLN CA C 18 58.113 58.113 59.150 -1.037 18003
2596 1 5 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.430 -0.390 18003
2597 1 5 . 1 1 17 17 GLN H H 18 8.140 8.140 7.671 0.469 18003
2598 1 5 . 1 1 18 18 ALA N N 19 124.743 124.743 122.053 2.690 18003
2599 1 5 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.037 0.139 18003
2600 1 5 . 1 1 18 18 ALA C C 19 180.616 180.616 179.537 1.079 18003
2601 1 5 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.758 -0.153 18003
2602 1 5 . 1 1 18 18 ALA CB C 19 19.028 19.028 17.891 1.137 18003
2603 1 5 . 1 1 18 18 ALA H H 19 8.455 8.455 7.800 0.655 18003
2604 1 5 . 1 1 19 19 ALA N N 20 119.089 119.089 121.007 -1.918 18003
2605 1 5 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.036 0.143 18003
2606 1 5 . 1 1 19 19 ALA C C 20 179.239 179.239 179.426 -0.187 18003
2607 1 5 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.888 0.383 18003
2608 1 5 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.357 -0.165 18003
2609 1 5 . 1 1 19 19 ALA H H 20 8.993 8.993 7.895 1.098 18003
2610 1 5 . 1 1 20 20 ALA N N 21 119.226 119.226 121.035 -1.809 18003
2611 1 5 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.845 0.215 18003
2612 1 5 . 1 1 20 20 ALA C C 21 180.230 180.230 179.782 0.448 18003
2613 1 5 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.047 0.096 18003
2614 1 5 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.308 -0.280 18003
2615 1 5 . 1 1 20 20 ALA H H 21 7.724 7.724 8.107 -0.383 18003
2616 1 5 . 1 1 21 21 GLN N N 22 119.310 119.310 118.114 1.196 18003
2617 1 5 . 1 1 21 21 GLN HA H 22 4.129 4.129 4.040 0.089 18003
2618 1 5 . 1 1 21 21 GLN C C 22 179.319 179.319 178.721 0.598 18003
2619 1 5 . 1 1 21 21 GLN CA C 22 58.762 58.762 58.914 -0.152 18003
2620 1 5 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.473 -0.444 18003
2621 1 5 . 1 1 21 21 GLN H H 22 7.638 7.638 8.492 -0.854 18003
2622 1 5 . 1 1 22 22 VAL N N 23 121.565 121.565 120.283 1.282 18003
2623 1 5 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.699 0.267 18003
2624 1 5 . 1 1 22 22 VAL C C 23 178.026 178.026 177.859 0.167 18003
2625 1 5 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.034 0.107 18003
2626 1 5 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.223 -0.257 18003
2627 1 5 . 1 1 22 22 VAL H H 23 8.442 8.442 8.028 0.414 18003
2628 1 5 . 1 1 23 23 ALA N N 24 121.400 121.400 121.862 -0.462 18003
2629 1 5 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.932 0.164 18003
2630 1 5 . 1 1 23 23 ALA C C 24 178.758 178.758 180.009 -1.251 18003
2631 1 5 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.520 0.395 18003
2632 1 5 . 1 1 23 23 ALA CB C 24 16.650 16.650 18.034 -1.384 18003
2633 1 5 . 1 1 23 23 ALA H H 24 8.495 8.495 8.529 -0.034 18003
2634 1 5 . 1 1 24 24 SER N N 25 112.138 112.138 114.624 -2.486 18003
2635 1 5 . 1 1 24 24 SER HA H 25 4.093 4.093 4.174 -0.081 18003
2636 1 5 . 1 1 24 24 SER C C 25 177.271 177.271 176.891 0.380 18003
2637 1 5 . 1 1 24 24 SER CA C 25 62.166 62.166 62.300 -0.134 18003
2638 1 5 . 1 1 24 24 SER CB C 25 63.032 63.032 62.631 0.401 18003
2639 1 5 . 1 1 24 24 SER H H 25 7.936 7.936 8.243 -0.307 18003
2640 1 5 . 1 1 25 25 THR N N 26 119.701 119.701 120.012 -0.311 18003
2641 1 5 . 1 1 25 25 THR HA H 26 4.380 4.380 3.991 0.389 18003
2642 1 5 . 1 1 25 25 THR C C 26 175.456 175.456 176.314 -0.858 18003
2643 1 5 . 1 1 25 25 THR CA C 26 67.129 67.129 67.090 0.039 18003
2644 1 5 . 1 1 25 25 THR CB C 26 68.800 68.800 68.812 -0.012 18003
2645 1 5 . 1 1 25 25 THR H H 26 7.775 7.775 7.700 0.075 18003
2646 1 5 . 1 1 26 26 LEU N N 27 119.270 119.270 120.297 -1.027 18003
2647 1 5 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.110 -0.547 18003
2648 1 5 . 1 1 26 26 LEU C C 27 178.390 178.390 179.022 -0.632 18003
2649 1 5 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.435 0.234 18003
2650 1 5 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.075 0.955 18003
2651 1 5 . 1 1 26 26 LEU H H 27 8.006 8.006 8.463 -0.457 18003
2652 1 5 . 1 1 27 27 GLN N N 28 115.843 115.843 120.213 -4.370 18003
2653 1 5 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.028 -0.224 18003
2654 1 5 . 1 1 27 27 GLN C C 28 178.657 178.657 177.863 0.794 18003
2655 1 5 . 1 1 27 27 GLN CA C 28 58.712 58.712 59.048 -0.336 18003
2656 1 5 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.821 -0.792 18003
2657 1 5 . 1 1 27 27 GLN H H 28 8.485 8.485 8.203 0.282 18003
2658 1 5 . 1 1 28 28 ALA N N 29 118.779 118.779 122.867 -4.088 18003
2659 1 5 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.076 -0.068 18003
2660 1 5 . 1 1 28 28 ALA C C 29 178.259 178.259 179.686 -1.427 18003
2661 1 5 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.817 -0.855 18003
2662 1 5 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.436 0.302 18003
2663 1 5 . 1 1 28 28 ALA H H 29 7.432 7.432 7.846 -0.414 18003
2664 1 5 . 1 1 29 29 LEU N N 30 113.442 113.442 117.476 -4.034 18003
2665 1 5 . 1 1 29 29 LEU HA H 30 3.996 3.996 4.001 -0.005 18003
2666 1 5 . 1 1 29 29 LEU C C 30 175.924 175.924 178.317 -2.393 18003
2667 1 5 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.757 -1.193 18003
2668 1 5 . 1 1 29 29 LEU CB C 30 42.266 42.266 40.750 1.516 18003
2669 1 5 . 1 1 29 29 LEU H H 30 7.311 7.311 7.808 -0.497 18003
2670 1 5 . 1 1 30 30 ALA N N 31 119.563 119.563 119.785 -0.222 18003
2671 1 5 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.017 0.155 18003
2672 1 5 . 1 1 30 30 ALA C C 31 176.316 176.316 177.587 -1.271 18003
2673 1 5 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.823 -2.167 18003
2674 1 5 . 1 1 30 30 ALA CB C 31 18.077 18.077 18.561 -0.484 18003
2675 1 5 . 1 1 30 30 ALA H H 31 7.223 7.223 7.342 -0.119 18003
2676 1 5 . 1 1 31 31 THR N N 32 114.613 114.613 114.735 -0.122 18003
2677 1 5 . 1 1 31 31 THR HA H 32 4.950 4.950 4.078 0.872 18003
2678 1 5 . 1 1 31 31 THR CA C 32 58.129 58.129 62.802 -4.673 18003
2679 1 5 . 1 1 31 31 THR CB C 32 69.098 69.098 68.612 0.486 18003
2680 1 5 . 1 1 31 31 THR H H 32 8.399 8.399 7.921 0.478 18003
2681 1 5 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.104 0.334 18003
2682 1 5 . 1 1 32 32 PRO C C 33 178.207 178.207 178.449 -0.242 18003
2683 1 5 . 1 1 32 32 PRO CA C 33 66.905 66.905 66.098 0.807 18003
2684 1 5 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.729 -0.465 18003
2685 1 5 . 1 1 33 33 SER N N 34 110.767 110.767 112.757 -1.990 18003
2686 1 5 . 1 1 33 33 SER HA H 34 4.026 4.026 4.097 -0.071 18003
2687 1 5 . 1 1 33 33 SER C C 34 176.742 176.742 176.806 -0.064 18003
2688 1 5 . 1 1 33 33 SER CA C 34 61.782 61.782 62.259 -0.477 18003
2689 1 5 . 1 1 33 33 SER CB C 34 62.432 62.432 62.499 -0.067 18003
2690 1 5 . 1 1 33 33 SER H H 34 8.407 8.407 8.471 -0.064 18003
2691 1 5 . 1 1 34 34 ARG N N 35 120.135 120.135 121.578 -1.443 18003
2692 1 5 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.126 -0.072 18003
2693 1 5 . 1 1 34 34 ARG C C 35 178.283 178.283 178.741 -0.458 18003
2694 1 5 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.846 1.686 18003
2695 1 5 . 1 1 34 34 ARG CB C 35 28.953 28.953 30.008 -1.055 18003
2696 1 5 . 1 1 34 34 ARG H H 35 7.341 7.341 7.612 -0.271 18003
2697 1 5 . 1 1 35 35 LEU N N 36 118.454 118.454 122.187 -3.733 18003
2698 1 5 . 1 1 35 35 LEU HA H 36 4.054 4.054 4.044 0.010 18003
2699 1 5 . 1 1 35 35 LEU C C 36 180.643 180.643 178.555 2.088 18003
2700 1 5 . 1 1 35 35 LEU CA C 36 57.809 57.809 57.951 -0.142 18003
2701 1 5 . 1 1 35 35 LEU CB C 36 41.778 41.778 41.434 0.344 18003
2702 1 5 . 1 1 35 35 LEU H H 36 8.226 8.226 8.343 -0.117 18003
2703 1 5 . 1 1 36 36 MET N N 37 121.073 121.073 118.796 2.277 18003
2704 1 5 . 1 1 36 36 MET HA H 37 3.928 3.928 4.090 -0.162 18003
2705 1 5 . 1 1 36 36 MET C C 37 177.671 177.671 178.724 -1.053 18003
2706 1 5 . 1 1 36 36 MET CA C 37 60.613 60.613 59.290 1.323 18003
2707 1 5 . 1 1 36 36 MET CB C 37 33.128 33.128 32.625 0.503 18003
2708 1 5 . 1 1 36 36 MET H H 37 8.447 8.447 7.995 0.452 18003
2709 1 5 . 1 1 37 37 ILE N N 38 118.239 118.239 120.270 -2.031 18003
2710 1 5 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.636 -0.196 18003
2711 1 5 . 1 1 37 37 ILE C C 38 177.092 177.092 178.088 -0.996 18003
2712 1 5 . 1 1 37 37 ILE CA C 38 65.675 65.675 65.296 0.379 18003
2713 1 5 . 1 1 37 37 ILE CB C 38 38.255 38.255 37.690 0.565 18003
2714 1 5 . 1 1 37 37 ILE H H 38 7.763 7.763 7.955 -0.192 18003
2715 1 5 . 1 1 38 38 LEU N N 39 116.073 116.073 119.948 -3.875 18003
2716 1 5 . 1 1 38 38 LEU HA H 39 3.826 3.826 4.025 -0.199 18003
2717 1 5 . 1 1 38 38 LEU C C 39 178.941 178.941 179.229 -0.288 18003
2718 1 5 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.326 -0.295 18003
2719 1 5 . 1 1 38 38 LEU CB C 39 41.780 41.780 40.730 1.050 18003
2720 1 5 . 1 1 38 38 LEU H H 39 8.538 8.538 8.559 -0.021 18003
2721 1 5 . 1 1 39 39 THR N N 40 106.678 106.678 115.762 -9.084 18003
2722 1 5 . 1 1 39 39 THR HA H 40 3.932 3.932 3.842 0.090 18003
2723 1 5 . 1 1 39 39 THR C C 40 177.747 177.747 176.753 0.994 18003
2724 1 5 . 1 1 39 39 THR CA C 40 65.536 65.536 66.761 -1.225 18003
2725 1 5 . 1 1 39 39 THR CB C 40 68.360 68.360 68.605 -0.245 18003
2726 1 5 . 1 1 39 39 THR H H 40 8.086 8.086 8.142 -0.056 18003
2727 1 5 . 1 1 40 40 GLN N N 41 122.344 122.344 119.928 2.416 18003
2728 1 5 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.096 -0.090 18003
2729 1 5 . 1 1 40 40 GLN C C 41 178.348 178.348 178.876 -0.528 18003
2730 1 5 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.574 -0.649 18003
2731 1 5 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.284 -0.764 18003
2732 1 5 . 1 1 40 40 GLN H H 41 7.593 7.593 7.700 -0.107 18003
2733 1 5 . 1 1 41 41 LEU N N 42 116.302 116.302 121.259 -4.957 18003
2734 1 5 . 1 1 41 41 LEU C C 42 178.418 178.418 179.167 -0.749 18003
2735 1 5 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.670 -2.139 18003
2736 1 5 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.718 -0.369 18003
2737 1 5 . 1 1 41 41 LEU H H 42 7.570 7.570 7.898 -0.328 18003
2738 1 5 . 1 1 42 42 ARG N N 43 119.954 119.954 118.183 1.771 18003
2739 1 5 . 1 1 42 42 ARG HA H 43 3.915 3.915 3.904 0.011 18003
2740 1 5 . 1 1 42 42 ARG C C 43 177.205 177.205 177.810 -0.605 18003
2741 1 5 . 1 1 42 42 ARG CA C 43 58.704 58.704 59.284 -0.580 18003
2742 1 5 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.033 -0.590 18003
2743 1 5 . 1 1 42 42 ARG H H 43 7.612 7.612 8.357 -0.745 18003
2744 1 5 . 1 1 43 43 ASN N N 44 114.682 114.682 115.749 -1.067 18003
2745 1 5 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.585 0.175 18003
2746 1 5 . 1 1 43 43 ASN C C 44 174.507 174.507 175.888 -1.381 18003
2747 1 5 . 1 1 43 43 ASN CA C 44 53.953 53.953 54.600 -0.647 18003
2748 1 5 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.215 -0.185 18003
2749 1 5 . 1 1 43 43 ASN H H 44 7.567 7.567 7.726 -0.159 18003
2750 1 5 . 1 1 44 44 GLY N N 45 109.113 109.113 107.679 1.434 18003
2751 1 5 . 1 1 44 44 GLY CA C 45 44.268 44.268 44.876 -0.608 18003
2752 1 5 . 1 1 44 44 GLY H H 45 7.361 7.361 8.278 -0.917 18003
2753 1 5 . 1 1 45 45 PRO C C 46 178.412 178.412 175.747 2.665 18003
2754 1 5 . 1 1 45 45 PRO CA C 46 62.580 62.580 63.459 -0.878 18003
2755 1 5 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.382 1.747 18003
2756 1 5 . 1 1 46 46 LEU N N 47 120.363 120.363 119.192 1.171 18003
2757 1 5 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.879 0.152 18003
2758 1 5 . 1 1 46 46 LEU CA C 47 52.550 52.550 52.756 -0.206 18003
2759 1 5 . 1 1 46 46 LEU CB C 47 48.210 48.210 42.224 5.986 18003
2760 1 5 . 1 1 46 46 LEU H H 47 8.252 8.252 8.038 0.214 18003
2761 1 5 . 1 1 47 47 PRO C C 48 177.313 177.313 178.574 -1.261 18003
2762 1 5 . 1 1 47 47 PRO CA C 48 61.835 61.835 61.856 -0.021 18003
2763 1 5 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.664 -0.281 18003
2764 1 5 . 1 1 48 48 VAL N N 49 119.384 119.384 119.512 -0.128 18003
2765 1 5 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.656 -0.049 18003
2766 1 5 . 1 1 48 48 VAL C C 49 176.710 176.710 178.288 -1.578 18003
2767 1 5 . 1 1 48 48 VAL CA C 49 66.188 66.188 67.543 -1.355 18003
2768 1 5 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.318 0.263 18003
2769 1 5 . 1 1 48 48 VAL H H 49 9.074 9.074 8.957 0.117 18003
2770 1 5 . 1 1 49 49 THR N N 50 111.293 111.293 114.921 -3.628 18003
2771 1 5 . 1 1 49 49 THR HA H 50 4.181 4.181 4.103 0.078 18003
2772 1 5 . 1 1 49 49 THR C C 50 176.717 176.717 176.339 0.378 18003
2773 1 5 . 1 1 49 49 THR CA C 50 65.063 65.063 66.775 -1.712 18003
2774 1 5 . 1 1 49 49 THR CB C 50 68.032 68.032 68.302 -0.270 18003
2775 1 5 . 1 1 49 49 THR H H 50 7.848 7.848 8.103 -0.255 18003
2776 1 5 . 1 1 50 50 ASP N N 51 120.138 120.138 121.862 -1.724 18003
2777 1 5 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.466 -0.261 18003
2778 1 5 . 1 1 50 50 ASP C C 51 174.723 174.723 178.446 -3.723 18003
2779 1 5 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.024 -0.243 18003
2780 1 5 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.530 0.581 18003
2781 1 5 . 1 1 50 50 ASP H H 51 7.108 7.108 8.331 -1.223 18003
2782 1 5 . 1 1 51 51 LEU N N 52 121.089 121.089 121.347 -0.258 18003
2783 1 5 . 1 1 51 51 LEU HA H 52 3.985 3.985 3.970 0.015 18003
2784 1 5 . 1 1 51 51 LEU C C 52 177.089 177.089 178.556 -1.467 18003
2785 1 5 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.808 0.353 18003
2786 1 5 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.766 0.014 18003
2787 1 5 . 1 1 51 51 LEU H H 52 7.943 7.943 8.411 -0.468 18003
2788 1 5 . 1 1 52 52 ALA N N 53 119.237 119.237 121.098 -1.861 18003
2789 1 5 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.870 0.002 18003
2790 1 5 . 1 1 52 52 ALA C C 53 179.466 179.466 179.418 0.048 18003
2791 1 5 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.110 0.553 18003
2792 1 5 . 1 1 52 52 ALA CB C 53 17.619 17.619 17.942 -0.323 18003
2793 1 5 . 1 1 52 52 ALA H H 53 8.480 8.480 8.148 0.332 18003
2794 1 5 . 1 1 53 53 GLU N N 54 115.655 115.655 119.060 -3.405 18003
2795 1 5 . 1 1 53 53 GLU HA H 54 4.054 4.054 3.970 0.084 18003
2796 1 5 . 1 1 53 53 GLU C C 54 179.073 179.073 177.977 1.096 18003
2797 1 5 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.883 -0.056 18003
2798 1 5 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.564 -0.164 18003
2799 1 5 . 1 1 53 53 GLU H H 54 7.705 7.705 7.859 -0.154 18003
2800 1 5 . 1 1 54 54 ALA N N 55 120.276 120.276 121.070 -0.794 18003
2801 1 5 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.116 0.021 18003
2802 1 5 . 1 1 54 54 ALA C C 55 179.771 179.771 179.162 0.609 18003
2803 1 5 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.428 0.233 18003
2804 1 5 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.028 -0.793 18003
2805 1 5 . 1 1 54 54 ALA H H 55 7.928 7.928 7.730 0.198 18003
2806 1 5 . 1 1 55 55 ILE N N 56 107.195 107.195 117.333 -10.138 18003
2807 1 5 . 1 1 55 55 ILE C C 56 176.053 176.053 177.195 -1.142 18003
2808 1 5 . 1 1 55 55 ILE CA C 56 60.551 60.551 62.962 -2.411 18003
2809 1 5 . 1 1 55 55 ILE CB C 56 38.497 38.497 38.953 -0.456 18003
2810 1 5 . 1 1 55 55 ILE H H 56 7.507 7.507 7.798 -0.291 18003
2811 1 5 . 1 1 56 56 GLY N N 57 111.108 111.108 107.270 3.838 18003
2812 1 5 . 1 1 56 56 GLY C C 57 174.421 174.421 173.753 0.668 18003
2813 1 5 . 1 1 56 56 GLY CA C 57 46.960 46.960 44.612 2.348 18003
2814 1 5 . 1 1 56 56 GLY H H 57 7.757 7.757 8.108 -0.351 18003
2815 1 5 . 1 1 57 57 MET N N 58 118.089 118.089 119.452 -1.363 18003
2816 1 5 . 1 1 57 57 MET HA H 58 3.933 3.933 4.140 -0.207 18003
2817 1 5 . 1 1 57 57 MET C C 58 174.157 174.157 174.722 -0.565 18003
2818 1 5 . 1 1 57 57 MET CA C 58 54.091 54.091 56.655 -2.564 18003
2819 1 5 . 1 1 57 57 MET CB C 58 38.062 38.062 32.622 5.440 18003
2820 1 5 . 1 1 57 57 MET H H 58 7.659 7.659 7.842 -0.183 18003
2821 1 5 . 1 1 58 58 GLU N N 59 121.656 121.656 123.231 -1.575 18003
2822 1 5 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.350 -0.010 18003
2823 1 5 . 1 1 58 58 GLU C C 59 178.355 178.355 176.276 2.079 18003
2824 1 5 . 1 1 58 58 GLU CA C 59 56.643 56.643 57.220 -0.577 18003
2825 1 5 . 1 1 58 58 GLU CB C 59 30.029 30.029 29.660 0.369 18003
2826 1 5 . 1 1 58 58 GLU H H 59 8.523 8.523 8.479 0.044 18003
2827 1 5 . 1 1 59 59 GLN N N 60 123.686 123.686 120.016 3.670 18003
2828 1 5 . 1 1 59 59 GLN HA H 60 4.214 4.214 3.993 0.221 18003
2829 1 5 . 1 1 59 59 GLN C C 60 177.961 177.961 177.248 0.713 18003
2830 1 5 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.848 1.768 18003
2831 1 5 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.317 0.698 18003
2832 1 5 . 1 1 59 59 GLN H H 60 9.009 9.009 8.521 0.488 18003
2833 1 5 . 1 1 60 60 SER N N 61 115.101 115.101 115.594 -0.493 18003
2834 1 5 . 1 1 60 60 SER C C 61 176.801 176.801 176.238 0.563 18003
2835 1 5 . 1 1 60 60 SER CA C 61 61.213 61.213 61.041 0.172 18003
2836 1 5 . 1 1 60 60 SER H H 61 8.964 8.964 8.417 0.547 18003
2837 1 5 . 1 1 61 61 ALA N N 62 126.069 126.069 124.533 1.536 18003
2838 1 5 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.118 0.233 18003
2839 1 5 . 1 1 61 61 ALA C C 62 180.635 180.635 179.720 0.915 18003
2840 1 5 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.786 -0.528 18003
2841 1 5 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.226 0.397 18003
2842 1 5 . 1 1 61 61 ALA H H 62 7.103 7.103 7.657 -0.554 18003
2843 1 5 . 1 1 62 62 VAL N N 63 119.252 119.252 119.620 -0.368 18003
2844 1 5 . 1 1 62 62 VAL C C 63 177.842 177.842 177.675 0.167 18003
2845 1 5 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.386 0.412 18003
2846 1 5 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.160 0.104 18003
2847 1 5 . 1 1 62 62 VAL H H 63 7.971 7.971 7.656 0.315 18003
2848 1 5 . 1 1 63 63 SER N N 64 115.494 115.494 115.213 0.281 18003
2849 1 5 . 1 1 63 63 SER HA H 64 4.034 4.034 3.918 0.116 18003
2850 1 5 . 1 1 63 63 SER C C 64 176.835 176.835 176.750 0.085 18003
2851 1 5 . 1 1 63 63 SER CA C 64 62.400 62.400 61.930 0.470 18003
2852 1 5 . 1 1 63 63 SER CB C 64 62.752 62.752 63.007 -0.255 18003
2853 1 5 . 1 1 63 63 SER H H 64 8.743 8.743 7.987 0.756 18003
2854 1 5 . 1 1 64 64 HIS N N 65 120.010 120.010 121.261 -1.251 18003
2855 1 5 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.361 -0.001 18003
2856 1 5 . 1 1 64 64 HIS C C 65 177.731 177.731 177.290 0.441 18003
2857 1 5 . 1 1 64 64 HIS CA C 65 59.998 59.998 60.126 -0.128 18003
2858 1 5 . 1 1 64 64 HIS CB C 65 29.934 29.934 30.225 -0.291 18003
2859 1 5 . 1 1 64 64 HIS H H 65 7.804 7.804 8.080 -0.276 18003
2860 1 5 . 1 1 65 65 GLN N N 66 115.590 115.590 119.658 -4.068 18003
2861 1 5 . 1 1 65 65 GLN HA H 66 4.035 4.035 4.105 -0.070 18003
2862 1 5 . 1 1 65 65 GLN C C 66 179.055 179.055 178.425 0.630 18003
2863 1 5 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.573 -1.043 18003
2864 1 5 . 1 1 65 65 GLN H H 66 7.751 7.751 8.158 -0.407 18003
2865 1 5 . 1 1 66 66 LEU N N 67 118.746 118.746 119.638 -0.892 18003
2866 1 5 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.986 -0.039 18003
2867 1 5 . 1 1 66 66 LEU C C 67 178.334 178.334 178.983 -0.649 18003
2868 1 5 . 1 1 66 66 LEU CA C 67 57.846 57.846 57.913 -0.067 18003
2869 1 5 . 1 1 66 66 LEU CB C 67 41.103 41.103 40.876 0.227 18003
2870 1 5 . 1 1 66 66 LEU H H 67 8.648 8.648 8.676 -0.028 18003
2871 1 5 . 1 1 67 67 ARG N N 68 119.610 119.610 119.753 -0.143 18003
2872 1 5 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.901 0.042 18003
2873 1 5 . 1 1 67 67 ARG C C 68 178.807 178.807 178.602 0.205 18003
2874 1 5 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.494 -0.117 18003
2875 1 5 . 1 1 67 67 ARG CB C 68 29.475 29.475 29.943 -0.468 18003
2876 1 5 . 1 1 67 67 ARG H H 68 7.607 7.607 7.726 -0.119 18003
2877 1 5 . 1 1 68 68 VAL N N 69 119.719 119.719 119.972 -0.253 18003
2878 1 5 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.629 0.004 18003
2879 1 5 . 1 1 68 68 VAL C C 69 178.690 178.690 177.972 0.718 18003
2880 1 5 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.533 -0.079 18003
2881 1 5 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.564 0.215 18003
2882 1 5 . 1 1 68 68 VAL H H 69 7.259 7.259 7.675 -0.416 18003
2883 1 5 . 1 1 69 69 LEU N N 70 117.532 117.532 119.870 -2.338 18003
2884 1 5 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.871 0.077 18003
2885 1 5 . 1 1 69 69 LEU C C 70 179.144 179.144 179.116 0.028 18003
2886 1 5 . 1 1 69 69 LEU CA C 70 57.750 57.750 57.663 0.087 18003
2887 1 5 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.389 0.471 18003
2888 1 5 . 1 1 69 69 LEU H H 70 8.375 8.375 8.331 0.044 18003
2889 1 5 . 1 1 70 70 ARG N N 71 122.498 122.498 117.121 5.377 18003
2890 1 5 . 1 1 70 70 ARG HA H 71 3.931 3.931 4.056 -0.125 18003
2891 1 5 . 1 1 70 70 ARG C C 71 180.499 180.499 179.159 1.340 18003
2892 1 5 . 1 1 70 70 ARG CA C 71 58.777 58.777 58.842 -0.065 18003
2893 1 5 . 1 1 70 70 ARG CB C 71 30.155 30.155 29.734 0.421 18003
2894 1 5 . 1 1 70 70 ARG H H 71 8.822 8.822 8.577 0.245 18003
2895 1 5 . 1 1 71 71 ASN N N 72 121.816 121.816 117.439 4.377 18003
2896 1 5 . 1 1 71 71 ASN C C 72 177.170 177.170 176.050 1.120 18003
2897 1 5 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.607 0.170 18003
2898 1 5 . 1 1 71 71 ASN CB C 72 37.734 37.734 39.344 -1.610 18003
2899 1 5 . 1 1 71 71 ASN H H 72 8.144 8.144 7.847 0.297 18003
2900 1 5 . 1 1 72 72 LEU N N 73 117.044 117.044 113.040 4.004 18003
2901 1 5 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.767 -0.422 18003
2902 1 5 . 1 1 72 72 LEU C C 73 176.984 176.984 175.591 1.393 18003
2903 1 5 . 1 1 72 72 LEU CA C 73 55.125 55.125 54.539 0.586 18003
2904 1 5 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.128 1.141 18003
2905 1 5 . 1 1 72 72 LEU H H 73 7.804 7.804 7.938 -0.134 18003
2906 1 5 . 1 1 73 73 GLY N N 74 106.621 106.621 109.170 -2.549 18003
2907 1 5 . 1 1 73 73 GLY C C 74 173.266 173.266 174.133 -0.867 18003
2908 1 5 . 1 1 73 73 GLY CA C 74 46.022 46.022 45.262 0.760 18003
2909 1 5 . 1 1 73 73 GLY H H 74 7.851 7.851 8.584 -0.733 18003
2910 1 5 . 1 1 74 74 LEU N N 75 114.582 114.582 120.662 -6.080 18003
2911 1 5 . 1 1 74 74 LEU C C 75 177.562 177.562 175.226 2.336 18003
2912 1 5 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.538 0.493 18003
2913 1 5 . 1 1 74 74 LEU CB C 75 44.444 44.444 39.446 4.998 18003
2914 1 5 . 1 1 74 74 LEU H H 75 7.808 7.808 8.332 -0.524 18003
2915 1 5 . 1 1 75 75 VAL N N 76 110.980 110.980 112.653 -1.673 18003
2916 1 5 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.660 -0.133 18003
2917 1 5 . 1 1 75 75 VAL C C 76 173.922 173.922 174.147 -0.225 18003
2918 1 5 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.682 -2.739 18003
2919 1 5 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.301 0.728 18003
2920 1 5 . 1 1 75 75 VAL H H 76 7.079 7.079 7.894 -0.815 18003
2921 1 5 . 1 1 76 76 VAL N N 77 118.619 118.619 120.452 -1.833 18003
2922 1 5 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.613 0.689 18003
2923 1 5 . 1 1 76 76 VAL C C 77 174.041 174.041 174.654 -0.613 18003
2924 1 5 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.520 -0.521 18003
2925 1 5 . 1 1 76 76 VAL H H 77 9.024 9.024 9.114 -0.090 18003
2926 1 5 . 1 1 77 77 GLY N N 78 109.451 109.451 107.998 1.453 18003
2927 1 5 . 1 1 77 77 GLY C C 78 172.225 172.225 172.383 -0.158 18003
2928 1 5 . 1 1 77 77 GLY CA C 78 44.462 44.462 45.399 -0.937 18003
2929 1 5 . 1 1 77 77 GLY H H 78 8.265 8.265 8.207 0.058 18003
2930 1 5 . 1 1 78 78 ASP N N 79 122.826 122.826 121.625 1.201 18003
2931 1 5 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.854 -0.108 18003
2932 1 5 . 1 1 78 78 ASP C C 79 174.817 174.817 175.106 -0.289 18003
2933 1 5 . 1 1 78 78 ASP CA C 79 53.111 53.111 52.789 0.322 18003
2934 1 5 . 1 1 78 78 ASP CB C 79 43.655 43.655 42.971 0.684 18003
2935 1 5 . 1 1 78 78 ASP H H 79 8.479 8.479 8.150 0.329 18003
2936 1 5 . 1 1 79 79 ARG N N 80 122.613 122.613 124.926 -2.313 18003
2937 1 5 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.224 0.188 18003
2938 1 5 . 1 1 79 79 ARG C C 80 175.546 175.546 174.880 0.666 18003
2939 1 5 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.136 0.182 18003
2940 1 5 . 1 1 79 79 ARG CB C 80 30.376 30.376 31.336 -0.960 18003
2941 1 5 . 1 1 79 79 ARG H H 80 8.580 8.580 8.679 -0.099 18003
2942 1 5 . 1 1 80 80 ALA N N 81 129.263 129.263 128.824 0.439 18003
2943 1 5 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.571 -0.119 18003
2944 1 5 . 1 1 80 80 ALA C C 81 177.126 177.126 175.861 1.265 18003
2945 1 5 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.013 0.607 18003
2946 1 5 . 1 1 80 80 ALA CB C 81 19.260 19.260 21.573 -2.313 18003
2947 1 5 . 1 1 80 80 ALA H H 81 8.396 8.396 8.466 -0.070 18003
2948 1 5 . 1 1 81 81 GLY N N 82 112.739 112.739 107.092 5.647 18003
2949 1 5 . 1 1 81 81 GLY C C 82 174.856 174.856 174.257 0.599 18003
2950 1 5 . 1 1 81 81 GLY CA C 82 46.392 46.392 46.495 -0.103 18003
2951 1 5 . 1 1 81 81 GLY H H 82 8.641 8.641 8.382 0.259 18003
2952 1 5 . 1 1 82 82 ARG N N 83 124.780 124.780 120.514 4.266 18003
2953 1 5 . 1 1 82 82 ARG HA H 83 4.323 4.323 3.989 0.334 18003
2954 1 5 . 1 1 82 82 ARG C C 83 176.339 176.339 175.209 1.130 18003
2955 1 5 . 1 1 82 82 ARG CA C 83 56.690 56.690 56.361 0.329 18003
2956 1 5 . 1 1 82 82 ARG CB C 83 30.221 30.221 28.370 1.851 18003
2957 1 5 . 1 1 82 82 ARG H H 83 8.728 8.728 8.272 0.456 18003
2958 1 5 . 1 1 83 83 SER N N 84 114.678 114.678 114.393 0.285 18003
2959 1 5 . 1 1 83 83 SER C C 84 172.869 172.869 172.533 0.336 18003
2960 1 5 . 1 1 83 83 SER CA C 84 56.834 56.834 57.928 -1.093 18003
2961 1 5 . 1 1 83 83 SER CB C 84 65.191 65.191 64.334 0.857 18003
2962 1 5 . 1 1 83 83 SER H H 84 7.821 7.821 8.357 -0.536 18003
2963 1 5 . 1 1 84 84 ILE N N 85 122.996 122.996 128.205 -5.209 18003
2964 1 5 . 1 1 84 84 ILE C C 85 175.521 175.521 173.445 2.076 18003
2965 1 5 . 1 1 84 84 ILE CA C 85 60.235 60.235 58.958 1.277 18003
2966 1 5 . 1 1 84 84 ILE CB C 85 38.136 38.136 40.556 -2.420 18003
2967 1 5 . 1 1 84 84 ILE H H 85 8.232 8.232 8.289 -0.057 18003
2968 1 5 . 1 1 85 85 VAL N N 86 121.845 121.845 129.473 -7.628 18003
2969 1 5 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.321 -0.011 18003
2970 1 5 . 1 1 85 85 VAL C C 86 174.818 174.818 174.198 0.620 18003
2971 1 5 . 1 1 85 85 VAL CA C 86 59.738 59.738 60.531 -0.793 18003
2972 1 5 . 1 1 85 85 VAL CB C 86 34.221 34.221 33.524 0.697 18003
2973 1 5 . 1 1 85 85 VAL H H 86 8.495 8.495 8.224 0.271 18003
2974 1 5 . 1 1 86 86 TYR N N 87 125.020 125.020 127.687 -2.667 18003
2975 1 5 . 1 1 86 86 TYR HA H 87 4.319 4.319 4.915 -0.596 18003
2976 1 5 . 1 1 86 86 TYR C C 87 173.808 173.808 175.748 -1.940 18003
2977 1 5 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.733 -0.268 18003
2978 1 5 . 1 1 86 86 TYR CB C 87 41.480 41.480 40.646 0.834 18003
2979 1 5 . 1 1 86 86 TYR H H 87 8.488 8.488 8.684 -0.196 18003
2980 1 5 . 1 1 87 87 SER N N 88 110.681 110.681 115.415 -4.734 18003
2981 1 5 . 1 1 87 87 SER HA H 88 5.414 5.414 4.879 0.535 18003
2982 1 5 . 1 1 87 87 SER C C 88 174.693 174.693 173.177 1.516 18003
2983 1 5 . 1 1 87 87 SER CA C 88 56.113 56.113 56.713 -0.600 18003
2984 1 5 . 1 1 87 87 SER CB C 88 66.309 66.309 67.318 -1.009 18003
2985 1 5 . 1 1 87 87 SER H H 88 8.718 8.718 9.242 -0.524 18003
2986 1 5 . 1 1 88 88 LEU N N 89 119.612 119.612 122.480 -2.868 18003
2987 1 5 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.318 0.609 18003
2988 1 5 . 1 1 88 88 LEU C C 89 179.031 179.031 177.046 1.985 18003
2989 1 5 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.010 0.315 18003
2990 1 5 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.522 -0.802 18003
2991 1 5 . 1 1 88 88 LEU H H 89 9.034 9.034 8.467 0.567 18003
2992 1 5 . 1 1 89 89 TYR N N 90 120.540 120.540 124.251 -3.711 18003
2993 1 5 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.176 0.446 18003
2994 1 5 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.913 0.800 18003
2995 1 5 . 1 1 89 89 TYR H H 90 8.075 8.075 8.401 -0.326 18003
2996 1 5 . 1 1 92 92 HIS C C 93 177.850 177.850 177.203 0.647 18003
2997 1 5 . 1 1 93 93 VAL N N 94 120.211 120.211 118.273 1.938 18003
2998 1 5 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.719 -0.218 18003
2999 1 5 . 1 1 93 93 VAL C C 94 176.785 176.785 177.806 -1.021 18003
3000 1 5 . 1 1 93 93 VAL CA C 94 66.666 66.666 66.501 0.165 18003
3001 1 5 . 1 1 93 93 VAL CB C 94 31.637 31.637 30.905 0.732 18003
3002 1 5 . 1 1 93 93 VAL H H 94 8.164 8.164 8.322 -0.158 18003
3003 1 5 . 1 1 94 94 ALA N N 95 119.221 119.221 119.810 -0.589 18003
3004 1 5 . 1 1 94 94 ALA HA H 95 3.790 3.790 4.072 -0.282 18003
3005 1 5 . 1 1 94 94 ALA C C 95 177.979 177.979 179.963 -1.984 18003
3006 1 5 . 1 1 94 94 ALA CA C 95 55.479 55.479 54.985 0.494 18003
3007 1 5 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.388 -0.278 18003
3008 1 5 . 1 1 94 94 ALA H H 95 6.942 6.942 7.488 -0.546 18003
3009 1 5 . 1 1 95 95 GLN N N 96 115.416 115.416 118.660 -3.244 18003
3010 1 5 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.085 -0.050 18003
3011 1 5 . 1 1 95 95 GLN C C 96 177.993 177.993 178.728 -0.735 18003
3012 1 5 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.637 0.205 18003
3013 1 5 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.502 -0.473 18003
3014 1 5 . 1 1 95 95 GLN H H 96 7.795 7.795 7.981 -0.186 18003
3015 1 5 . 1 1 96 96 LEU N N 97 120.758 120.758 118.045 2.713 18003
3016 1 5 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.305 -0.456 18003
3017 1 5 . 1 1 96 96 LEU C C 97 177.974 177.974 179.156 -1.182 18003
3018 1 5 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.023 1.259 18003
3019 1 5 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.163 -0.117 18003
3020 1 5 . 1 1 96 96 LEU H H 97 8.197 8.197 8.266 -0.069 18003
3021 1 5 . 1 1 97 97 LEU N N 98 117.567 117.567 120.638 -3.071 18003
3022 1 5 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.980 -0.150 18003
3023 1 5 . 1 1 97 97 LEU C C 98 178.219 178.219 178.292 -0.073 18003
3024 1 5 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.532 -0.802 18003
3025 1 5 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.756 0.106 18003
3026 1 5 . 1 1 97 97 LEU H H 98 7.660 7.660 8.191 -0.531 18003
3027 1 5 . 1 1 98 98 ASP N N 99 118.607 118.607 119.564 -0.957 18003
3028 1 5 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.390 -0.281 18003
3029 1 5 . 1 1 98 98 ASP C C 99 179.382 179.382 179.220 0.162 18003
3030 1 5 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.731 0.304 18003
3031 1 5 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.258 -0.419 18003
3032 1 5 . 1 1 98 98 ASP H H 99 8.295 8.295 8.591 -0.296 18003
3033 1 5 . 1 1 99 99 GLU N N 100 117.542 117.542 120.429 -2.887 18003
3034 1 5 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.194 -0.345 18003
3035 1 5 . 1 1 99 99 GLU C C 100 179.389 179.389 178.963 0.426 18003
3036 1 5 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.208 -1.185 18003
3037 1 5 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.732 -0.703 18003
3038 1 5 . 1 1 99 99 GLU H H 100 8.334 8.334 7.849 0.485 18003
3039 1 5 . 1 1 100 100 ALA N N 101 122.890 122.890 123.958 -1.068 18003
3040 1 5 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.144 -0.146 18003
3041 1 5 . 1 1 100 100 ALA C C 101 180.184 180.184 179.771 0.413 18003
3042 1 5 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.316 0.205 18003
3043 1 5 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.682 -1.063 18003
3044 1 5 . 1 1 100 100 ALA H H 101 8.550 8.550 8.572 -0.022 18003
3045 1 5 . 1 1 101 101 ILE N N 102 119.952 119.952 119.486 0.466 18003
3046 1 5 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.794 -0.205 18003
3047 1 5 . 1 1 101 101 ILE C C 102 178.114 178.114 177.529 0.585 18003
3048 1 5 . 1 1 101 101 ILE CA C 102 65.376 65.376 63.949 1.427 18003
3049 1 5 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.273 0.756 18003
3050 1 5 . 1 1 101 101 ILE H H 102 8.493 8.493 8.612 -0.119 18003
3051 1 5 . 1 1 102 102 TYR N N 103 120.625 120.625 120.675 -0.050 18003
3052 1 5 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.036 0.135 18003
3053 1 5 . 1 1 102 102 TYR C C 103 179.772 179.772 177.787 1.985 18003
3054 1 5 . 1 1 102 102 TYR CA C 103 60.724 60.724 62.290 -1.566 18003
3055 1 5 . 1 1 102 102 TYR CB C 103 37.500 37.500 38.385 -0.885 18003
3056 1 5 . 1 1 102 102 TYR H H 103 8.520 8.520 8.160 0.360 18003
3057 1 5 . 1 1 103 103 HIS N N 104 117.456 117.456 118.174 -0.718 18003
3058 1 5 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.084 0.341 18003
3059 1 5 . 1 1 103 103 HIS C C 104 176.377 176.377 177.507 -1.130 18003
3060 1 5 . 1 1 103 103 HIS CA C 104 60.043 60.043 59.488 0.555 18003
3061 1 5 . 1 1 103 103 HIS CB C 104 29.029 29.029 30.024 -0.995 18003
3062 1 5 . 1 1 103 103 HIS H H 104 8.622 8.622 8.539 0.083 18003
3063 1 5 . 1 1 104 104 SER N N 105 113.596 113.596 114.261 -0.665 18003
3064 1 5 . 1 1 104 104 SER C C 105 176.712 176.712 176.666 0.046 18003
3065 1 5 . 1 1 104 104 SER CA C 105 61.852 61.852 61.018 0.834 18003
3066 1 5 . 1 1 104 104 SER CB C 105 63.550 63.550 63.267 0.283 18003
3067 1 5 . 1 1 104 104 SER H H 105 7.900 7.900 8.191 -0.291 18003
3068 1 5 . 1 1 105 105 GLU N N 106 119.022 119.022 119.075 -0.053 18003
3069 1 5 . 1 1 105 105 GLU HA H 106 4.013 4.013 4.181 -0.168 18003
3070 1 5 . 1 1 105 105 GLU C C 106 177.902 177.902 178.366 -0.464 18003
3071 1 5 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.101 -0.070 18003
3072 1 5 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.307 -0.028 18003
3073 1 5 . 1 1 105 105 GLU H H 106 8.181 8.181 8.489 -0.308 18003
3074 1 5 . 1 1 106 106 HIS N N 107 116.482 116.482 118.687 -2.205 18003
3075 1 5 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.103 0.304 18003
3076 1 5 . 1 1 106 106 HIS C C 107 175.575 175.575 176.598 -1.023 18003
3077 1 5 . 1 1 106 106 HIS CA C 107 57.343 57.343 58.638 -1.295 18003
3078 1 5 . 1 1 106 106 HIS CB C 107 28.580 28.580 29.717 -1.137 18003
3079 1 5 . 1 1 106 106 HIS H H 107 7.770 7.770 7.615 0.155 18003
3080 1 5 . 1 1 107 107 LEU N N 108 120.346 120.346 117.098 3.248 18003
3081 1 5 . 1 1 107 107 LEU HA H 108 4.054 4.054 3.986 0.068 18003
3082 1 5 . 1 1 107 107 LEU C C 108 177.404 177.404 177.156 0.248 18003
3083 1 5 . 1 1 107 107 LEU CA C 108 55.991 55.991 55.284 0.707 18003
3084 1 5 . 1 1 107 107 LEU CB C 108 42.030 42.030 42.505 -0.475 18003
3085 1 5 . 1 1 107 107 LEU H H 108 7.682 7.682 7.713 -0.031 18003
3086 1 5 . 1 1 108 108 HIS N N 109 117.222 117.222 118.093 -0.871 18003
3087 1 5 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.144 -0.090 18003
3088 1 5 . 1 1 108 108 HIS C C 109 174.606 174.606 175.668 -1.062 18003
3089 1 5 . 1 1 108 108 HIS CA C 109 56.029 56.029 56.167 -0.138 18003
3090 1 5 . 1 1 108 108 HIS CB C 109 28.517 28.517 29.227 -0.711 18003
3091 1 5 . 1 1 108 108 HIS H H 109 8.030 8.030 7.808 0.222 18003
3092 1 5 . 1 1 109 109 LEU N N 110 121.114 121.114 125.349 -4.235 18003
3093 1 5 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.132 0.166 18003
3094 1 5 . 1 1 109 109 LEU C C 110 178.028 178.028 178.226 -0.198 18003
3095 1 5 . 1 1 109 109 LEU CA C 110 55.574 55.574 56.122 -0.548 18003
3096 1 5 . 1 1 109 109 LEU CB C 110 42.076 42.076 42.029 0.047 18003
3097 1 5 . 1 1 109 109 LEU H H 110 7.973 7.973 8.431 -0.458 18003
3098 1 5 . 1 1 110 110 GLY N N 111 108.631 108.631 105.097 3.534 18003
3099 1 5 . 1 1 110 110 GLY C C 111 174.606 174.606 173.852 0.754 18003
3100 1 5 . 1 1 110 110 GLY CA C 111 45.580 45.580 45.473 0.107 18003
3101 1 5 . 1 1 110 110 GLY H H 111 8.255 8.255 7.908 0.347 18003
3102 1 5 . 1 1 111 111 LEU N N 112 121.022 121.022 120.791 0.231 18003
3103 1 5 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.626 -0.267 18003
3104 1 5 . 1 1 111 111 LEU C C 112 177.701 177.701 176.028 1.673 18003
3105 1 5 . 1 1 111 111 LEU CA C 112 55.476 55.476 54.290 1.186 18003
3106 1 5 . 1 1 111 111 LEU CB C 112 41.899 41.899 42.295 -0.396 18003
3107 1 5 . 1 1 111 111 LEU H H 112 7.981 7.981 7.555 0.426 18003
3108 1 5 . 1 1 112 112 SER N N 113 115.471 115.471 120.271 -4.800 18003
3109 1 5 . 1 1 112 112 SER HA H 113 4.432 4.432 4.671 -0.239 18003
3110 1 5 . 1 1 112 112 SER C C 113 174.381 174.381 173.359 1.022 18003
3111 1 5 . 1 1 112 112 SER CA C 113 58.527 58.527 57.425 1.101 18003
3112 1 5 . 1 1 112 112 SER CB C 113 63.593 63.593 65.133 -1.540 18003
3113 1 5 . 1 1 112 112 SER H H 113 8.215 8.215 8.467 -0.252 18003
3114 1 5 . 1 1 113 113 ASP N N 114 121.696 121.696 122.004 -0.308 18003
3115 1 5 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.780 -0.353 18003
3116 1 5 . 1 1 113 113 ASP C C 114 175.958 175.958 175.587 0.371 18003
3117 1 5 . 1 1 113 113 ASP CA C 114 54.213 54.213 53.270 0.943 18003
3118 1 5 . 1 1 113 113 ASP CB C 114 41.030 41.030 40.181 0.849 18003
3119 1 5 . 1 1 113 113 ASP H H 114 8.203 8.203 8.503 -0.300 18003
3120 1 5 . 1 1 114 114 ARG N N 115 120.088 120.088 123.261 -3.173 18003
3121 1 5 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.154 0.118 18003
3122 1 5 . 1 1 114 114 ARG C C 115 175.792 175.792 175.565 0.227 18003
3123 1 5 . 1 1 114 114 ARG CA C 115 55.735 55.735 55.808 -0.073 18003
3124 1 5 . 1 1 114 114 ARG CB C 115 30.586 30.586 31.061 -0.475 18003
3125 1 5 . 1 1 114 114 ARG H H 115 8.016 8.016 8.255 -0.239 18003
3126 1 5 . 1 1 115 115 HIS N N 116 120.597 120.597 120.500 0.097 18003
3127 1 5 . 1 1 115 115 HIS CA C 116 53.697 53.697 53.690 0.007 18003
3128 1 5 . 1 1 115 115 HIS CB C 116 29.299 29.299 29.478 -0.179 18003
3129 1 5 . 1 1 115 115 HIS H H 116 8.385 8.385 7.728 0.657 18003
3130 1 5 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.371 0.111 18003
3131 1 5 . 1 1 116 116 PRO C C 117 177.090 177.090 177.208 -0.118 18003
3132 1 5 . 1 1 116 116 PRO CA C 117 63.177 63.177 63.602 -0.425 18003
3133 1 5 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.030 -0.210 18003
3134 1 5 . 1 1 117 117 SER N N 118 116.220 116.220 115.472 0.748 18003
3135 1 5 . 1 1 117 117 SER HA H 118 4.465 4.465 4.490 -0.025 18003
3136 1 5 . 1 1 117 117 SER C C 118 174.287 174.287 173.991 0.296 18003
3137 1 5 . 1 1 117 117 SER CA C 118 58.110 58.110 57.555 0.555 18003
3138 1 5 . 1 1 117 117 SER CB C 118 63.750 63.750 64.166 -0.416 18003
3139 1 5 . 1 1 117 117 SER H H 118 8.487 8.487 7.830 0.657 18003
3140 1 5 . 1 1 118 118 ALA N N 119 126.082 126.082 123.915 2.167 18003
3141 1 5 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.362 0.077 18003
3142 1 5 . 1 1 118 118 ALA C C 119 176.879 176.879 178.627 -1.748 18003
3143 1 5 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.445 0.004 18003
3144 1 5 . 1 1 118 118 ALA CB C 119 19.483 19.483 18.916 0.567 18003
3145 1 5 . 1 1 118 118 ALA H H 119 8.295 8.295 8.221 0.074 18003
3146 1 6 . 1 1 2 2 HIS C C 3 175.176 175.176 175.089 0.087 18003
3147 1 6 . 1 1 2 2 HIS CA C 3 55.900 55.900 56.289 -0.389 18003
3148 1 6 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.639 -0.610 18003
3149 1 6 . 1 1 3 3 GLY N N 4 110.613 110.613 110.364 0.249 18003
3150 1 6 . 1 1 3 3 GLY C C 4 174.068 174.068 173.947 0.121 18003
3151 1 6 . 1 1 3 3 GLY CA C 4 45.141 45.141 44.925 0.215 18003
3152 1 6 . 1 1 3 3 GLY H H 4 8.500 8.500 8.358 0.142 18003
3153 1 6 . 1 1 4 4 VAL N N 5 119.318 119.318 119.849 -0.531 18003
3154 1 6 . 1 1 4 4 VAL HA H 5 4.128 4.128 3.828 0.300 18003
3155 1 6 . 1 1 4 4 VAL C C 5 176.361 176.361 175.000 1.361 18003
3156 1 6 . 1 1 4 4 VAL CA C 5 61.987 61.987 63.953 -1.966 18003
3157 1 6 . 1 1 4 4 VAL CB C 5 32.635 32.635 32.117 0.518 18003
3158 1 6 . 1 1 4 4 VAL H H 5 8.094 8.094 8.106 -0.012 18003
3159 1 6 . 1 1 5 5 GLU N N 6 124.369 124.369 119.253 5.116 18003
3160 1 6 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.369 -0.081 18003
3161 1 6 . 1 1 5 5 GLU C C 6 177.012 177.012 176.451 0.561 18003
3162 1 6 . 1 1 5 5 GLU CA C 6 56.699 56.699 56.615 0.084 18003
3163 1 6 . 1 1 5 5 GLU CB C 6 30.029 30.029 30.177 -0.148 18003
3164 1 6 . 1 1 5 5 GLU H H 6 8.545 8.545 7.929 0.616 18003
3165 1 6 . 1 1 6 6 GLY N N 7 109.747 109.747 110.158 -0.411 18003
3166 1 6 . 1 1 6 6 GLY C C 7 174.117 174.117 175.449 -1.332 18003
3167 1 6 . 1 1 6 6 GLY CA C 7 45.568 45.568 45.020 0.548 18003
3168 1 6 . 1 1 6 6 GLY H H 7 8.352 8.352 8.546 -0.194 18003
3169 1 6 . 1 1 7 7 ARG N N 8 120.059 120.059 120.068 -0.009 18003
3170 1 6 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.058 0.284 18003
3171 1 6 . 1 1 7 7 ARG C C 8 176.016 176.016 175.959 0.057 18003
3172 1 6 . 1 1 7 7 ARG CA C 8 55.833 55.833 57.776 -1.942 18003
3173 1 6 . 1 1 7 7 ARG CB C 8 30.444 30.444 30.582 -0.138 18003
3174 1 6 . 1 1 7 7 ARG H H 8 8.084 8.084 8.462 -0.378 18003
3175 1 6 . 1 1 8 8 ASN N N 9 119.379 119.379 115.535 3.844 18003
3176 1 6 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.794 -0.462 18003
3177 1 6 . 1 1 8 8 ASN C C 9 174.667 174.667 174.216 0.451 18003
3178 1 6 . 1 1 8 8 ASN CA C 9 53.441 53.441 52.078 1.363 18003
3179 1 6 . 1 1 8 8 ASN CB C 9 38.480 38.480 37.647 0.833 18003
3180 1 6 . 1 1 8 8 ASN H H 9 8.411 8.411 8.003 0.408 18003
3181 1 6 . 1 1 9 9 ARG N N 10 121.700 121.700 117.748 3.952 18003
3182 1 6 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.092 0.557 18003
3183 1 6 . 1 1 9 9 ARG CA C 10 53.147 53.147 56.542 -3.395 18003
3184 1 6 . 1 1 9 9 ARG CB C 10 30.197 30.197 28.652 1.545 18003
3185 1 6 . 1 1 9 9 ARG H H 10 8.138 8.138 7.374 0.764 18003
3186 1 6 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.466 -0.023 18003
3187 1 6 . 1 1 10 10 PRO C C 11 176.815 176.815 176.483 0.332 18003
3188 1 6 . 1 1 10 10 PRO CA C 11 63.177 63.177 63.408 -0.231 18003
3189 1 6 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.333 -0.513 18003
3190 1 6 . 1 1 11 11 SER N N 12 116.291 116.291 116.566 -0.275 18003
3191 1 6 . 1 1 11 11 SER HA H 12 4.418 4.418 4.407 0.011 18003
3192 1 6 . 1 1 11 11 SER C C 12 173.702 173.702 173.922 -0.220 18003
3193 1 6 . 1 1 11 11 SER CA C 12 58.031 58.031 58.167 -0.136 18003
3194 1 6 . 1 1 11 11 SER CB C 12 64.032 64.032 64.049 -0.017 18003
3195 1 6 . 1 1 11 11 SER H H 12 8.325 8.325 8.230 0.095 18003
3196 1 6 . 1 1 12 12 ALA N N 13 126.862 126.862 123.984 2.878 18003
3197 1 6 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.539 -0.151 18003
3198 1 6 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.053 -0.595 18003
3199 1 6 . 1 1 12 12 ALA CB C 13 18.257 18.257 19.544 -1.287 18003
3200 1 6 . 1 1 12 12 ALA H H 13 8.166 8.166 7.719 0.447 18003
3201 1 6 . 1 1 13 13 PRO C C 14 176.368 176.368 176.475 -0.107 18003
3202 1 6 . 1 1 13 13 PRO CA C 14 62.937 62.937 63.003 -0.066 18003
3203 1 6 . 1 1 13 13 PRO CB C 14 32.022 32.022 30.506 1.516 18003
3204 1 6 . 1 1 14 14 LEU N N 15 120.969 120.969 125.183 -4.214 18003
3205 1 6 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.232 0.026 18003
3206 1 6 . 1 1 14 14 LEU C C 15 176.124 176.124 178.055 -1.931 18003
3207 1 6 . 1 1 14 14 LEU CA C 15 54.527 54.527 55.208 -0.681 18003
3208 1 6 . 1 1 14 14 LEU CB C 15 43.418 43.418 42.060 1.358 18003
3209 1 6 . 1 1 14 14 LEU H H 15 7.875 7.875 7.720 0.155 18003
3210 1 6 . 1 1 15 15 ASP N N 16 121.780 121.780 118.640 3.140 18003
3211 1 6 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.629 -0.036 18003
3212 1 6 . 1 1 15 15 ASP C C 16 176.208 176.208 178.299 -2.091 18003
3213 1 6 . 1 1 15 15 ASP CA C 16 52.468 52.468 56.179 -3.711 18003
3214 1 6 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.683 0.946 18003
3215 1 6 . 1 1 15 15 ASP H H 16 7.850 7.850 8.530 -0.680 18003
3216 1 6 . 1 1 16 16 SER N N 17 114.435 114.435 116.231 -1.796 18003
3217 1 6 . 1 1 16 16 SER HA H 17 4.120 4.120 4.052 0.068 18003
3218 1 6 . 1 1 16 16 SER C C 17 177.207 177.207 176.111 1.096 18003
3219 1 6 . 1 1 16 16 SER CA C 17 62.322 62.322 61.303 1.019 18003
3220 1 6 . 1 1 16 16 SER H H 17 8.658 8.658 8.099 0.559 18003
3221 1 6 . 1 1 17 17 GLN N N 18 122.403 122.403 121.388 1.015 18003
3222 1 6 . 1 1 17 17 GLN HA H 18 4.197 4.197 3.917 0.280 18003
3223 1 6 . 1 1 17 17 GLN C C 18 178.715 178.715 177.837 0.878 18003
3224 1 6 . 1 1 17 17 GLN CA C 18 58.113 58.113 59.227 -1.114 18003
3225 1 6 . 1 1 17 17 GLN CB C 18 28.040 28.040 27.668 0.373 18003
3226 1 6 . 1 1 17 17 GLN H H 18 8.140 8.140 8.418 -0.278 18003
3227 1 6 . 1 1 18 18 ALA N N 19 124.743 124.743 121.601 3.142 18003
3228 1 6 . 1 1 18 18 ALA HA H 19 4.176 4.176 3.928 0.248 18003
3229 1 6 . 1 1 18 18 ALA C C 19 180.616 180.616 179.496 1.120 18003
3230 1 6 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.938 -0.333 18003
3231 1 6 . 1 1 18 18 ALA CB C 19 19.028 19.028 17.875 1.153 18003
3232 1 6 . 1 1 18 18 ALA H H 19 8.455 8.455 7.977 0.478 18003
3233 1 6 . 1 1 19 19 ALA N N 20 119.089 119.089 120.558 -1.469 18003
3234 1 6 . 1 1 19 19 ALA HA H 20 4.179 4.179 3.993 0.186 18003
3235 1 6 . 1 1 19 19 ALA C C 20 179.239 179.239 179.464 -0.225 18003
3236 1 6 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.746 0.525 18003
3237 1 6 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.358 -0.166 18003
3238 1 6 . 1 1 19 19 ALA H H 20 8.993 8.993 7.745 1.248 18003
3239 1 6 . 1 1 20 20 ALA N N 21 119.226 119.226 121.265 -2.039 18003
3240 1 6 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.891 0.169 18003
3241 1 6 . 1 1 20 20 ALA C C 21 180.230 180.230 179.632 0.598 18003
3242 1 6 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.177 -0.034 18003
3243 1 6 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.061 -0.033 18003
3244 1 6 . 1 1 20 20 ALA H H 21 7.724 7.724 8.653 -0.929 18003
3245 1 6 . 1 1 21 21 GLN N N 22 119.310 119.310 118.699 0.611 18003
3246 1 6 . 1 1 21 21 GLN HA H 22 4.129 4.129 4.015 0.114 18003
3247 1 6 . 1 1 21 21 GLN C C 22 179.319 179.319 178.659 0.660 18003
3248 1 6 . 1 1 21 21 GLN CA C 22 58.762 58.762 58.678 0.084 18003
3249 1 6 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.421 -0.392 18003
3250 1 6 . 1 1 21 21 GLN H H 22 7.638 7.638 8.537 -0.899 18003
3251 1 6 . 1 1 22 22 VAL N N 23 121.565 121.565 119.719 1.846 18003
3252 1 6 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.626 0.340 18003
3253 1 6 . 1 1 22 22 VAL C C 23 178.026 178.026 177.923 0.103 18003
3254 1 6 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.218 -0.076 18003
3255 1 6 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.631 -0.665 18003
3256 1 6 . 1 1 22 22 VAL H H 23 8.442 8.442 7.789 0.653 18003
3257 1 6 . 1 1 23 23 ALA N N 24 121.400 121.400 122.015 -0.615 18003
3258 1 6 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.914 0.182 18003
3259 1 6 . 1 1 23 23 ALA C C 24 178.758 178.758 179.552 -0.794 18003
3260 1 6 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.435 0.480 18003
3261 1 6 . 1 1 23 23 ALA CB C 24 16.650 16.650 18.078 -1.428 18003
3262 1 6 . 1 1 23 23 ALA H H 24 8.495 8.495 8.694 -0.199 18003
3263 1 6 . 1 1 24 24 SER N N 25 112.138 112.138 113.993 -1.855 18003
3264 1 6 . 1 1 24 24 SER HA H 25 4.093 4.093 4.141 -0.048 18003
3265 1 6 . 1 1 24 24 SER C C 25 177.271 177.271 176.649 0.622 18003
3266 1 6 . 1 1 24 24 SER CA C 25 62.166 62.166 61.580 0.586 18003
3267 1 6 . 1 1 24 24 SER CB C 25 63.032 63.032 62.937 0.095 18003
3268 1 6 . 1 1 24 24 SER H H 25 7.936 7.936 8.653 -0.717 18003
3269 1 6 . 1 1 25 25 THR N N 26 119.701 119.701 119.525 0.176 18003
3270 1 6 . 1 1 25 25 THR HA H 26 4.380 4.380 3.954 0.426 18003
3271 1 6 . 1 1 25 25 THR C C 26 175.456 175.456 176.723 -1.267 18003
3272 1 6 . 1 1 25 25 THR CA C 26 67.129 67.129 66.751 0.377 18003
3273 1 6 . 1 1 25 25 THR CB C 26 68.800 68.800 68.815 -0.015 18003
3274 1 6 . 1 1 25 25 THR H H 26 7.775 7.775 7.643 0.132 18003
3275 1 6 . 1 1 26 26 LEU N N 27 119.270 119.270 120.248 -0.978 18003
3276 1 6 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.124 -0.561 18003
3277 1 6 . 1 1 26 26 LEU C C 27 178.390 178.390 178.852 -0.462 18003
3278 1 6 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.400 0.269 18003
3279 1 6 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.135 0.895 18003
3280 1 6 . 1 1 26 26 LEU H H 27 8.006 8.006 7.981 0.025 18003
3281 1 6 . 1 1 27 27 GLN N N 28 115.843 115.843 119.633 -3.790 18003
3282 1 6 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.064 -0.260 18003
3283 1 6 . 1 1 27 27 GLN C C 28 178.657 178.657 178.559 0.098 18003
3284 1 6 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.815 -0.103 18003
3285 1 6 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.889 -0.860 18003
3286 1 6 . 1 1 27 27 GLN H H 28 8.485 8.485 8.197 0.288 18003
3287 1 6 . 1 1 28 28 ALA N N 29 118.779 118.779 123.457 -4.678 18003
3288 1 6 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.023 -0.015 18003
3289 1 6 . 1 1 28 28 ALA C C 29 178.259 178.259 179.554 -1.295 18003
3290 1 6 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.844 -0.882 18003
3291 1 6 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.437 0.301 18003
3292 1 6 . 1 1 28 28 ALA H H 29 7.432 7.432 8.160 -0.728 18003
3293 1 6 . 1 1 29 29 LEU N N 30 113.442 113.442 118.386 -4.944 18003
3294 1 6 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.957 0.040 18003
3295 1 6 . 1 1 29 29 LEU C C 30 175.924 175.924 176.734 -0.810 18003
3296 1 6 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.659 -1.095 18003
3297 1 6 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.585 0.681 18003
3298 1 6 . 1 1 29 29 LEU H H 30 7.311 7.311 7.796 -0.485 18003
3299 1 6 . 1 1 30 30 ALA N N 31 119.563 119.563 118.744 0.819 18003
3300 1 6 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.179 -0.007 18003
3301 1 6 . 1 1 30 30 ALA C C 31 176.316 176.316 176.865 -0.549 18003
3302 1 6 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.594 -1.938 18003
3303 1 6 . 1 1 30 30 ALA CB C 31 18.077 18.077 19.090 -1.013 18003
3304 1 6 . 1 1 30 30 ALA H H 31 7.223 7.223 7.349 -0.126 18003
3305 1 6 . 1 1 31 31 THR N N 32 114.613 114.613 111.651 2.962 18003
3306 1 6 . 1 1 31 31 THR HA H 32 4.950 4.950 4.139 0.811 18003
3307 1 6 . 1 1 31 31 THR CA C 32 58.129 58.129 62.910 -4.781 18003
3308 1 6 . 1 1 31 31 THR CB C 32 69.098 69.098 68.009 1.089 18003
3309 1 6 . 1 1 31 31 THR H H 32 8.399 8.399 8.429 -0.030 18003
3310 1 6 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.202 0.236 18003
3311 1 6 . 1 1 32 32 PRO C C 33 178.207 178.207 179.018 -0.811 18003
3312 1 6 . 1 1 32 32 PRO CA C 33 66.905 66.905 65.936 0.969 18003
3313 1 6 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.706 -0.442 18003
3314 1 6 . 1 1 33 33 SER N N 34 110.767 110.767 114.410 -3.643 18003
3315 1 6 . 1 1 33 33 SER HA H 34 4.026 4.026 4.142 -0.116 18003
3316 1 6 . 1 1 33 33 SER C C 34 176.742 176.742 176.702 0.040 18003
3317 1 6 . 1 1 33 33 SER CA C 34 61.782 61.782 61.648 0.134 18003
3318 1 6 . 1 1 33 33 SER CB C 34 62.432 62.432 62.765 -0.333 18003
3319 1 6 . 1 1 33 33 SER H H 34 8.407 8.407 8.373 0.034 18003
3320 1 6 . 1 1 34 34 ARG N N 35 120.135 120.135 122.741 -2.606 18003
3321 1 6 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.073 -0.019 18003
3322 1 6 . 1 1 34 34 ARG C C 35 178.283 178.283 178.295 -0.012 18003
3323 1 6 . 1 1 34 34 ARG CA C 35 60.532 60.532 59.232 1.300 18003
3324 1 6 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.984 -1.031 18003
3325 1 6 . 1 1 34 34 ARG H H 35 7.341 7.341 8.083 -0.742 18003
3326 1 6 . 1 1 35 35 LEU N N 36 118.454 118.454 121.032 -2.578 18003
3327 1 6 . 1 1 35 35 LEU HA H 36 4.054 4.054 3.966 0.088 18003
3328 1 6 . 1 1 35 35 LEU C C 36 180.643 180.643 178.756 1.887 18003
3329 1 6 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.194 -0.385 18003
3330 1 6 . 1 1 35 35 LEU CB C 36 41.778 41.778 42.019 -0.241 18003
3331 1 6 . 1 1 35 35 LEU H H 36 8.226 8.226 8.616 -0.390 18003
3332 1 6 . 1 1 36 36 MET N N 37 121.073 121.073 118.919 2.154 18003
3333 1 6 . 1 1 36 36 MET HA H 37 3.928 3.928 4.065 -0.137 18003
3334 1 6 . 1 1 36 36 MET C C 37 177.671 177.671 178.291 -0.620 18003
3335 1 6 . 1 1 36 36 MET CA C 37 60.613 60.613 58.419 2.194 18003
3336 1 6 . 1 1 36 36 MET CB C 37 33.128 33.128 32.223 0.905 18003
3337 1 6 . 1 1 36 36 MET H H 37 8.447 8.447 8.015 0.432 18003
3338 1 6 . 1 1 37 37 ILE N N 38 118.239 118.239 119.280 -1.041 18003
3339 1 6 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.775 -0.335 18003
3340 1 6 . 1 1 37 37 ILE C C 38 177.092 177.092 178.295 -1.203 18003
3341 1 6 . 1 1 37 37 ILE CA C 38 65.675 65.675 64.131 1.544 18003
3342 1 6 . 1 1 37 37 ILE CB C 38 38.255 38.255 36.560 1.694 18003
3343 1 6 . 1 1 37 37 ILE H H 38 7.763 7.763 7.961 -0.198 18003
3344 1 6 . 1 1 38 38 LEU N N 39 116.073 116.073 121.987 -5.914 18003
3345 1 6 . 1 1 38 38 LEU HA H 39 3.826 3.826 4.022 -0.196 18003
3346 1 6 . 1 1 38 38 LEU C C 39 178.941 178.941 179.227 -0.286 18003
3347 1 6 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.602 -0.571 18003
3348 1 6 . 1 1 38 38 LEU CB C 39 41.780 41.780 40.717 1.063 18003
3349 1 6 . 1 1 38 38 LEU H H 39 8.538 8.538 8.621 -0.083 18003
3350 1 6 . 1 1 39 39 THR N N 40 106.678 106.678 115.736 -9.058 18003
3351 1 6 . 1 1 39 39 THR HA H 40 3.932 3.932 3.955 -0.023 18003
3352 1 6 . 1 1 39 39 THR C C 40 177.747 177.747 176.664 1.083 18003
3353 1 6 . 1 1 39 39 THR CA C 40 65.536 65.536 67.182 -1.646 18003
3354 1 6 . 1 1 39 39 THR CB C 40 68.360 68.360 68.168 0.192 18003
3355 1 6 . 1 1 39 39 THR H H 40 8.086 8.086 8.832 -0.746 18003
3356 1 6 . 1 1 40 40 GLN N N 41 122.344 122.344 121.428 0.916 18003
3357 1 6 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.089 -0.083 18003
3358 1 6 . 1 1 40 40 GLN C C 41 178.348 178.348 178.325 0.023 18003
3359 1 6 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.803 -0.878 18003
3360 1 6 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.237 -0.717 18003
3361 1 6 . 1 1 40 40 GLN H H 41 7.593 7.593 7.693 -0.100 18003
3362 1 6 . 1 1 41 41 LEU N N 42 116.302 116.302 118.139 -1.837 18003
3363 1 6 . 1 1 41 41 LEU C C 42 178.418 178.418 178.897 -0.479 18003
3364 1 6 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.115 -1.584 18003
3365 1 6 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.880 -0.531 18003
3366 1 6 . 1 1 41 41 LEU H H 42 7.570 7.570 7.651 -0.081 18003
3367 1 6 . 1 1 42 42 ARG N N 43 119.954 119.954 118.408 1.546 18003
3368 1 6 . 1 1 42 42 ARG HA H 43 3.915 3.915 4.073 -0.158 18003
3369 1 6 . 1 1 42 42 ARG C C 43 177.205 177.205 178.179 -0.974 18003
3370 1 6 . 1 1 42 42 ARG CA C 43 58.704 58.704 58.551 0.153 18003
3371 1 6 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.243 -0.800 18003
3372 1 6 . 1 1 42 42 ARG H H 43 7.612 7.612 8.136 -0.524 18003
3373 1 6 . 1 1 43 43 ASN N N 44 114.682 114.682 117.262 -2.580 18003
3374 1 6 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.580 0.180 18003
3375 1 6 . 1 1 43 43 ASN C C 44 174.507 174.507 175.403 -0.896 18003
3376 1 6 . 1 1 43 43 ASN CA C 44 53.953 53.953 54.857 -0.904 18003
3377 1 6 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.796 -0.766 18003
3378 1 6 . 1 1 43 43 ASN H H 44 7.567 7.567 7.859 -0.292 18003
3379 1 6 . 1 1 44 44 GLY N N 45 109.113 109.113 106.681 2.432 18003
3380 1 6 . 1 1 44 44 GLY CA C 45 44.268 44.268 44.515 -0.247 18003
3381 1 6 . 1 1 44 44 GLY H H 45 7.361 7.361 7.494 -0.133 18003
3382 1 6 . 1 1 45 45 PRO C C 46 178.412 178.412 176.945 1.467 18003
3383 1 6 . 1 1 45 45 PRO CA C 46 62.580 62.580 63.292 -0.712 18003
3384 1 6 . 1 1 45 45 PRO CB C 46 33.129 33.129 32.542 0.587 18003
3385 1 6 . 1 1 46 46 LEU N N 47 120.363 120.363 114.229 6.134 18003
3386 1 6 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.123 0.908 18003
3387 1 6 . 1 1 46 46 LEU CA C 47 52.550 52.550 54.572 -2.022 18003
3388 1 6 . 1 1 46 46 LEU CB C 47 48.210 48.210 40.678 7.532 18003
3389 1 6 . 1 1 46 46 LEU H H 47 8.252 8.252 8.035 0.217 18003
3390 1 6 . 1 1 47 47 PRO C C 48 177.313 177.313 177.859 -0.546 18003
3391 1 6 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.215 -0.380 18003
3392 1 6 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.610 -0.227 18003
3393 1 6 . 1 1 48 48 VAL N N 49 119.384 119.384 120.084 -0.700 18003
3394 1 6 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.713 -0.106 18003
3395 1 6 . 1 1 48 48 VAL C C 49 176.710 176.710 178.115 -1.405 18003
3396 1 6 . 1 1 48 48 VAL CA C 49 66.188 66.188 67.490 -1.302 18003
3397 1 6 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.310 0.271 18003
3398 1 6 . 1 1 48 48 VAL H H 49 9.074 9.074 8.718 0.356 18003
3399 1 6 . 1 1 49 49 THR N N 50 111.293 111.293 114.169 -2.876 18003
3400 1 6 . 1 1 49 49 THR HA H 50 4.181 4.181 4.334 -0.153 18003
3401 1 6 . 1 1 49 49 THR C C 50 176.717 176.717 176.087 0.630 18003
3402 1 6 . 1 1 49 49 THR CA C 50 65.063 65.063 65.876 -0.813 18003
3403 1 6 . 1 1 49 49 THR CB C 50 68.032 68.032 68.492 -0.460 18003
3404 1 6 . 1 1 49 49 THR H H 50 7.848 7.848 8.232 -0.384 18003
3405 1 6 . 1 1 50 50 ASP N N 51 120.138 120.138 120.425 -0.287 18003
3406 1 6 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.483 -0.278 18003
3407 1 6 . 1 1 50 50 ASP C C 51 174.723 174.723 178.688 -3.965 18003
3408 1 6 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.269 -0.488 18003
3409 1 6 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.281 0.830 18003
3410 1 6 . 1 1 50 50 ASP H H 51 7.108 7.108 8.368 -1.260 18003
3411 1 6 . 1 1 51 51 LEU N N 52 121.089 121.089 120.254 0.835 18003
3412 1 6 . 1 1 51 51 LEU HA H 52 3.985 3.985 3.986 -0.001 18003
3413 1 6 . 1 1 51 51 LEU C C 52 177.089 177.089 178.662 -1.573 18003
3414 1 6 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.956 0.204 18003
3415 1 6 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.662 0.118 18003
3416 1 6 . 1 1 51 51 LEU H H 52 7.943 7.943 7.967 -0.024 18003
3417 1 6 . 1 1 52 52 ALA N N 53 119.237 119.237 122.199 -2.962 18003
3418 1 6 . 1 1 52 52 ALA HA H 53 3.872 3.872 4.006 -0.134 18003
3419 1 6 . 1 1 52 52 ALA C C 53 179.466 179.466 179.747 -0.281 18003
3420 1 6 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.039 0.624 18003
3421 1 6 . 1 1 52 52 ALA CB C 53 17.619 17.619 18.253 -0.634 18003
3422 1 6 . 1 1 52 52 ALA H H 53 8.480 8.480 7.840 0.640 18003
3423 1 6 . 1 1 53 53 GLU N N 54 115.655 115.655 118.431 -2.776 18003
3424 1 6 . 1 1 53 53 GLU HA H 54 4.054 4.054 4.003 0.051 18003
3425 1 6 . 1 1 53 53 GLU C C 54 179.073 179.073 178.942 0.131 18003
3426 1 6 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.776 0.051 18003
3427 1 6 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.348 0.052 18003
3428 1 6 . 1 1 53 53 GLU H H 54 7.705 7.705 7.790 -0.085 18003
3429 1 6 . 1 1 54 54 ALA N N 55 120.276 120.276 120.787 -0.511 18003
3430 1 6 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.139 -0.002 18003
3431 1 6 . 1 1 54 54 ALA C C 55 179.771 179.771 179.080 0.691 18003
3432 1 6 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.321 0.340 18003
3433 1 6 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.416 -1.181 18003
3434 1 6 . 1 1 54 54 ALA H H 55 7.928 7.928 7.766 0.162 18003
3435 1 6 . 1 1 55 55 ILE N N 56 107.195 107.195 116.906 -9.711 18003
3436 1 6 . 1 1 55 55 ILE C C 56 176.053 176.053 176.519 -0.466 18003
3437 1 6 . 1 1 55 55 ILE CA C 56 60.551 60.551 62.457 -1.906 18003
3438 1 6 . 1 1 55 55 ILE CB C 56 38.497 38.497 39.378 -0.881 18003
3439 1 6 . 1 1 55 55 ILE H H 56 7.507 7.507 8.234 -0.727 18003
3440 1 6 . 1 1 56 56 GLY N N 57 111.108 111.108 106.410 4.698 18003
3441 1 6 . 1 1 56 56 GLY C C 57 174.421 174.421 174.071 0.350 18003
3442 1 6 . 1 1 56 56 GLY CA C 57 46.960 46.960 44.892 2.068 18003
3443 1 6 . 1 1 56 56 GLY H H 57 7.757 7.757 7.776 -0.019 18003
3444 1 6 . 1 1 57 57 MET N N 58 118.089 118.089 121.055 -2.966 18003
3445 1 6 . 1 1 57 57 MET HA H 58 3.933 3.933 3.835 0.098 18003
3446 1 6 . 1 1 57 57 MET C C 58 174.157 174.157 177.200 -3.043 18003
3447 1 6 . 1 1 57 57 MET CA C 58 54.091 54.091 57.694 -3.603 18003
3448 1 6 . 1 1 57 57 MET CB C 58 38.062 38.062 31.644 6.418 18003
3449 1 6 . 1 1 57 57 MET H H 58 7.659 7.659 8.093 -0.434 18003
3450 1 6 . 1 1 58 58 GLU N N 59 121.656 121.656 114.280 7.376 18003
3451 1 6 . 1 1 58 58 GLU HA H 59 4.340 4.340 3.947 0.393 18003
3452 1 6 . 1 1 58 58 GLU C C 59 178.355 178.355 177.262 1.093 18003
3453 1 6 . 1 1 58 58 GLU CA C 59 56.643 56.643 58.108 -1.465 18003
3454 1 6 . 1 1 58 58 GLU CB C 59 30.029 30.029 28.424 1.605 18003
3455 1 6 . 1 1 58 58 GLU H H 59 8.523 8.523 8.646 -0.123 18003
3456 1 6 . 1 1 59 59 GLN N N 60 123.686 123.686 117.572 6.114 18003
3457 1 6 . 1 1 59 59 GLN HA H 60 4.214 4.214 4.017 0.197 18003
3458 1 6 . 1 1 59 59 GLN C C 60 177.961 177.961 178.401 -0.440 18003
3459 1 6 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.530 2.086 18003
3460 1 6 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.104 0.911 18003
3461 1 6 . 1 1 59 59 GLN H H 60 9.009 9.009 8.729 0.280 18003
3462 1 6 . 1 1 60 60 SER N N 61 115.101 115.101 113.877 1.224 18003
3463 1 6 . 1 1 60 60 SER C C 61 176.801 176.801 175.799 1.002 18003
3464 1 6 . 1 1 60 60 SER CA C 61 61.213 61.213 60.533 0.680 18003
3465 1 6 . 1 1 60 60 SER H H 61 8.964 8.964 8.367 0.597 18003
3466 1 6 . 1 1 61 61 ALA N N 62 126.069 126.069 124.070 1.999 18003
3467 1 6 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.209 0.142 18003
3468 1 6 . 1 1 61 61 ALA C C 62 180.635 180.635 179.349 1.286 18003
3469 1 6 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.934 -0.676 18003
3470 1 6 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.253 0.370 18003
3471 1 6 . 1 1 61 61 ALA H H 62 7.103 7.103 7.884 -0.781 18003
3472 1 6 . 1 1 62 62 VAL N N 63 119.252 119.252 115.865 3.387 18003
3473 1 6 . 1 1 62 62 VAL C C 63 177.842 177.842 177.678 0.164 18003
3474 1 6 . 1 1 62 62 VAL CA C 63 66.798 66.798 65.448 1.350 18003
3475 1 6 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.342 -0.078 18003
3476 1 6 . 1 1 62 62 VAL H H 63 7.971 7.971 7.824 0.147 18003
3477 1 6 . 1 1 63 63 SER N N 64 115.494 115.494 116.617 -1.123 18003
3478 1 6 . 1 1 63 63 SER HA H 64 4.034 4.034 3.941 0.093 18003
3479 1 6 . 1 1 63 63 SER C C 64 176.835 176.835 176.636 0.199 18003
3480 1 6 . 1 1 63 63 SER CA C 64 62.400 62.400 61.801 0.599 18003
3481 1 6 . 1 1 63 63 SER CB C 64 62.752 62.752 62.947 -0.195 18003
3482 1 6 . 1 1 63 63 SER H H 64 8.743 8.743 8.004 0.739 18003
3483 1 6 . 1 1 64 64 HIS N N 65 120.010 120.010 121.396 -1.386 18003
3484 1 6 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.306 0.054 18003
3485 1 6 . 1 1 64 64 HIS C C 65 177.731 177.731 177.562 0.169 18003
3486 1 6 . 1 1 64 64 HIS CA C 65 59.998 59.998 59.690 0.309 18003
3487 1 6 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.894 0.040 18003
3488 1 6 . 1 1 64 64 HIS H H 65 7.804 7.804 7.958 -0.154 18003
3489 1 6 . 1 1 65 65 GLN N N 66 115.590 115.590 118.695 -3.105 18003
3490 1 6 . 1 1 65 65 GLN HA H 66 4.035 4.035 3.849 0.186 18003
3491 1 6 . 1 1 65 65 GLN C C 66 179.055 179.055 178.473 0.582 18003
3492 1 6 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.912 -1.382 18003
3493 1 6 . 1 1 65 65 GLN H H 66 7.751 7.751 8.070 -0.319 18003
3494 1 6 . 1 1 66 66 LEU N N 67 118.746 118.746 121.031 -2.285 18003
3495 1 6 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.919 0.028 18003
3496 1 6 . 1 1 66 66 LEU C C 67 178.334 178.334 178.148 0.186 18003
3497 1 6 . 1 1 66 66 LEU CA C 67 57.846 57.846 58.178 -0.332 18003
3498 1 6 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.821 -0.718 18003
3499 1 6 . 1 1 66 66 LEU H H 67 8.648 8.648 8.694 -0.046 18003
3500 1 6 . 1 1 67 67 ARG N N 68 119.610 119.610 118.963 0.647 18003
3501 1 6 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.887 0.056 18003
3502 1 6 . 1 1 67 67 ARG C C 68 178.807 178.807 178.353 0.454 18003
3503 1 6 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.453 -0.076 18003
3504 1 6 . 1 1 67 67 ARG CB C 68 29.475 29.475 29.956 -0.481 18003
3505 1 6 . 1 1 67 67 ARG H H 68 7.607 7.607 7.860 -0.253 18003
3506 1 6 . 1 1 68 68 VAL N N 69 119.719 119.719 120.463 -0.744 18003
3507 1 6 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.591 0.042 18003
3508 1 6 . 1 1 68 68 VAL C C 69 178.690 178.690 178.326 0.364 18003
3509 1 6 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.666 -0.212 18003
3510 1 6 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.368 0.411 18003
3511 1 6 . 1 1 68 68 VAL H H 69 7.259 7.259 7.574 -0.315 18003
3512 1 6 . 1 1 69 69 LEU N N 70 117.532 117.532 118.863 -1.331 18003
3513 1 6 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.987 -0.039 18003
3514 1 6 . 1 1 69 69 LEU C C 70 179.144 179.144 179.090 0.054 18003
3515 1 6 . 1 1 69 69 LEU CA C 70 57.750 57.750 57.559 0.190 18003
3516 1 6 . 1 1 69 69 LEU CB C 70 41.860 41.860 40.627 1.233 18003
3517 1 6 . 1 1 69 69 LEU H H 70 8.375 8.375 7.938 0.437 18003
3518 1 6 . 1 1 70 70 ARG N N 71 122.498 122.498 120.333 2.165 18003
3519 1 6 . 1 1 70 70 ARG HA H 71 3.931 3.931 3.887 0.044 18003
3520 1 6 . 1 1 70 70 ARG C C 71 180.499 180.499 178.736 1.763 18003
3521 1 6 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.590 -0.813 18003
3522 1 6 . 1 1 70 70 ARG CB C 71 30.155 30.155 29.984 0.171 18003
3523 1 6 . 1 1 70 70 ARG H H 71 8.822 8.822 8.587 0.235 18003
3524 1 6 . 1 1 71 71 ASN N N 72 121.816 121.816 117.178 4.638 18003
3525 1 6 . 1 1 71 71 ASN C C 72 177.170 177.170 177.849 -0.679 18003
3526 1 6 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.574 0.203 18003
3527 1 6 . 1 1 71 71 ASN CB C 72 37.734 37.734 37.897 -0.163 18003
3528 1 6 . 1 1 71 71 ASN H H 72 8.144 8.144 8.008 0.136 18003
3529 1 6 . 1 1 72 72 LEU N N 73 117.044 117.044 117.591 -0.547 18003
3530 1 6 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.157 0.188 18003
3531 1 6 . 1 1 72 72 LEU C C 73 176.984 176.984 178.074 -1.090 18003
3532 1 6 . 1 1 72 72 LEU CA C 73 55.125 55.125 55.797 -0.672 18003
3533 1 6 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.102 1.167 18003
3534 1 6 . 1 1 72 72 LEU H H 73 7.804 7.804 7.207 0.597 18003
3535 1 6 . 1 1 73 73 GLY N N 74 106.621 106.621 105.642 0.979 18003
3536 1 6 . 1 1 73 73 GLY C C 74 173.266 173.266 173.734 -0.468 18003
3537 1 6 . 1 1 73 73 GLY CA C 74 46.022 46.022 45.004 1.018 18003
3538 1 6 . 1 1 73 73 GLY H H 74 7.851 7.851 8.281 -0.430 18003
3539 1 6 . 1 1 74 74 LEU N N 75 114.582 114.582 119.823 -5.241 18003
3540 1 6 . 1 1 74 74 LEU C C 75 177.562 177.562 175.672 1.890 18003
3541 1 6 . 1 1 74 74 LEU CA C 75 56.031 56.031 54.993 1.038 18003
3542 1 6 . 1 1 74 74 LEU CB C 75 44.444 44.444 43.679 0.765 18003
3543 1 6 . 1 1 74 74 LEU H H 75 7.808 7.808 7.706 0.102 18003
3544 1 6 . 1 1 75 75 VAL N N 76 110.980 110.980 111.595 -0.615 18003
3545 1 6 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.733 -0.206 18003
3546 1 6 . 1 1 75 75 VAL C C 76 173.922 173.922 174.222 -0.300 18003
3547 1 6 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.054 -2.111 18003
3548 1 6 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.478 0.551 18003
3549 1 6 . 1 1 75 75 VAL H H 76 7.079 7.079 7.266 -0.187 18003
3550 1 6 . 1 1 76 76 VAL N N 77 118.619 118.619 115.970 2.649 18003
3551 1 6 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.746 0.556 18003
3552 1 6 . 1 1 76 76 VAL C C 77 174.041 174.041 174.287 -0.246 18003
3553 1 6 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.100 -0.101 18003
3554 1 6 . 1 1 76 76 VAL H H 77 9.024 9.024 9.220 -0.196 18003
3555 1 6 . 1 1 77 77 GLY N N 78 109.451 109.451 106.750 2.701 18003
3556 1 6 . 1 1 77 77 GLY C C 78 172.225 172.225 172.678 -0.453 18003
3557 1 6 . 1 1 77 77 GLY CA C 78 44.462 44.462 44.820 -0.358 18003
3558 1 6 . 1 1 77 77 GLY H H 78 8.265 8.265 8.348 -0.083 18003
3559 1 6 . 1 1 78 78 ASP N N 79 122.826 122.826 121.159 1.667 18003
3560 1 6 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.852 -0.106 18003
3561 1 6 . 1 1 78 78 ASP C C 79 174.817 174.817 175.058 -0.241 18003
3562 1 6 . 1 1 78 78 ASP CA C 79 53.111 53.111 53.394 -0.283 18003
3563 1 6 . 1 1 78 78 ASP CB C 79 43.655 43.655 44.254 -0.599 18003
3564 1 6 . 1 1 78 78 ASP H H 79 8.479 8.479 8.281 0.198 18003
3565 1 6 . 1 1 79 79 ARG N N 80 122.613 122.613 124.018 -1.405 18003
3566 1 6 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.366 0.046 18003
3567 1 6 . 1 1 79 79 ARG C C 80 175.546 175.546 174.985 0.561 18003
3568 1 6 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.231 0.087 18003
3569 1 6 . 1 1 79 79 ARG CB C 80 30.376 30.376 31.323 -0.947 18003
3570 1 6 . 1 1 79 79 ARG H H 80 8.580 8.580 8.677 -0.097 18003
3571 1 6 . 1 1 80 80 ALA N N 81 129.263 129.263 129.679 -0.416 18003
3572 1 6 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.640 -0.188 18003
3573 1 6 . 1 1 80 80 ALA C C 81 177.126 177.126 176.336 0.790 18003
3574 1 6 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.585 0.035 18003
3575 1 6 . 1 1 80 80 ALA CB C 81 19.260 19.260 20.964 -1.704 18003
3576 1 6 . 1 1 80 80 ALA H H 81 8.396 8.396 8.975 -0.579 18003
3577 1 6 . 1 1 81 81 GLY N N 82 112.739 112.739 111.563 1.176 18003
3578 1 6 . 1 1 81 81 GLY C C 82 174.856 174.856 174.761 0.095 18003
3579 1 6 . 1 1 81 81 GLY CA C 82 46.392 46.392 46.562 -0.170 18003
3580 1 6 . 1 1 81 81 GLY H H 82 8.641 8.641 8.562 0.079 18003
3581 1 6 . 1 1 82 82 ARG N N 83 124.780 124.780 122.630 2.150 18003
3582 1 6 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.626 -0.303 18003
3583 1 6 . 1 1 82 82 ARG C C 83 176.339 176.339 175.226 1.113 18003
3584 1 6 . 1 1 82 82 ARG CA C 83 56.690 56.690 55.674 1.016 18003
3585 1 6 . 1 1 82 82 ARG CB C 83 30.221 30.221 31.201 -0.980 18003
3586 1 6 . 1 1 82 82 ARG H H 83 8.728 8.728 8.477 0.251 18003
3587 1 6 . 1 1 83 83 SER N N 84 114.678 114.678 115.190 -0.512 18003
3588 1 6 . 1 1 83 83 SER C C 84 172.869 172.869 172.030 0.839 18003
3589 1 6 . 1 1 83 83 SER CA C 84 56.834 56.834 57.776 -0.943 18003
3590 1 6 . 1 1 83 83 SER CB C 84 65.191 65.191 66.567 -1.376 18003
3591 1 6 . 1 1 83 83 SER H H 84 7.821 7.821 8.416 -0.595 18003
3592 1 6 . 1 1 84 84 ILE N N 85 122.996 122.996 117.153 5.843 18003
3593 1 6 . 1 1 84 84 ILE C C 85 175.521 175.521 174.166 1.355 18003
3594 1 6 . 1 1 84 84 ILE CA C 85 60.235 60.235 58.866 1.369 18003
3595 1 6 . 1 1 84 84 ILE CB C 85 38.136 38.136 42.075 -3.939 18003
3596 1 6 . 1 1 84 84 ILE H H 85 8.232 8.232 8.205 0.027 18003
3597 1 6 . 1 1 85 85 VAL N N 86 121.845 121.845 117.500 4.345 18003
3598 1 6 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.464 -0.154 18003
3599 1 6 . 1 1 85 85 VAL C C 86 174.818 174.818 174.324 0.494 18003
3600 1 6 . 1 1 85 85 VAL CA C 86 59.738 59.738 60.381 -0.643 18003
3601 1 6 . 1 1 85 85 VAL CB C 86 34.221 34.221 33.785 0.436 18003
3602 1 6 . 1 1 85 85 VAL H H 86 8.495 8.495 8.335 0.160 18003
3603 1 6 . 1 1 86 86 TYR N N 87 125.020 125.020 127.332 -2.312 18003
3604 1 6 . 1 1 86 86 TYR HA H 87 4.319 4.319 4.931 -0.612 18003
3605 1 6 . 1 1 86 86 TYR C C 87 173.808 173.808 175.548 -1.740 18003
3606 1 6 . 1 1 86 86 TYR CA C 87 57.465 57.465 58.378 -0.913 18003
3607 1 6 . 1 1 86 86 TYR CB C 87 41.480 41.480 38.429 3.050 18003
3608 1 6 . 1 1 86 86 TYR H H 87 8.488 8.488 8.815 -0.327 18003
3609 1 6 . 1 1 87 87 SER N N 88 110.681 110.681 116.751 -6.070 18003
3610 1 6 . 1 1 87 87 SER HA H 88 5.414 5.414 4.891 0.523 18003
3611 1 6 . 1 1 87 87 SER C C 88 174.693 174.693 173.122 1.571 18003
3612 1 6 . 1 1 87 87 SER CA C 88 56.113 56.113 57.157 -1.044 18003
3613 1 6 . 1 1 87 87 SER CB C 88 66.309 66.309 66.988 -0.679 18003
3614 1 6 . 1 1 87 87 SER H H 88 8.718 8.718 9.124 -0.406 18003
3615 1 6 . 1 1 88 88 LEU N N 89 119.612 119.612 124.531 -4.919 18003
3616 1 6 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.346 0.581 18003
3617 1 6 . 1 1 88 88 LEU C C 89 179.031 179.031 177.019 2.012 18003
3618 1 6 . 1 1 88 88 LEU CA C 89 55.325 55.325 54.150 1.175 18003
3619 1 6 . 1 1 88 88 LEU CB C 89 41.720 41.720 40.703 1.016 18003
3620 1 6 . 1 1 88 88 LEU H H 89 9.034 9.034 8.746 0.288 18003
3621 1 6 . 1 1 89 89 TYR N N 90 120.540 120.540 124.519 -3.979 18003
3622 1 6 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.185 0.437 18003
3623 1 6 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.898 0.814 18003
3624 1 6 . 1 1 89 89 TYR H H 90 8.075 8.075 8.293 -0.218 18003
3625 1 6 . 1 1 92 92 HIS C C 93 177.850 177.850 177.433 0.417 18003
3626 1 6 . 1 1 93 93 VAL N N 94 120.211 120.211 119.136 1.075 18003
3627 1 6 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.715 -0.214 18003
3628 1 6 . 1 1 93 93 VAL C C 94 176.785 176.785 177.092 -0.307 18003
3629 1 6 . 1 1 93 93 VAL CA C 94 66.666 66.666 66.227 0.439 18003
3630 1 6 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.639 -0.002 18003
3631 1 6 . 1 1 93 93 VAL H H 94 8.164 8.164 7.857 0.307 18003
3632 1 6 . 1 1 94 94 ALA N N 95 119.221 119.221 119.347 -0.126 18003
3633 1 6 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.973 -0.183 18003
3634 1 6 . 1 1 94 94 ALA C C 95 177.979 177.979 179.545 -1.566 18003
3635 1 6 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.179 0.300 18003
3636 1 6 . 1 1 94 94 ALA CB C 95 18.110 18.110 17.911 0.199 18003
3637 1 6 . 1 1 94 94 ALA H H 95 6.942 6.942 7.572 -0.630 18003
3638 1 6 . 1 1 95 95 GLN N N 96 115.416 115.416 119.396 -3.980 18003
3639 1 6 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.217 -0.182 18003
3640 1 6 . 1 1 95 95 GLN C C 96 177.993 177.993 178.405 -0.412 18003
3641 1 6 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.676 0.166 18003
3642 1 6 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.524 -0.495 18003
3643 1 6 . 1 1 95 95 GLN H H 96 7.795 7.795 7.610 0.185 18003
3644 1 6 . 1 1 96 96 LEU N N 97 120.758 120.758 120.389 0.369 18003
3645 1 6 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.041 -0.192 18003
3646 1 6 . 1 1 96 96 LEU C C 97 177.974 177.974 179.302 -1.328 18003
3647 1 6 . 1 1 96 96 LEU CA C 97 59.282 59.282 57.901 1.381 18003
3648 1 6 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.627 -0.581 18003
3649 1 6 . 1 1 96 96 LEU H H 97 8.197 8.197 7.901 0.296 18003
3650 1 6 . 1 1 97 97 LEU N N 98 117.567 117.567 119.738 -2.171 18003
3651 1 6 . 1 1 97 97 LEU HA H 98 3.830 3.830 4.006 -0.176 18003
3652 1 6 . 1 1 97 97 LEU C C 98 178.219 178.219 179.411 -1.192 18003
3653 1 6 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.039 -0.309 18003
3654 1 6 . 1 1 97 97 LEU CB C 98 41.862 41.862 40.327 1.536 18003
3655 1 6 . 1 1 97 97 LEU H H 98 7.660 7.660 8.046 -0.386 18003
3656 1 6 . 1 1 98 98 ASP N N 99 118.607 118.607 120.405 -1.798 18003
3657 1 6 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.369 -0.260 18003
3658 1 6 . 1 1 98 98 ASP C C 99 179.382 179.382 179.181 0.201 18003
3659 1 6 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.821 0.214 18003
3660 1 6 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.226 -0.387 18003
3661 1 6 . 1 1 98 98 ASP H H 99 8.295 8.295 8.413 -0.118 18003
3662 1 6 . 1 1 99 99 GLU N N 100 117.542 117.542 120.263 -2.721 18003
3663 1 6 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.150 -0.301 18003
3664 1 6 . 1 1 99 99 GLU C C 100 179.389 179.389 178.958 0.431 18003
3665 1 6 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.246 -1.223 18003
3666 1 6 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.747 -0.719 18003
3667 1 6 . 1 1 99 99 GLU H H 100 8.334 8.334 8.041 0.293 18003
3668 1 6 . 1 1 100 100 ALA N N 101 122.890 122.890 123.822 -0.932 18003
3669 1 6 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.095 -0.097 18003
3670 1 6 . 1 1 100 100 ALA C C 101 180.184 180.184 179.827 0.357 18003
3671 1 6 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.478 0.042 18003
3672 1 6 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.477 -0.858 18003
3673 1 6 . 1 1 100 100 ALA H H 101 8.550 8.550 8.380 0.170 18003
3674 1 6 . 1 1 101 101 ILE N N 102 119.952 119.952 118.617 1.335 18003
3675 1 6 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.770 -0.181 18003
3676 1 6 . 1 1 101 101 ILE C C 102 178.114 178.114 177.758 0.356 18003
3677 1 6 . 1 1 101 101 ILE CA C 102 65.376 65.376 64.864 0.512 18003
3678 1 6 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.026 1.003 18003
3679 1 6 . 1 1 101 101 ILE H H 102 8.493 8.493 8.618 -0.125 18003
3680 1 6 . 1 1 102 102 TYR N N 103 120.625 120.625 121.472 -0.847 18003
3681 1 6 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.192 -0.021 18003
3682 1 6 . 1 1 102 102 TYR C C 103 179.772 179.772 178.075 1.697 18003
3683 1 6 . 1 1 102 102 TYR CA C 103 60.724 60.724 61.686 -0.962 18003
3684 1 6 . 1 1 102 102 TYR CB C 103 37.500 37.500 38.363 -0.863 18003
3685 1 6 . 1 1 102 102 TYR H H 103 8.520 8.520 8.167 0.353 18003
3686 1 6 . 1 1 103 103 HIS N N 104 117.456 117.456 118.117 -0.661 18003
3687 1 6 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.160 0.265 18003
3688 1 6 . 1 1 103 103 HIS C C 104 176.377 176.377 177.049 -0.672 18003
3689 1 6 . 1 1 103 103 HIS CA C 104 60.043 60.043 59.468 0.575 18003
3690 1 6 . 1 1 103 103 HIS CB C 104 29.029 29.029 30.089 -1.060 18003
3691 1 6 . 1 1 103 103 HIS H H 104 8.622 8.622 8.958 -0.336 18003
3692 1 6 . 1 1 104 104 SER N N 105 113.596 113.596 115.147 -1.551 18003
3693 1 6 . 1 1 104 104 SER C C 105 176.712 176.712 176.561 0.151 18003
3694 1 6 . 1 1 104 104 SER CA C 105 61.852 61.852 61.166 0.687 18003
3695 1 6 . 1 1 104 104 SER CB C 105 63.550 63.550 63.714 -0.164 18003
3696 1 6 . 1 1 104 104 SER H H 105 7.900 7.900 8.013 -0.113 18003
3697 1 6 . 1 1 105 105 GLU N N 106 119.022 119.022 122.276 -3.254 18003
3698 1 6 . 1 1 105 105 GLU HA H 106 4.013 4.013 4.054 -0.041 18003
3699 1 6 . 1 1 105 105 GLU C C 106 177.902 177.902 177.923 -0.021 18003
3700 1 6 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.803 -0.772 18003
3701 1 6 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.595 -0.316 18003
3702 1 6 . 1 1 105 105 GLU H H 106 8.181 8.181 8.270 -0.089 18003
3703 1 6 . 1 1 106 106 HIS N N 107 116.482 116.482 114.428 2.054 18003
3704 1 6 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.356 0.051 18003
3705 1 6 . 1 1 106 106 HIS C C 107 175.575 175.575 174.754 0.821 18003
3706 1 6 . 1 1 106 106 HIS CA C 107 57.343 57.343 57.065 0.278 18003
3707 1 6 . 1 1 106 106 HIS CB C 107 28.580 28.580 30.442 -1.862 18003
3708 1 6 . 1 1 106 106 HIS H H 107 7.770 7.770 7.774 -0.004 18003
3709 1 6 . 1 1 107 107 LEU N N 108 120.346 120.346 121.641 -1.295 18003
3710 1 6 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.440 -0.386 18003
3711 1 6 . 1 1 107 107 LEU C C 108 177.404 177.404 174.591 2.813 18003
3712 1 6 . 1 1 107 107 LEU CA C 108 55.991 55.991 54.815 1.176 18003
3713 1 6 . 1 1 107 107 LEU CB C 108 42.030 42.030 42.192 -0.162 18003
3714 1 6 . 1 1 107 107 LEU H H 108 7.682 7.682 7.607 0.075 18003
3715 1 6 . 1 1 108 108 HIS N N 109 117.222 117.222 119.032 -1.810 18003
3716 1 6 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.648 -0.594 18003
3717 1 6 . 1 1 108 108 HIS C C 109 174.606 174.606 174.901 -0.295 18003
3718 1 6 . 1 1 108 108 HIS CA C 109 56.029 56.029 55.773 0.256 18003
3719 1 6 . 1 1 108 108 HIS CB C 109 28.517 28.517 30.016 -1.499 18003
3720 1 6 . 1 1 108 108 HIS H H 109 8.030 8.030 7.980 0.050 18003
3721 1 6 . 1 1 109 109 LEU N N 110 121.114 121.114 122.192 -1.078 18003
3722 1 6 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.315 -0.017 18003
3723 1 6 . 1 1 109 109 LEU C C 110 178.028 178.028 178.990 -0.962 18003
3724 1 6 . 1 1 109 109 LEU CA C 110 55.574 55.574 56.687 -1.113 18003
3725 1 6 . 1 1 109 109 LEU CB C 110 42.076 42.076 41.156 0.920 18003
3726 1 6 . 1 1 109 109 LEU H H 110 7.973 7.973 7.771 0.202 18003
3727 1 6 . 1 1 110 110 GLY N N 111 108.631 108.631 106.147 2.484 18003
3728 1 6 . 1 1 110 110 GLY C C 111 174.606 174.606 174.790 -0.184 18003
3729 1 6 . 1 1 110 110 GLY CA C 111 45.580 45.580 45.152 0.428 18003
3730 1 6 . 1 1 110 110 GLY H H 111 8.255 8.255 8.060 0.195 18003
3731 1 6 . 1 1 111 111 LEU N N 112 121.022 121.022 121.117 -0.095 18003
3732 1 6 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.039 0.320 18003
3733 1 6 . 1 1 111 111 LEU C C 112 177.701 177.701 175.206 2.495 18003
3734 1 6 . 1 1 111 111 LEU CA C 112 55.476 55.476 54.739 0.737 18003
3735 1 6 . 1 1 111 111 LEU CB C 112 41.899 41.899 41.874 0.025 18003
3736 1 6 . 1 1 111 111 LEU H H 112 7.981 7.981 8.001 -0.020 18003
3737 1 6 . 1 1 112 112 SER N N 113 115.471 115.471 117.833 -2.362 18003
3738 1 6 . 1 1 112 112 SER HA H 113 4.432 4.432 4.548 -0.116 18003
3739 1 6 . 1 1 112 112 SER C C 113 174.381 174.381 174.116 0.265 18003
3740 1 6 . 1 1 112 112 SER CA C 113 58.527 58.527 57.573 0.954 18003
3741 1 6 . 1 1 112 112 SER CB C 113 63.593 63.593 63.865 -0.272 18003
3742 1 6 . 1 1 112 112 SER H H 113 8.215 8.215 7.932 0.283 18003
3743 1 6 . 1 1 113 113 ASP N N 114 121.696 121.696 128.380 -6.684 18003
3744 1 6 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.769 -0.342 18003
3745 1 6 . 1 1 113 113 ASP C C 114 175.958 175.958 175.962 -0.004 18003
3746 1 6 . 1 1 113 113 ASP CA C 114 54.213 54.213 53.563 0.650 18003
3747 1 6 . 1 1 113 113 ASP CB C 114 41.030 41.030 41.657 -0.627 18003
3748 1 6 . 1 1 113 113 ASP H H 114 8.203 8.203 8.636 -0.433 18003
3749 1 6 . 1 1 114 114 ARG N N 115 120.088 120.088 123.658 -3.570 18003
3750 1 6 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.313 -0.041 18003
3751 1 6 . 1 1 114 114 ARG C C 115 175.792 175.792 175.065 0.727 18003
3752 1 6 . 1 1 114 114 ARG CA C 115 55.735 55.735 55.632 0.103 18003
3753 1 6 . 1 1 114 114 ARG CB C 115 30.586 30.586 28.782 1.804 18003
3754 1 6 . 1 1 114 114 ARG H H 115 8.016 8.016 8.564 -0.548 18003
3755 1 6 . 1 1 115 115 HIS N N 116 120.597 120.597 122.078 -1.481 18003
3756 1 6 . 1 1 115 115 HIS CA C 116 53.697 53.697 54.273 -0.576 18003
3757 1 6 . 1 1 115 115 HIS CB C 116 29.299 29.299 30.103 -0.804 18003
3758 1 6 . 1 1 115 115 HIS H H 116 8.385 8.385 8.255 0.130 18003
3759 1 6 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.663 -0.181 18003
3760 1 6 . 1 1 116 116 PRO C C 117 177.090 177.090 176.183 0.907 18003
3761 1 6 . 1 1 116 116 PRO CA C 117 63.177 63.177 63.121 0.056 18003
3762 1 6 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.614 -0.794 18003
3763 1 6 . 1 1 117 117 SER N N 118 116.220 116.220 115.783 0.437 18003
3764 1 6 . 1 1 117 117 SER HA H 118 4.465 4.465 4.515 -0.050 18003
3765 1 6 . 1 1 117 117 SER C C 118 174.287 174.287 173.386 0.901 18003
3766 1 6 . 1 1 117 117 SER CA C 118 58.110 58.110 57.720 0.390 18003
3767 1 6 . 1 1 117 117 SER CB C 118 63.750 63.750 64.919 -1.169 18003
3768 1 6 . 1 1 117 117 SER H H 118 8.487 8.487 7.884 0.603 18003
3769 1 6 . 1 1 118 118 ALA N N 119 126.082 126.082 122.537 3.545 18003
3770 1 6 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.184 0.255 18003
3771 1 6 . 1 1 118 118 ALA C C 119 176.879 176.879 176.945 -0.066 18003
3772 1 6 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.256 0.193 18003
3773 1 6 . 1 1 118 118 ALA CB C 119 19.483 19.483 17.576 1.907 18003
3774 1 6 . 1 1 118 118 ALA H H 119 8.295 8.295 8.700 -0.405 18003
3775 1 7 . 1 1 2 2 HIS C C 3 175.176 175.176 174.837 0.339 18003
3776 1 7 . 1 1 2 2 HIS CA C 3 55.900 55.900 55.232 0.668 18003
3777 1 7 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.764 -0.735 18003
3778 1 7 . 1 1 3 3 GLY N N 4 110.613 110.613 109.442 1.171 18003
3779 1 7 . 1 1 3 3 GLY C C 4 174.068 174.068 173.512 0.556 18003
3780 1 7 . 1 1 3 3 GLY CA C 4 45.141 45.141 45.003 0.138 18003
3781 1 7 . 1 1 3 3 GLY H H 4 8.500 8.500 8.855 -0.355 18003
3782 1 7 . 1 1 4 4 VAL N N 5 119.318 119.318 122.101 -2.783 18003
3783 1 7 . 1 1 4 4 VAL HA H 5 4.128 4.128 4.362 -0.234 18003
3784 1 7 . 1 1 4 4 VAL C C 5 176.361 176.361 175.528 0.833 18003
3785 1 7 . 1 1 4 4 VAL CA C 5 61.987 61.987 61.597 0.390 18003
3786 1 7 . 1 1 4 4 VAL CB C 5 32.635 32.635 32.849 -0.214 18003
3787 1 7 . 1 1 4 4 VAL H H 5 8.094 8.094 7.866 0.228 18003
3788 1 7 . 1 1 5 5 GLU N N 6 124.369 124.369 124.454 -0.085 18003
3789 1 7 . 1 1 5 5 GLU HA H 6 4.288 4.288 3.988 0.300 18003
3790 1 7 . 1 1 5 5 GLU C C 6 177.012 177.012 176.607 0.405 18003
3791 1 7 . 1 1 5 5 GLU CA C 6 56.699 56.699 57.245 -0.546 18003
3792 1 7 . 1 1 5 5 GLU CB C 6 30.029 30.029 29.752 0.277 18003
3793 1 7 . 1 1 5 5 GLU H H 6 8.545 8.545 8.786 -0.241 18003
3794 1 7 . 1 1 6 6 GLY N N 7 109.747 109.747 104.693 5.054 18003
3795 1 7 . 1 1 6 6 GLY C C 7 174.117 174.117 174.034 0.083 18003
3796 1 7 . 1 1 6 6 GLY CA C 7 45.568 45.568 45.345 0.223 18003
3797 1 7 . 1 1 6 6 GLY H H 7 8.352 8.352 8.293 0.059 18003
3798 1 7 . 1 1 7 7 ARG N N 8 120.059 120.059 121.359 -1.300 18003
3799 1 7 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.263 0.079 18003
3800 1 7 . 1 1 7 7 ARG C C 8 176.016 176.016 176.059 -0.043 18003
3801 1 7 . 1 1 7 7 ARG CA C 8 55.833 55.833 55.643 0.190 18003
3802 1 7 . 1 1 7 7 ARG CB C 8 30.444 30.444 28.971 1.473 18003
3803 1 7 . 1 1 7 7 ARG H H 8 8.084 8.084 8.130 -0.046 18003
3804 1 7 . 1 1 8 8 ASN N N 9 119.379 119.379 119.001 0.378 18003
3805 1 7 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.306 0.026 18003
3806 1 7 . 1 1 8 8 ASN C C 9 174.667 174.667 174.436 0.231 18003
3807 1 7 . 1 1 8 8 ASN CA C 9 53.441 53.441 54.192 -0.751 18003
3808 1 7 . 1 1 8 8 ASN CB C 9 38.480 38.480 37.847 0.633 18003
3809 1 7 . 1 1 8 8 ASN H H 9 8.411 8.411 8.494 -0.083 18003
3810 1 7 . 1 1 9 9 ARG N N 10 121.700 121.700 115.932 5.768 18003
3811 1 7 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.041 0.608 18003
3812 1 7 . 1 1 9 9 ARG CA C 10 53.147 53.147 56.187 -3.040 18003
3813 1 7 . 1 1 9 9 ARG CB C 10 30.197 30.197 29.391 0.806 18003
3814 1 7 . 1 1 9 9 ARG H H 10 8.138 8.138 7.420 0.718 18003
3815 1 7 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.516 -0.073 18003
3816 1 7 . 1 1 10 10 PRO C C 11 176.815 176.815 176.429 0.386 18003
3817 1 7 . 1 1 10 10 PRO CA C 11 63.177 63.177 63.446 -0.269 18003
3818 1 7 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.135 -0.315 18003
3819 1 7 . 1 1 11 11 SER N N 12 116.291 116.291 114.823 1.468 18003
3820 1 7 . 1 1 11 11 SER HA H 12 4.418 4.418 4.651 -0.233 18003
3821 1 7 . 1 1 11 11 SER C C 12 173.702 173.702 173.484 0.218 18003
3822 1 7 . 1 1 11 11 SER CA C 12 58.031 58.031 57.891 0.140 18003
3823 1 7 . 1 1 11 11 SER CB C 12 64.032 64.032 64.039 -0.007 18003
3824 1 7 . 1 1 11 11 SER H H 12 8.325 8.325 8.475 -0.150 18003
3825 1 7 . 1 1 12 12 ALA N N 13 126.862 126.862 123.928 2.934 18003
3826 1 7 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.486 -0.098 18003
3827 1 7 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.733 -1.275 18003
3828 1 7 . 1 1 12 12 ALA CB C 13 18.257 18.257 18.740 -0.483 18003
3829 1 7 . 1 1 12 12 ALA H H 13 8.166 8.166 7.824 0.342 18003
3830 1 7 . 1 1 13 13 PRO C C 14 176.368 176.368 176.460 -0.092 18003
3831 1 7 . 1 1 13 13 PRO CA C 14 62.937 62.937 63.056 -0.119 18003
3832 1 7 . 1 1 13 13 PRO CB C 14 32.022 32.022 32.167 -0.145 18003
3833 1 7 . 1 1 14 14 LEU N N 15 120.969 120.969 124.722 -3.753 18003
3834 1 7 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.421 -0.163 18003
3835 1 7 . 1 1 14 14 LEU C C 15 176.124 176.124 178.237 -2.113 18003
3836 1 7 . 1 1 14 14 LEU CA C 15 54.527 54.527 54.114 0.413 18003
3837 1 7 . 1 1 14 14 LEU CB C 15 43.418 43.418 42.813 0.605 18003
3838 1 7 . 1 1 14 14 LEU H H 15 7.875 7.875 8.227 -0.352 18003
3839 1 7 . 1 1 15 15 ASP N N 16 121.780 121.780 120.574 1.206 18003
3840 1 7 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.272 0.321 18003
3841 1 7 . 1 1 15 15 ASP C C 16 176.208 176.208 177.900 -1.692 18003
3842 1 7 . 1 1 15 15 ASP CA C 16 52.468 52.468 56.985 -4.517 18003
3843 1 7 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.373 1.256 18003
3844 1 7 . 1 1 15 15 ASP H H 16 7.850 7.850 8.756 -0.906 18003
3845 1 7 . 1 1 16 16 SER N N 17 114.435 114.435 114.166 0.269 18003
3846 1 7 . 1 1 16 16 SER HA H 17 4.120 4.120 3.999 0.121 18003
3847 1 7 . 1 1 16 16 SER C C 17 177.207 177.207 176.317 0.890 18003
3848 1 7 . 1 1 16 16 SER CA C 17 62.322 62.322 60.980 1.342 18003
3849 1 7 . 1 1 16 16 SER H H 17 8.658 8.658 8.293 0.365 18003
3850 1 7 . 1 1 17 17 GLN N N 18 122.403 122.403 119.982 2.421 18003
3851 1 7 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.084 0.113 18003
3852 1 7 . 1 1 17 17 GLN C C 18 178.715 178.715 178.002 0.713 18003
3853 1 7 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.277 -0.164 18003
3854 1 7 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.078 -0.038 18003
3855 1 7 . 1 1 17 17 GLN H H 18 8.140 8.140 8.167 -0.027 18003
3856 1 7 . 1 1 18 18 ALA N N 19 124.743 124.743 123.218 1.525 18003
3857 1 7 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.425 -0.249 18003
3858 1 7 . 1 1 18 18 ALA C C 19 180.616 180.616 179.422 1.194 18003
3859 1 7 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.379 0.226 18003
3860 1 7 . 1 1 18 18 ALA CB C 19 19.028 19.028 18.119 0.909 18003
3861 1 7 . 1 1 18 18 ALA H H 19 8.455 8.455 8.348 0.107 18003
3862 1 7 . 1 1 19 19 ALA N N 20 119.089 119.089 121.312 -2.223 18003
3863 1 7 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.024 0.155 18003
3864 1 7 . 1 1 19 19 ALA C C 20 179.239 179.239 179.333 -0.094 18003
3865 1 7 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.932 0.339 18003
3866 1 7 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.291 -0.099 18003
3867 1 7 . 1 1 19 19 ALA H H 20 8.993 8.993 8.006 0.987 18003
3868 1 7 . 1 1 20 20 ALA N N 21 119.226 119.226 121.017 -1.791 18003
3869 1 7 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.911 0.149 18003
3870 1 7 . 1 1 20 20 ALA C C 21 180.230 180.230 179.846 0.384 18003
3871 1 7 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.126 0.018 18003
3872 1 7 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.046 -0.018 18003
3873 1 7 . 1 1 20 20 ALA H H 21 7.724 7.724 7.866 -0.142 18003
3874 1 7 . 1 1 21 21 GLN N N 22 119.310 119.310 118.509 0.801 18003
3875 1 7 . 1 1 21 21 GLN HA H 22 4.129 4.129 3.918 0.211 18003
3876 1 7 . 1 1 21 21 GLN C C 22 179.319 179.319 178.706 0.613 18003
3877 1 7 . 1 1 21 21 GLN CA C 22 58.762 58.762 59.009 -0.247 18003
3878 1 7 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.698 -0.669 18003
3879 1 7 . 1 1 21 21 GLN H H 22 7.638 7.638 7.978 -0.340 18003
3880 1 7 . 1 1 22 22 VAL N N 23 121.565 121.565 119.913 1.652 18003
3881 1 7 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.636 0.330 18003
3882 1 7 . 1 1 22 22 VAL C C 23 178.026 178.026 177.829 0.197 18003
3883 1 7 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.040 0.102 18003
3884 1 7 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.595 -0.629 18003
3885 1 7 . 1 1 22 22 VAL H H 23 8.442 8.442 7.931 0.511 18003
3886 1 7 . 1 1 23 23 ALA N N 24 121.400 121.400 122.217 -0.817 18003
3887 1 7 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.884 0.212 18003
3888 1 7 . 1 1 23 23 ALA C C 24 178.758 178.758 179.660 -0.902 18003
3889 1 7 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.491 0.424 18003
3890 1 7 . 1 1 23 23 ALA CB C 24 16.650 16.650 17.995 -1.345 18003
3891 1 7 . 1 1 23 23 ALA H H 24 8.495 8.495 8.544 -0.049 18003
3892 1 7 . 1 1 24 24 SER N N 25 112.138 112.138 113.657 -1.519 18003
3893 1 7 . 1 1 24 24 SER HA H 25 4.093 4.093 4.210 -0.117 18003
3894 1 7 . 1 1 24 24 SER C C 25 177.271 177.271 176.562 0.709 18003
3895 1 7 . 1 1 24 24 SER CA C 25 62.166 62.166 61.349 0.818 18003
3896 1 7 . 1 1 24 24 SER CB C 25 63.032 63.032 62.845 0.187 18003
3897 1 7 . 1 1 24 24 SER H H 25 7.936 7.936 8.440 -0.504 18003
3898 1 7 . 1 1 25 25 THR N N 26 119.701 119.701 119.913 -0.212 18003
3899 1 7 . 1 1 25 25 THR HA H 26 4.380 4.380 4.003 0.377 18003
3900 1 7 . 1 1 25 25 THR C C 26 175.456 175.456 176.620 -1.164 18003
3901 1 7 . 1 1 25 25 THR CA C 26 67.129 67.129 67.478 -0.349 18003
3902 1 7 . 1 1 25 25 THR CB C 26 68.800 68.800 68.674 0.126 18003
3903 1 7 . 1 1 25 25 THR H H 26 7.775 7.775 7.654 0.121 18003
3904 1 7 . 1 1 26 26 LEU N N 27 119.270 119.270 120.436 -1.166 18003
3905 1 7 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.039 -0.476 18003
3906 1 7 . 1 1 26 26 LEU C C 27 178.390 178.390 178.937 -0.547 18003
3907 1 7 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.356 0.313 18003
3908 1 7 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.244 0.786 18003
3909 1 7 . 1 1 26 26 LEU H H 27 8.006 8.006 8.503 -0.497 18003
3910 1 7 . 1 1 27 27 GLN N N 28 115.843 115.843 120.169 -4.326 18003
3911 1 7 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.097 -0.293 18003
3912 1 7 . 1 1 27 27 GLN C C 28 178.657 178.657 177.670 0.987 18003
3913 1 7 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.476 0.236 18003
3914 1 7 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.849 -0.820 18003
3915 1 7 . 1 1 27 27 GLN H H 28 8.485 8.485 8.110 0.375 18003
3916 1 7 . 1 1 28 28 ALA N N 29 118.779 118.779 122.403 -3.624 18003
3917 1 7 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.013 -0.005 18003
3918 1 7 . 1 1 28 28 ALA C C 29 178.259 178.259 180.016 -1.757 18003
3919 1 7 . 1 1 28 28 ALA CA C 29 53.962 53.962 55.127 -1.165 18003
3920 1 7 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.850 -0.112 18003
3921 1 7 . 1 1 28 28 ALA H H 29 7.432 7.432 8.030 -0.598 18003
3922 1 7 . 1 1 29 29 LEU N N 30 113.442 113.442 118.089 -4.647 18003
3923 1 7 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.947 0.049 18003
3924 1 7 . 1 1 29 29 LEU C C 30 175.924 175.924 177.039 -1.115 18003
3925 1 7 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.911 -1.347 18003
3926 1 7 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.688 0.578 18003
3927 1 7 . 1 1 29 29 LEU H H 30 7.311 7.311 7.735 -0.424 18003
3928 1 7 . 1 1 30 30 ALA N N 31 119.563 119.563 118.823 0.740 18003
3929 1 7 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.180 -0.008 18003
3930 1 7 . 1 1 30 30 ALA C C 31 176.316 176.316 175.594 0.722 18003
3931 1 7 . 1 1 30 30 ALA CA C 31 51.656 51.656 52.896 -1.240 18003
3932 1 7 . 1 1 30 30 ALA CB C 31 18.077 18.077 19.482 -1.405 18003
3933 1 7 . 1 1 30 30 ALA H H 31 7.223 7.223 7.343 -0.120 18003
3934 1 7 . 1 1 31 31 THR N N 32 114.613 114.613 109.206 5.407 18003
3935 1 7 . 1 1 31 31 THR HA H 32 4.950 4.950 4.224 0.726 18003
3936 1 7 . 1 1 31 31 THR CA C 32 58.129 58.129 62.240 -4.111 18003
3937 1 7 . 1 1 31 31 THR CB C 32 69.098 69.098 67.096 2.002 18003
3938 1 7 . 1 1 31 31 THR H H 32 8.399 8.399 8.043 0.356 18003
3939 1 7 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.178 0.260 18003
3940 1 7 . 1 1 32 32 PRO C C 33 178.207 178.207 178.897 -0.690 18003
3941 1 7 . 1 1 32 32 PRO CA C 33 66.905 66.905 65.857 1.048 18003
3942 1 7 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.751 -0.487 18003
3943 1 7 . 1 1 33 33 SER N N 34 110.767 110.767 111.830 -1.063 18003
3944 1 7 . 1 1 33 33 SER HA H 34 4.026 4.026 4.195 -0.169 18003
3945 1 7 . 1 1 33 33 SER C C 34 176.742 176.742 176.686 0.056 18003
3946 1 7 . 1 1 33 33 SER CA C 34 61.782 61.782 61.834 -0.052 18003
3947 1 7 . 1 1 33 33 SER CB C 34 62.432 62.432 62.923 -0.492 18003
3948 1 7 . 1 1 33 33 SER H H 34 8.407 8.407 8.418 -0.011 18003
3949 1 7 . 1 1 34 34 ARG N N 35 120.135 120.135 120.800 -0.665 18003
3950 1 7 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.084 -0.030 18003
3951 1 7 . 1 1 34 34 ARG C C 35 178.283 178.283 178.578 -0.295 18003
3952 1 7 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.641 1.891 18003
3953 1 7 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.561 -0.608 18003
3954 1 7 . 1 1 34 34 ARG H H 35 7.341 7.341 7.582 -0.241 18003
3955 1 7 . 1 1 35 35 LEU N N 36 118.454 118.454 121.734 -3.280 18003
3956 1 7 . 1 1 35 35 LEU HA H 36 4.054 4.054 4.119 -0.065 18003
3957 1 7 . 1 1 35 35 LEU C C 36 180.643 180.643 179.296 1.347 18003
3958 1 7 . 1 1 35 35 LEU CA C 36 57.809 57.809 57.957 -0.148 18003
3959 1 7 . 1 1 35 35 LEU CB C 36 41.778 41.778 41.034 0.744 18003
3960 1 7 . 1 1 35 35 LEU H H 36 8.226 8.226 8.216 0.010 18003
3961 1 7 . 1 1 36 36 MET N N 37 121.073 121.073 120.020 1.053 18003
3962 1 7 . 1 1 36 36 MET HA H 37 3.928 3.928 4.085 -0.157 18003
3963 1 7 . 1 1 36 36 MET C C 37 177.671 177.671 178.789 -1.118 18003
3964 1 7 . 1 1 36 36 MET CA C 37 60.613 60.613 58.495 2.118 18003
3965 1 7 . 1 1 36 36 MET CB C 37 33.128 33.128 32.073 1.055 18003
3966 1 7 . 1 1 36 36 MET H H 37 8.447 8.447 8.484 -0.037 18003
3967 1 7 . 1 1 37 37 ILE N N 38 118.239 118.239 119.444 -1.205 18003
3968 1 7 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.701 -0.261 18003
3969 1 7 . 1 1 37 37 ILE C C 38 177.092 177.092 178.337 -1.245 18003
3970 1 7 . 1 1 37 37 ILE CA C 38 65.675 65.675 63.958 1.717 18003
3971 1 7 . 1 1 37 37 ILE CB C 38 38.255 38.255 36.714 1.541 18003
3972 1 7 . 1 1 37 37 ILE H H 38 7.763 7.763 8.365 -0.602 18003
3973 1 7 . 1 1 38 38 LEU N N 39 116.073 116.073 120.609 -4.536 18003
3974 1 7 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.905 -0.079 18003
3975 1 7 . 1 1 38 38 LEU C C 39 178.941 178.941 179.317 -0.376 18003
3976 1 7 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.639 -0.608 18003
3977 1 7 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.527 0.253 18003
3978 1 7 . 1 1 38 38 LEU H H 39 8.538 8.538 8.710 -0.172 18003
3979 1 7 . 1 1 39 39 THR N N 40 106.678 106.678 115.541 -8.863 18003
3980 1 7 . 1 1 39 39 THR HA H 40 3.932 3.932 3.926 0.006 18003
3981 1 7 . 1 1 39 39 THR C C 40 177.747 177.747 177.122 0.625 18003
3982 1 7 . 1 1 39 39 THR CA C 40 65.536 65.536 66.784 -1.248 18003
3983 1 7 . 1 1 39 39 THR CB C 40 68.360 68.360 68.214 0.146 18003
3984 1 7 . 1 1 39 39 THR H H 40 8.086 8.086 8.540 -0.454 18003
3985 1 7 . 1 1 40 40 GLN N N 41 122.344 122.344 121.394 0.950 18003
3986 1 7 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.076 -0.070 18003
3987 1 7 . 1 1 40 40 GLN C C 41 178.348 178.348 178.565 -0.217 18003
3988 1 7 . 1 1 40 40 GLN CA C 41 57.925 57.925 59.028 -1.103 18003
3989 1 7 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.099 -0.578 18003
3990 1 7 . 1 1 40 40 GLN H H 41 7.593 7.593 7.781 -0.188 18003
3991 1 7 . 1 1 41 41 LEU N N 42 116.302 116.302 119.212 -2.910 18003
3992 1 7 . 1 1 41 41 LEU C C 42 178.418 178.418 179.712 -1.294 18003
3993 1 7 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.573 -2.042 18003
3994 1 7 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.844 -0.495 18003
3995 1 7 . 1 1 41 41 LEU H H 42 7.570 7.570 7.868 -0.298 18003
3996 1 7 . 1 1 42 42 ARG N N 43 119.954 119.954 118.319 1.635 18003
3997 1 7 . 1 1 42 42 ARG HA H 43 3.915 3.915 4.106 -0.191 18003
3998 1 7 . 1 1 42 42 ARG C C 43 177.205 177.205 178.409 -1.204 18003
3999 1 7 . 1 1 42 42 ARG CA C 43 58.704 58.704 58.541 0.163 18003
4000 1 7 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.212 -0.769 18003
4001 1 7 . 1 1 42 42 ARG H H 43 7.612 7.612 8.499 -0.887 18003
4002 1 7 . 1 1 43 43 ASN N N 44 114.682 114.682 117.005 -2.323 18003
4003 1 7 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.598 0.162 18003
4004 1 7 . 1 1 43 43 ASN C C 44 174.507 174.507 175.378 -0.871 18003
4005 1 7 . 1 1 43 43 ASN CA C 44 53.953 53.953 54.623 -0.671 18003
4006 1 7 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.606 -0.576 18003
4007 1 7 . 1 1 43 43 ASN H H 44 7.567 7.567 8.094 -0.527 18003
4008 1 7 . 1 1 44 44 GLY N N 45 109.113 109.113 106.806 2.307 18003
4009 1 7 . 1 1 44 44 GLY CA C 45 44.268 44.268 44.785 -0.517 18003
4010 1 7 . 1 1 44 44 GLY H H 45 7.361 7.361 7.516 -0.155 18003
4011 1 7 . 1 1 45 45 PRO C C 46 178.412 178.412 175.778 2.634 18003
4012 1 7 . 1 1 45 45 PRO CA C 46 62.580 62.580 63.038 -0.458 18003
4013 1 7 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.451 1.678 18003
4014 1 7 . 1 1 46 46 LEU N N 47 120.363 120.363 122.119 -1.756 18003
4015 1 7 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.988 0.043 18003
4016 1 7 . 1 1 46 46 LEU CA C 47 52.550 52.550 51.932 0.618 18003
4017 1 7 . 1 1 46 46 LEU CB C 47 48.210 48.210 42.466 5.744 18003
4018 1 7 . 1 1 46 46 LEU H H 47 8.252 8.252 8.061 0.191 18003
4019 1 7 . 1 1 47 47 PRO C C 48 177.313 177.313 177.958 -0.645 18003
4020 1 7 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.605 -0.770 18003
4021 1 7 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.696 -0.313 18003
4022 1 7 . 1 1 48 48 VAL N N 49 119.384 119.384 119.006 0.378 18003
4023 1 7 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.759 -0.152 18003
4024 1 7 . 1 1 48 48 VAL C C 49 176.710 176.710 178.259 -1.549 18003
4025 1 7 . 1 1 48 48 VAL CA C 49 66.188 66.188 66.983 -0.795 18003
4026 1 7 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.244 0.337 18003
4027 1 7 . 1 1 48 48 VAL H H 49 9.074 9.074 8.472 0.602 18003
4028 1 7 . 1 1 49 49 THR N N 50 111.293 111.293 113.524 -2.231 18003
4029 1 7 . 1 1 49 49 THR HA H 50 4.181 4.181 4.085 0.096 18003
4030 1 7 . 1 1 49 49 THR C C 50 176.717 176.717 176.230 0.487 18003
4031 1 7 . 1 1 49 49 THR CA C 50 65.063 65.063 66.480 -1.417 18003
4032 1 7 . 1 1 49 49 THR CB C 50 68.032 68.032 68.302 -0.270 18003
4033 1 7 . 1 1 49 49 THR H H 50 7.848 7.848 8.110 -0.262 18003
4034 1 7 . 1 1 50 50 ASP N N 51 120.138 120.138 120.663 -0.525 18003
4035 1 7 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.489 -0.284 18003
4036 1 7 . 1 1 50 50 ASP C C 51 174.723 174.723 178.563 -3.840 18003
4037 1 7 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.090 -0.309 18003
4038 1 7 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.206 0.905 18003
4039 1 7 . 1 1 50 50 ASP H H 51 7.108 7.108 8.472 -1.364 18003
4040 1 7 . 1 1 51 51 LEU N N 52 121.089 121.089 120.980 0.109 18003
4041 1 7 . 1 1 51 51 LEU HA H 52 3.985 3.985 4.070 -0.085 18003
4042 1 7 . 1 1 51 51 LEU C C 52 177.089 177.089 178.475 -1.386 18003
4043 1 7 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.752 0.409 18003
4044 1 7 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.041 0.739 18003
4045 1 7 . 1 1 51 51 LEU H H 52 7.943 7.943 8.200 -0.257 18003
4046 1 7 . 1 1 52 52 ALA N N 53 119.237 119.237 121.710 -2.473 18003
4047 1 7 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.934 -0.062 18003
4048 1 7 . 1 1 52 52 ALA C C 53 179.466 179.466 179.601 -0.135 18003
4049 1 7 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.532 0.131 18003
4050 1 7 . 1 1 52 52 ALA CB C 53 17.619 17.619 18.085 -0.466 18003
4051 1 7 . 1 1 52 52 ALA H H 53 8.480 8.480 8.152 0.328 18003
4052 1 7 . 1 1 53 53 GLU N N 54 115.655 115.655 119.122 -3.467 18003
4053 1 7 . 1 1 53 53 GLU HA H 54 4.054 4.054 4.084 -0.030 18003
4054 1 7 . 1 1 53 53 GLU C C 54 179.073 179.073 178.457 0.616 18003
4055 1 7 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.401 0.426 18003
4056 1 7 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.467 -0.067 18003
4057 1 7 . 1 1 53 53 GLU H H 54 7.705 7.705 7.868 -0.163 18003
4058 1 7 . 1 1 54 54 ALA N N 55 120.276 120.276 121.285 -1.009 18003
4059 1 7 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.158 -0.021 18003
4060 1 7 . 1 1 54 54 ALA C C 55 179.771 179.771 179.109 0.662 18003
4061 1 7 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.302 0.359 18003
4062 1 7 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.305 -1.070 18003
4063 1 7 . 1 1 54 54 ALA H H 55 7.928 7.928 7.828 0.100 18003
4064 1 7 . 1 1 55 55 ILE N N 56 107.195 107.195 116.515 -9.320 18003
4065 1 7 . 1 1 55 55 ILE C C 56 176.053 176.053 176.369 -0.316 18003
4066 1 7 . 1 1 55 55 ILE CA C 56 60.551 60.551 62.979 -2.428 18003
4067 1 7 . 1 1 55 55 ILE CB C 56 38.497 38.497 39.355 -0.858 18003
4068 1 7 . 1 1 55 55 ILE H H 56 7.507 7.507 8.349 -0.842 18003
4069 1 7 . 1 1 56 56 GLY N N 57 111.108 111.108 107.289 3.819 18003
4070 1 7 . 1 1 56 56 GLY C C 57 174.421 174.421 173.919 0.502 18003
4071 1 7 . 1 1 56 56 GLY CA C 57 46.960 46.960 44.593 2.367 18003
4072 1 7 . 1 1 56 56 GLY H H 57 7.757 7.757 7.874 -0.117 18003
4073 1 7 . 1 1 57 57 MET N N 58 118.089 118.089 119.864 -1.775 18003
4074 1 7 . 1 1 57 57 MET HA H 58 3.933 3.933 3.993 -0.060 18003
4075 1 7 . 1 1 57 57 MET C C 58 174.157 174.157 175.367 -1.210 18003
4076 1 7 . 1 1 57 57 MET CA C 58 54.091 54.091 56.853 -2.762 18003
4077 1 7 . 1 1 57 57 MET CB C 58 38.062 38.062 32.156 5.906 18003
4078 1 7 . 1 1 57 57 MET H H 58 7.659 7.659 8.166 -0.507 18003
4079 1 7 . 1 1 58 58 GLU N N 59 121.656 121.656 120.156 1.500 18003
4080 1 7 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.363 -0.023 18003
4081 1 7 . 1 1 58 58 GLU C C 59 178.355 178.355 176.281 2.074 18003
4082 1 7 . 1 1 58 58 GLU CA C 59 56.643 56.643 56.617 0.026 18003
4083 1 7 . 1 1 58 58 GLU CB C 59 30.029 30.029 30.256 -0.227 18003
4084 1 7 . 1 1 58 58 GLU H H 59 8.523 8.523 8.491 0.032 18003
4085 1 7 . 1 1 59 59 GLN N N 60 123.686 123.686 119.341 4.345 18003
4086 1 7 . 1 1 59 59 GLN HA H 60 4.214 4.214 4.028 0.186 18003
4087 1 7 . 1 1 59 59 GLN C C 60 177.961 177.961 177.462 0.499 18003
4088 1 7 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.834 1.782 18003
4089 1 7 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.375 0.640 18003
4090 1 7 . 1 1 59 59 GLN H H 60 9.009 9.009 8.715 0.294 18003
4091 1 7 . 1 1 60 60 SER N N 61 115.101 115.101 114.181 0.920 18003
4092 1 7 . 1 1 60 60 SER C C 61 176.801 176.801 175.761 1.040 18003
4093 1 7 . 1 1 60 60 SER CA C 61 61.213 61.213 60.748 0.466 18003
4094 1 7 . 1 1 60 60 SER H H 61 8.964 8.964 8.279 0.685 18003
4095 1 7 . 1 1 61 61 ALA N N 62 126.069 126.069 125.439 0.630 18003
4096 1 7 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.208 0.143 18003
4097 1 7 . 1 1 61 61 ALA C C 62 180.635 180.635 179.441 1.194 18003
4098 1 7 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.629 -0.371 18003
4099 1 7 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.619 0.004 18003
4100 1 7 . 1 1 61 61 ALA H H 62 7.103 7.103 7.812 -0.709 18003
4101 1 7 . 1 1 62 62 VAL N N 63 119.252 119.252 119.325 -0.073 18003
4102 1 7 . 1 1 62 62 VAL C C 63 177.842 177.842 177.109 0.733 18003
4103 1 7 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.338 0.460 18003
4104 1 7 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.974 -0.710 18003
4105 1 7 . 1 1 62 62 VAL H H 63 7.971 7.971 7.925 0.046 18003
4106 1 7 . 1 1 63 63 SER N N 64 115.494 115.494 114.948 0.546 18003
4107 1 7 . 1 1 63 63 SER HA H 64 4.034 4.034 4.002 0.032 18003
4108 1 7 . 1 1 63 63 SER C C 64 176.835 176.835 176.471 0.364 18003
4109 1 7 . 1 1 63 63 SER CA C 64 62.400 62.400 61.770 0.630 18003
4110 1 7 . 1 1 63 63 SER CB C 64 62.752 62.752 62.855 -0.103 18003
4111 1 7 . 1 1 63 63 SER H H 64 8.743 8.743 7.992 0.751 18003
4112 1 7 . 1 1 64 64 HIS N N 65 120.010 120.010 120.608 -0.598 18003
4113 1 7 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.335 0.025 18003
4114 1 7 . 1 1 64 64 HIS C C 65 177.731 177.731 177.290 0.441 18003
4115 1 7 . 1 1 64 64 HIS CA C 65 59.998 59.998 59.894 0.104 18003
4116 1 7 . 1 1 64 64 HIS CB C 65 29.934 29.934 30.158 -0.224 18003
4117 1 7 . 1 1 64 64 HIS H H 65 7.804 7.804 7.913 -0.109 18003
4118 1 7 . 1 1 65 65 GLN N N 66 115.590 115.590 119.624 -4.034 18003
4119 1 7 . 1 1 65 65 GLN HA H 66 4.035 4.035 4.036 -0.001 18003
4120 1 7 . 1 1 65 65 GLN C C 66 179.055 179.055 178.371 0.684 18003
4121 1 7 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.419 -0.889 18003
4122 1 7 . 1 1 65 65 GLN H H 66 7.751 7.751 8.024 -0.273 18003
4123 1 7 . 1 1 66 66 LEU N N 67 118.746 118.746 119.968 -1.222 18003
4124 1 7 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.952 -0.005 18003
4125 1 7 . 1 1 66 66 LEU C C 67 178.334 178.334 179.082 -0.748 18003
4126 1 7 . 1 1 66 66 LEU CA C 67 57.846 57.846 57.958 -0.112 18003
4127 1 7 . 1 1 66 66 LEU CB C 67 41.103 41.103 40.995 0.108 18003
4128 1 7 . 1 1 66 66 LEU H H 67 8.648 8.648 8.644 0.004 18003
4129 1 7 . 1 1 67 67 ARG N N 68 119.610 119.610 119.446 0.164 18003
4130 1 7 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.890 0.053 18003
4131 1 7 . 1 1 67 67 ARG C C 68 178.807 178.807 178.640 0.167 18003
4132 1 7 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.587 -0.210 18003
4133 1 7 . 1 1 67 67 ARG CB C 68 29.475 29.475 30.012 -0.537 18003
4134 1 7 . 1 1 67 67 ARG H H 68 7.607 7.607 8.018 -0.411 18003
4135 1 7 . 1 1 68 68 VAL N N 69 119.719 119.719 119.722 -0.003 18003
4136 1 7 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.564 0.069 18003
4137 1 7 . 1 1 68 68 VAL C C 69 178.690 178.690 178.154 0.536 18003
4138 1 7 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.652 -0.198 18003
4139 1 7 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.516 0.263 18003
4140 1 7 . 1 1 68 68 VAL H H 69 7.259 7.259 7.761 -0.502 18003
4141 1 7 . 1 1 69 69 LEU N N 70 117.532 117.532 118.344 -0.812 18003
4142 1 7 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.948 -0.000 18003
4143 1 7 . 1 1 69 69 LEU C C 70 179.144 179.144 178.944 0.200 18003
4144 1 7 . 1 1 69 69 LEU CA C 70 57.750 57.750 57.435 0.314 18003
4145 1 7 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.180 0.680 18003
4146 1 7 . 1 1 69 69 LEU H H 70 8.375 8.375 7.991 0.384 18003
4147 1 7 . 1 1 70 70 ARG N N 71 122.498 122.498 120.368 2.130 18003
4148 1 7 . 1 1 70 70 ARG HA H 71 3.931 3.931 3.961 -0.030 18003
4149 1 7 . 1 1 70 70 ARG C C 71 180.499 180.499 178.581 1.918 18003
4150 1 7 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.654 -0.877 18003
4151 1 7 . 1 1 70 70 ARG CB C 71 30.155 30.155 30.083 0.072 18003
4152 1 7 . 1 1 70 70 ARG H H 71 8.822 8.822 8.482 0.340 18003
4153 1 7 . 1 1 71 71 ASN N N 72 121.816 121.816 117.223 4.593 18003
4154 1 7 . 1 1 71 71 ASN C C 72 177.170 177.170 177.979 -0.809 18003
4155 1 7 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.492 0.285 18003
4156 1 7 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.038 -0.304 18003
4157 1 7 . 1 1 71 71 ASN H H 72 8.144 8.144 7.963 0.181 18003
4158 1 7 . 1 1 72 72 LEU N N 73 117.044 117.044 117.948 -0.904 18003
4159 1 7 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.177 0.168 18003
4160 1 7 . 1 1 72 72 LEU C C 73 176.984 176.984 178.152 -1.168 18003
4161 1 7 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.217 -1.092 18003
4162 1 7 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.278 0.991 18003
4163 1 7 . 1 1 72 72 LEU H H 73 7.804 7.804 7.420 0.384 18003
4164 1 7 . 1 1 73 73 GLY N N 74 106.621 106.621 105.878 0.743 18003
4165 1 7 . 1 1 73 73 GLY C C 74 173.266 173.266 173.594 -0.328 18003
4166 1 7 . 1 1 73 73 GLY CA C 74 46.022 46.022 44.988 1.034 18003
4167 1 7 . 1 1 73 73 GLY H H 74 7.851 7.851 8.065 -0.214 18003
4168 1 7 . 1 1 74 74 LEU N N 75 114.582 114.582 120.069 -5.487 18003
4169 1 7 . 1 1 74 74 LEU C C 75 177.562 177.562 175.421 2.141 18003
4170 1 7 . 1 1 74 74 LEU CA C 75 56.031 56.031 54.430 1.601 18003
4171 1 7 . 1 1 74 74 LEU CB C 75 44.444 44.444 44.612 -0.168 18003
4172 1 7 . 1 1 74 74 LEU H H 75 7.808 7.808 7.760 0.048 18003
4173 1 7 . 1 1 75 75 VAL N N 76 110.980 110.980 111.722 -0.742 18003
4174 1 7 . 1 1 75 75 VAL HA H 76 4.527 4.527 5.086 -0.559 18003
4175 1 7 . 1 1 75 75 VAL C C 76 173.922 173.922 174.230 -0.308 18003
4176 1 7 . 1 1 75 75 VAL CA C 76 57.943 57.943 59.905 -1.962 18003
4177 1 7 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.335 0.694 18003
4178 1 7 . 1 1 75 75 VAL H H 76 7.079 7.079 7.347 -0.268 18003
4179 1 7 . 1 1 76 76 VAL N N 77 118.619 118.619 118.920 -0.301 18003
4180 1 7 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.547 0.755 18003
4181 1 7 . 1 1 76 76 VAL C C 77 174.041 174.041 174.507 -0.466 18003
4182 1 7 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.523 -0.524 18003
4183 1 7 . 1 1 76 76 VAL H H 77 9.024 9.024 9.167 -0.143 18003
4184 1 7 . 1 1 77 77 GLY N N 78 109.451 109.451 108.665 0.786 18003
4185 1 7 . 1 1 77 77 GLY C C 78 172.225 172.225 172.834 -0.609 18003
4186 1 7 . 1 1 77 77 GLY CA C 78 44.462 44.462 43.989 0.473 18003
4187 1 7 . 1 1 77 77 GLY H H 78 8.265 8.265 8.389 -0.124 18003
4188 1 7 . 1 1 78 78 ASP N N 79 122.826 122.826 120.679 2.147 18003
4189 1 7 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.711 0.035 18003
4190 1 7 . 1 1 78 78 ASP C C 79 174.817 174.817 175.203 -0.386 18003
4191 1 7 . 1 1 78 78 ASP CA C 79 53.111 53.111 53.799 -0.688 18003
4192 1 7 . 1 1 78 78 ASP CB C 79 43.655 43.655 43.958 -0.303 18003
4193 1 7 . 1 1 78 78 ASP H H 79 8.479 8.479 8.131 0.348 18003
4194 1 7 . 1 1 79 79 ARG N N 80 122.613 122.613 124.924 -2.311 18003
4195 1 7 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.089 0.323 18003
4196 1 7 . 1 1 79 79 ARG C C 80 175.546 175.546 174.988 0.558 18003
4197 1 7 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.749 -0.431 18003
4198 1 7 . 1 1 79 79 ARG CB C 80 30.376 30.376 30.577 -0.201 18003
4199 1 7 . 1 1 79 79 ARG H H 80 8.580 8.580 8.684 -0.104 18003
4200 1 7 . 1 1 80 80 ALA N N 81 129.263 129.263 128.917 0.346 18003
4201 1 7 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.407 0.045 18003
4202 1 7 . 1 1 80 80 ALA C C 81 177.126 177.126 176.198 0.928 18003
4203 1 7 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.892 -0.272 18003
4204 1 7 . 1 1 80 80 ALA CB C 81 19.260 19.260 20.559 -1.299 18003
4205 1 7 . 1 1 80 80 ALA H H 81 8.396 8.396 8.526 -0.130 18003
4206 1 7 . 1 1 81 81 GLY N N 82 112.739 112.739 109.896 2.843 18003
4207 1 7 . 1 1 81 81 GLY C C 82 174.856 174.856 174.454 0.402 18003
4208 1 7 . 1 1 81 81 GLY CA C 82 46.392 46.392 45.679 0.713 18003
4209 1 7 . 1 1 81 81 GLY H H 82 8.641 8.641 8.756 -0.115 18003
4210 1 7 . 1 1 82 82 ARG N N 83 124.780 124.780 115.781 8.999 18003
4211 1 7 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.039 0.284 18003
4212 1 7 . 1 1 82 82 ARG C C 83 176.339 176.339 174.964 1.375 18003
4213 1 7 . 1 1 82 82 ARG CA C 83 56.690 56.690 56.755 -0.066 18003
4214 1 7 . 1 1 82 82 ARG CB C 83 30.221 30.221 29.465 0.756 18003
4215 1 7 . 1 1 82 82 ARG H H 83 8.728 8.728 8.552 0.176 18003
4216 1 7 . 1 1 83 83 SER N N 84 114.678 114.678 113.219 1.459 18003
4217 1 7 . 1 1 83 83 SER C C 84 172.869 172.869 172.822 0.047 18003
4218 1 7 . 1 1 83 83 SER CA C 84 56.834 56.834 56.825 0.009 18003
4219 1 7 . 1 1 83 83 SER CB C 84 65.191 65.191 65.230 -0.039 18003
4220 1 7 . 1 1 83 83 SER H H 84 7.821 7.821 7.693 0.128 18003
4221 1 7 . 1 1 84 84 ILE N N 85 122.996 122.996 122.843 0.153 18003
4222 1 7 . 1 1 84 84 ILE C C 85 175.521 175.521 174.677 0.844 18003
4223 1 7 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.431 0.804 18003
4224 1 7 . 1 1 84 84 ILE CB C 85 38.136 38.136 39.639 -1.503 18003
4225 1 7 . 1 1 84 84 ILE H H 85 8.232 8.232 8.290 -0.058 18003
4226 1 7 . 1 1 85 85 VAL N N 86 121.845 121.845 123.838 -1.993 18003
4227 1 7 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.230 0.080 18003
4228 1 7 . 1 1 85 85 VAL C C 86 174.818 174.818 174.662 0.156 18003
4229 1 7 . 1 1 85 85 VAL CA C 86 59.738 59.738 60.805 -1.067 18003
4230 1 7 . 1 1 85 85 VAL CB C 86 34.221 34.221 35.131 -0.910 18003
4231 1 7 . 1 1 85 85 VAL H H 86 8.495 8.495 8.188 0.307 18003
4232 1 7 . 1 1 86 86 TYR N N 87 125.020 125.020 127.052 -2.032 18003
4233 1 7 . 1 1 86 86 TYR HA H 87 4.319 4.319 4.853 -0.534 18003
4234 1 7 . 1 1 86 86 TYR C C 87 173.808 173.808 175.601 -1.793 18003
4235 1 7 . 1 1 86 86 TYR CA C 87 57.465 57.465 58.603 -1.138 18003
4236 1 7 . 1 1 86 86 TYR CB C 87 41.480 41.480 39.112 2.368 18003
4237 1 7 . 1 1 86 86 TYR H H 87 8.488 8.488 8.681 -0.193 18003
4238 1 7 . 1 1 87 87 SER N N 88 110.681 110.681 115.744 -5.063 18003
4239 1 7 . 1 1 87 87 SER HA H 88 5.414 5.414 4.885 0.529 18003
4240 1 7 . 1 1 87 87 SER C C 88 174.693 174.693 173.197 1.496 18003
4241 1 7 . 1 1 87 87 SER CA C 88 56.113 56.113 56.906 -0.793 18003
4242 1 7 . 1 1 87 87 SER CB C 88 66.309 66.309 67.310 -1.001 18003
4243 1 7 . 1 1 87 87 SER H H 88 8.718 8.718 9.132 -0.414 18003
4244 1 7 . 1 1 88 88 LEU N N 89 119.612 119.612 123.311 -3.699 18003
4245 1 7 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.271 0.656 18003
4246 1 7 . 1 1 88 88 LEU C C 89 179.031 179.031 177.270 1.761 18003
4247 1 7 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.586 -0.261 18003
4248 1 7 . 1 1 88 88 LEU CB C 89 41.720 41.720 41.960 -0.240 18003
4249 1 7 . 1 1 88 88 LEU H H 89 9.034 9.034 8.640 0.394 18003
4250 1 7 . 1 1 89 89 TYR N N 90 120.540 120.540 124.549 -4.009 18003
4251 1 7 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.201 0.421 18003
4252 1 7 . 1 1 89 89 TYR CA C 90 61.712 61.712 61.071 0.641 18003
4253 1 7 . 1 1 89 89 TYR H H 90 8.075 8.075 8.813 -0.738 18003
4254 1 7 . 1 1 92 92 HIS C C 93 177.850 177.850 177.495 0.355 18003
4255 1 7 . 1 1 93 93 VAL N N 94 120.211 120.211 119.183 1.028 18003
4256 1 7 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.677 -0.176 18003
4257 1 7 . 1 1 93 93 VAL C C 94 176.785 176.785 177.551 -0.766 18003
4258 1 7 . 1 1 93 93 VAL CA C 94 66.666 66.666 66.361 0.305 18003
4259 1 7 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.163 0.474 18003
4260 1 7 . 1 1 93 93 VAL H H 94 8.164 8.164 7.790 0.374 18003
4261 1 7 . 1 1 94 94 ALA N N 95 119.221 119.221 121.061 -1.840 18003
4262 1 7 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.946 -0.156 18003
4263 1 7 . 1 1 94 94 ALA C C 95 177.979 177.979 179.692 -1.713 18003
4264 1 7 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.257 0.222 18003
4265 1 7 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.093 0.017 18003
4266 1 7 . 1 1 94 94 ALA H H 95 6.942 6.942 7.622 -0.680 18003
4267 1 7 . 1 1 95 95 GLN N N 96 115.416 115.416 119.161 -3.745 18003
4268 1 7 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.048 -0.013 18003
4269 1 7 . 1 1 95 95 GLN C C 96 177.993 177.993 178.155 -0.162 18003
4270 1 7 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.264 0.578 18003
4271 1 7 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.493 -0.464 18003
4272 1 7 . 1 1 95 95 GLN H H 96 7.795 7.795 7.756 0.039 18003
4273 1 7 . 1 1 96 96 LEU N N 97 120.758 120.758 121.278 -0.520 18003
4274 1 7 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.018 -0.169 18003
4275 1 7 . 1 1 96 96 LEU C C 97 177.974 177.974 178.572 -0.598 18003
4276 1 7 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.291 0.991 18003
4277 1 7 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.862 -0.816 18003
4278 1 7 . 1 1 96 96 LEU H H 97 8.197 8.197 8.380 -0.183 18003
4279 1 7 . 1 1 97 97 LEU N N 98 117.567 117.567 118.814 -1.247 18003
4280 1 7 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.852 -0.022 18003
4281 1 7 . 1 1 97 97 LEU C C 98 178.219 178.219 178.886 -0.667 18003
4282 1 7 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.255 -0.525 18003
4283 1 7 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.234 0.627 18003
4284 1 7 . 1 1 97 97 LEU H H 98 7.660 7.660 8.112 -0.452 18003
4285 1 7 . 1 1 98 98 ASP N N 99 118.607 118.607 119.378 -0.771 18003
4286 1 7 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.327 -0.218 18003
4287 1 7 . 1 1 98 98 ASP C C 99 179.382 179.382 178.549 0.833 18003
4288 1 7 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.746 0.289 18003
4289 1 7 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.620 -0.781 18003
4290 1 7 . 1 1 98 98 ASP H H 99 8.295 8.295 8.147 0.148 18003
4291 1 7 . 1 1 99 99 GLU N N 100 117.542 117.542 119.262 -1.720 18003
4292 1 7 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.006 -0.157 18003
4293 1 7 . 1 1 99 99 GLU C C 100 179.389 179.389 179.018 0.371 18003
4294 1 7 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.201 -1.178 18003
4295 1 7 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.393 -0.364 18003
4296 1 7 . 1 1 99 99 GLU H H 100 8.334 8.334 8.033 0.301 18003
4297 1 7 . 1 1 100 100 ALA N N 101 122.890 122.890 122.945 -0.055 18003
4298 1 7 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.124 -0.126 18003
4299 1 7 . 1 1 100 100 ALA C C 101 180.184 180.184 179.837 0.347 18003
4300 1 7 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.370 0.150 18003
4301 1 7 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.359 -0.740 18003
4302 1 7 . 1 1 100 100 ALA H H 101 8.550 8.550 8.121 0.429 18003
4303 1 7 . 1 1 101 101 ILE N N 102 119.952 119.952 118.904 1.048 18003
4304 1 7 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.727 -0.138 18003
4305 1 7 . 1 1 101 101 ILE C C 102 178.114 178.114 178.315 -0.201 18003
4306 1 7 . 1 1 101 101 ILE CA C 102 65.376 65.376 65.094 0.282 18003
4307 1 7 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.166 0.863 18003
4308 1 7 . 1 1 101 101 ILE H H 102 8.493 8.493 8.699 -0.206 18003
4309 1 7 . 1 1 102 102 TYR N N 103 120.625 120.625 118.775 1.850 18003
4310 1 7 . 1 1 102 102 TYR HA H 103 4.171 4.171 3.972 0.199 18003
4311 1 7 . 1 1 102 102 TYR C C 103 179.772 179.772 178.177 1.595 18003
4312 1 7 . 1 1 102 102 TYR CA C 103 60.724 60.724 61.192 -0.468 18003
4313 1 7 . 1 1 102 102 TYR CB C 103 37.500 37.500 37.514 -0.014 18003
4314 1 7 . 1 1 102 102 TYR H H 103 8.520 8.520 8.584 -0.064 18003
4315 1 7 . 1 1 103 103 HIS N N 104 117.456 117.456 120.030 -2.574 18003
4316 1 7 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.564 -0.139 18003
4317 1 7 . 1 1 103 103 HIS C C 104 176.377 176.377 177.744 -1.367 18003
4318 1 7 . 1 1 103 103 HIS CA C 104 60.043 60.043 58.763 1.280 18003
4319 1 7 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.713 -0.684 18003
4320 1 7 . 1 1 103 103 HIS H H 104 8.622 8.622 8.598 0.024 18003
4321 1 7 . 1 1 104 104 SER N N 105 113.596 113.596 113.309 0.287 18003
4322 1 7 . 1 1 104 104 SER C C 105 176.712 176.712 175.895 0.817 18003
4323 1 7 . 1 1 104 104 SER CA C 105 61.852 61.852 60.394 1.458 18003
4324 1 7 . 1 1 104 104 SER CB C 105 63.550 63.550 63.322 0.228 18003
4325 1 7 . 1 1 104 104 SER H H 105 7.900 7.900 7.969 -0.069 18003
4326 1 7 . 1 1 105 105 GLU N N 106 119.022 119.022 120.189 -1.167 18003
4327 1 7 . 1 1 105 105 GLU HA H 106 4.013 4.013 3.929 0.084 18003
4328 1 7 . 1 1 105 105 GLU C C 106 177.902 177.902 178.895 -0.993 18003
4329 1 7 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.605 -0.575 18003
4330 1 7 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.464 -0.185 18003
4331 1 7 . 1 1 105 105 GLU H H 106 8.181 8.181 7.876 0.305 18003
4332 1 7 . 1 1 106 106 HIS N N 107 116.482 116.482 117.038 -0.556 18003
4333 1 7 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.304 0.103 18003
4334 1 7 . 1 1 106 106 HIS C C 107 175.575 175.575 176.026 -0.451 18003
4335 1 7 . 1 1 106 106 HIS CA C 107 57.343 57.343 59.076 -1.733 18003
4336 1 7 . 1 1 106 106 HIS CB C 107 28.580 28.580 30.555 -1.975 18003
4337 1 7 . 1 1 106 106 HIS H H 107 7.770 7.770 7.756 0.014 18003
4338 1 7 . 1 1 107 107 LEU N N 108 120.346 120.346 118.106 2.240 18003
4339 1 7 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.423 -0.369 18003
4340 1 7 . 1 1 107 107 LEU C C 108 177.404 177.404 174.937 2.467 18003
4341 1 7 . 1 1 107 107 LEU CA C 108 55.991 55.991 55.465 0.526 18003
4342 1 7 . 1 1 107 107 LEU CB C 108 42.030 42.030 43.412 -1.382 18003
4343 1 7 . 1 1 107 107 LEU H H 108 7.682 7.682 8.053 -0.371 18003
4344 1 7 . 1 1 108 108 HIS N N 109 117.222 117.222 126.054 -8.832 18003
4345 1 7 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.770 -0.716 18003
4346 1 7 . 1 1 108 108 HIS C C 109 174.606 174.606 174.522 0.084 18003
4347 1 7 . 1 1 108 108 HIS CA C 109 56.029 56.029 56.364 -0.335 18003
4348 1 7 . 1 1 108 108 HIS CB C 109 28.517 28.517 31.657 -3.140 18003
4349 1 7 . 1 1 108 108 HIS H H 109 8.030 8.030 8.742 -0.712 18003
4350 1 7 . 1 1 109 109 LEU N N 110 121.114 121.114 123.816 -2.702 18003
4351 1 7 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.105 0.193 18003
4352 1 7 . 1 1 109 109 LEU C C 110 178.028 178.028 177.301 0.727 18003
4353 1 7 . 1 1 109 109 LEU CA C 110 55.574 55.574 55.204 0.370 18003
4354 1 7 . 1 1 109 109 LEU CB C 110 42.076 42.076 42.249 -0.173 18003
4355 1 7 . 1 1 109 109 LEU H H 110 7.973 7.973 8.499 -0.526 18003
4356 1 7 . 1 1 110 110 GLY N N 111 108.631 108.631 107.548 1.083 18003
4357 1 7 . 1 1 110 110 GLY C C 111 174.606 174.606 174.656 -0.050 18003
4358 1 7 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.584 0.996 18003
4359 1 7 . 1 1 110 110 GLY H H 111 8.255 8.255 7.577 0.678 18003
4360 1 7 . 1 1 111 111 LEU N N 112 121.022 121.022 122.948 -1.926 18003
4361 1 7 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.473 -0.114 18003
4362 1 7 . 1 1 111 111 LEU C C 112 177.701 177.701 177.036 0.665 18003
4363 1 7 . 1 1 111 111 LEU CA C 112 55.476 55.476 54.647 0.829 18003
4364 1 7 . 1 1 111 111 LEU CB C 112 41.899 41.899 43.124 -1.226 18003
4365 1 7 . 1 1 111 111 LEU H H 112 7.981 7.981 7.907 0.074 18003
4366 1 7 . 1 1 112 112 SER N N 113 115.471 115.471 121.170 -5.699 18003
4367 1 7 . 1 1 112 112 SER HA H 113 4.432 4.432 4.437 -0.005 18003
4368 1 7 . 1 1 112 112 SER C C 113 174.381 174.381 173.885 0.496 18003
4369 1 7 . 1 1 112 112 SER CA C 113 58.527 58.527 58.130 0.397 18003
4370 1 7 . 1 1 112 112 SER CB C 113 63.593 63.593 64.253 -0.660 18003
4371 1 7 . 1 1 112 112 SER H H 113 8.215 8.215 8.541 -0.326 18003
4372 1 7 . 1 1 113 113 ASP N N 114 121.696 121.696 122.764 -1.068 18003
4373 1 7 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.668 -0.241 18003
4374 1 7 . 1 1 113 113 ASP C C 114 175.958 175.958 176.413 -0.455 18003
4375 1 7 . 1 1 113 113 ASP CA C 114 54.213 54.213 53.620 0.593 18003
4376 1 7 . 1 1 113 113 ASP CB C 114 41.030 41.030 41.035 -0.005 18003
4377 1 7 . 1 1 113 113 ASP H H 114 8.203 8.203 8.480 -0.277 18003
4378 1 7 . 1 1 114 114 ARG N N 115 120.088 120.088 119.310 0.778 18003
4379 1 7 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.151 0.121 18003
4380 1 7 . 1 1 114 114 ARG C C 115 175.792 175.792 176.628 -0.836 18003
4381 1 7 . 1 1 114 114 ARG CA C 115 55.735 55.735 56.843 -1.108 18003
4382 1 7 . 1 1 114 114 ARG CB C 115 30.586 30.586 30.640 -0.054 18003
4383 1 7 . 1 1 114 114 ARG H H 115 8.016 8.016 7.525 0.491 18003
4384 1 7 . 1 1 115 115 HIS N N 116 120.597 120.597 115.897 4.700 18003
4385 1 7 . 1 1 115 115 HIS CA C 116 53.697 53.697 54.867 -1.170 18003
4386 1 7 . 1 1 115 115 HIS CB C 116 29.299 29.299 27.720 1.579 18003
4387 1 7 . 1 1 115 115 HIS H H 116 8.385 8.385 8.260 0.125 18003
4388 1 7 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.467 0.015 18003
4389 1 7 . 1 1 116 116 PRO C C 117 177.090 177.090 176.529 0.561 18003
4390 1 7 . 1 1 116 116 PRO CA C 117 63.177 63.177 63.291 -0.114 18003
4391 1 7 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.590 -0.770 18003
4392 1 7 . 1 1 117 117 SER N N 118 116.220 116.220 118.509 -2.289 18003
4393 1 7 . 1 1 117 117 SER HA H 118 4.465 4.465 4.651 -0.186 18003
4394 1 7 . 1 1 117 117 SER C C 118 174.287 174.287 174.187 0.100 18003
4395 1 7 . 1 1 117 117 SER CA C 118 58.110 58.110 57.921 0.189 18003
4396 1 7 . 1 1 117 117 SER CB C 118 63.750 63.750 64.677 -0.926 18003
4397 1 7 . 1 1 117 117 SER H H 118 8.487 8.487 8.339 0.148 18003
4398 1 7 . 1 1 118 118 ALA N N 119 126.082 126.082 127.999 -1.917 18003
4399 1 7 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.447 -0.008 18003
4400 1 7 . 1 1 118 118 ALA C C 119 176.879 176.879 178.511 -1.632 18003
4401 1 7 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.283 0.166 18003
4402 1 7 . 1 1 118 118 ALA CB C 119 19.483 19.483 19.537 -0.054 18003
4403 1 7 . 1 1 118 118 ALA H H 119 8.295 8.295 8.499 -0.204 18003
4404 1 8 . 1 1 2 2 HIS C C 3 175.176 175.176 175.426 -0.250 18003
4405 1 8 . 1 1 2 2 HIS CA C 3 55.900 55.900 55.170 0.730 18003
4406 1 8 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.965 -0.936 18003
4407 1 8 . 1 1 3 3 GLY N N 4 110.613 110.613 111.888 -1.275 18003
4408 1 8 . 1 1 3 3 GLY C C 4 174.068 174.068 175.097 -1.029 18003
4409 1 8 . 1 1 3 3 GLY CA C 4 45.141 45.141 44.893 0.248 18003
4410 1 8 . 1 1 3 3 GLY H H 4 8.500 8.500 8.805 -0.305 18003
4411 1 8 . 1 1 4 4 VAL N N 5 119.318 119.318 120.806 -1.488 18003
4412 1 8 . 1 1 4 4 VAL HA H 5 4.128 4.128 3.995 0.133 18003
4413 1 8 . 1 1 4 4 VAL C C 5 176.361 176.361 176.400 -0.039 18003
4414 1 8 . 1 1 4 4 VAL CA C 5 61.987 61.987 63.035 -1.048 18003
4415 1 8 . 1 1 4 4 VAL CB C 5 32.635 32.635 32.267 0.368 18003
4416 1 8 . 1 1 4 4 VAL H H 5 8.094 8.094 7.978 0.116 18003
4417 1 8 . 1 1 5 5 GLU N N 6 124.369 124.369 120.901 3.468 18003
4418 1 8 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.251 0.037 18003
4419 1 8 . 1 1 5 5 GLU C C 6 177.012 177.012 176.226 0.786 18003
4420 1 8 . 1 1 5 5 GLU CA C 6 56.699 56.699 56.405 0.294 18003
4421 1 8 . 1 1 5 5 GLU CB C 6 30.029 30.029 30.531 -0.502 18003
4422 1 8 . 1 1 5 5 GLU H H 6 8.545 8.545 7.845 0.700 18003
4423 1 8 . 1 1 6 6 GLY N N 7 109.747 109.747 109.894 -0.147 18003
4424 1 8 . 1 1 6 6 GLY C C 7 174.117 174.117 173.894 0.223 18003
4425 1 8 . 1 1 6 6 GLY CA C 7 45.568 45.568 44.786 0.782 18003
4426 1 8 . 1 1 6 6 GLY H H 7 8.352 8.352 8.289 0.063 18003
4427 1 8 . 1 1 7 7 ARG N N 8 120.059 120.059 121.303 -1.244 18003
4428 1 8 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.085 0.257 18003
4429 1 8 . 1 1 7 7 ARG C C 8 176.016 176.016 174.417 1.599 18003
4430 1 8 . 1 1 7 7 ARG CA C 8 55.833 55.833 56.243 -0.410 18003
4431 1 8 . 1 1 7 7 ARG CB C 8 30.444 30.444 30.091 0.353 18003
4432 1 8 . 1 1 7 7 ARG H H 8 8.084 8.084 8.371 -0.287 18003
4433 1 8 . 1 1 8 8 ASN N N 9 119.379 119.379 119.812 -0.433 18003
4434 1 8 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.775 -0.443 18003
4435 1 8 . 1 1 8 8 ASN C C 9 174.667 174.667 174.331 0.336 18003
4436 1 8 . 1 1 8 8 ASN CA C 9 53.441 53.441 52.472 0.969 18003
4437 1 8 . 1 1 8 8 ASN CB C 9 38.480 38.480 39.794 -1.314 18003
4438 1 8 . 1 1 8 8 ASN H H 9 8.411 8.411 8.059 0.352 18003
4439 1 8 . 1 1 9 9 ARG N N 10 121.700 121.700 118.872 2.828 18003
4440 1 8 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.197 0.452 18003
4441 1 8 . 1 1 9 9 ARG CA C 10 53.147 53.147 56.025 -2.878 18003
4442 1 8 . 1 1 9 9 ARG CB C 10 30.197 30.197 28.056 2.141 18003
4443 1 8 . 1 1 9 9 ARG H H 10 8.138 8.138 8.364 -0.226 18003
4444 1 8 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.541 -0.098 18003
4445 1 8 . 1 1 10 10 PRO C C 11 176.815 176.815 176.264 0.551 18003
4446 1 8 . 1 1 10 10 PRO CA C 11 63.177 63.177 62.848 0.329 18003
4447 1 8 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.597 -0.777 18003
4448 1 8 . 1 1 11 11 SER N N 12 116.291 116.291 116.769 -0.478 18003
4449 1 8 . 1 1 11 11 SER HA H 12 4.418 4.418 4.668 -0.250 18003
4450 1 8 . 1 1 11 11 SER C C 12 173.702 173.702 173.111 0.591 18003
4451 1 8 . 1 1 11 11 SER CA C 12 58.031 58.031 58.438 -0.407 18003
4452 1 8 . 1 1 11 11 SER CB C 12 64.032 64.032 64.012 0.020 18003
4453 1 8 . 1 1 11 11 SER H H 12 8.325 8.325 8.252 0.073 18003
4454 1 8 . 1 1 12 12 ALA N N 13 126.862 126.862 129.098 -2.236 18003
4455 1 8 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.344 0.044 18003
4456 1 8 . 1 1 12 12 ALA CA C 13 50.458 50.458 52.571 -2.113 18003
4457 1 8 . 1 1 12 12 ALA CB C 13 18.257 18.257 18.039 0.218 18003
4458 1 8 . 1 1 12 12 ALA H H 13 8.166 8.166 8.449 -0.283 18003
4459 1 8 . 1 1 13 13 PRO C C 14 176.368 176.368 176.639 -0.271 18003
4460 1 8 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.702 0.235 18003
4461 1 8 . 1 1 13 13 PRO CB C 14 32.022 32.022 32.001 0.021 18003
4462 1 8 . 1 1 14 14 LEU N N 15 120.969 120.969 119.845 1.124 18003
4463 1 8 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.198 0.060 18003
4464 1 8 . 1 1 14 14 LEU C C 15 176.124 176.124 178.319 -2.195 18003
4465 1 8 . 1 1 14 14 LEU CA C 15 54.527 54.527 54.712 -0.185 18003
4466 1 8 . 1 1 14 14 LEU CB C 15 43.418 43.418 42.386 1.032 18003
4467 1 8 . 1 1 14 14 LEU H H 15 7.875 7.875 8.274 -0.399 18003
4468 1 8 . 1 1 15 15 ASP N N 16 121.780 121.780 121.708 0.072 18003
4469 1 8 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.264 0.329 18003
4470 1 8 . 1 1 15 15 ASP C C 16 176.208 176.208 177.636 -1.428 18003
4471 1 8 . 1 1 15 15 ASP CA C 16 52.468 52.468 57.153 -4.685 18003
4472 1 8 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.423 1.206 18003
4473 1 8 . 1 1 15 15 ASP H H 16 7.850 7.850 8.870 -1.020 18003
4474 1 8 . 1 1 16 16 SER N N 17 114.435 114.435 114.956 -0.521 18003
4475 1 8 . 1 1 16 16 SER HA H 17 4.120 4.120 4.074 0.046 18003
4476 1 8 . 1 1 16 16 SER C C 17 177.207 177.207 176.461 0.746 18003
4477 1 8 . 1 1 16 16 SER CA C 17 62.322 62.322 61.269 1.053 18003
4478 1 8 . 1 1 16 16 SER H H 17 8.658 8.658 8.179 0.479 18003
4479 1 8 . 1 1 17 17 GLN N N 18 122.403 122.403 120.293 2.110 18003
4480 1 8 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.078 0.119 18003
4481 1 8 . 1 1 17 17 GLN C C 18 178.715 178.715 178.359 0.356 18003
4482 1 8 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.358 -0.244 18003
4483 1 8 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.011 0.029 18003
4484 1 8 . 1 1 17 17 GLN H H 18 8.140 8.140 8.138 0.002 18003
4485 1 8 . 1 1 18 18 ALA N N 19 124.743 124.743 122.044 2.699 18003
4486 1 8 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.100 0.076 18003
4487 1 8 . 1 1 18 18 ALA C C 19 180.616 180.616 179.480 1.136 18003
4488 1 8 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.561 0.044 18003
4489 1 8 . 1 1 18 18 ALA CB C 19 19.028 19.028 17.948 1.080 18003
4490 1 8 . 1 1 18 18 ALA H H 19 8.455 8.455 8.268 0.187 18003
4491 1 8 . 1 1 19 19 ALA N N 20 119.089 119.089 121.483 -2.394 18003
4492 1 8 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.042 0.137 18003
4493 1 8 . 1 1 19 19 ALA C C 20 179.239 179.239 179.382 -0.143 18003
4494 1 8 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.903 0.368 18003
4495 1 8 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.355 -0.163 18003
4496 1 8 . 1 1 19 19 ALA H H 20 8.993 8.993 8.173 0.820 18003
4497 1 8 . 1 1 20 20 ALA N N 21 119.226 119.226 121.153 -1.927 18003
4498 1 8 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.945 0.115 18003
4499 1 8 . 1 1 20 20 ALA C C 21 180.230 180.230 179.587 0.643 18003
4500 1 8 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.070 0.073 18003
4501 1 8 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.087 -0.059 18003
4502 1 8 . 1 1 20 20 ALA H H 21 7.724 7.724 7.986 -0.262 18003
4503 1 8 . 1 1 21 21 GLN N N 22 119.310 119.310 118.517 0.793 18003
4504 1 8 . 1 1 21 21 GLN HA H 22 4.129 4.129 4.014 0.115 18003
4505 1 8 . 1 1 21 21 GLN C C 22 179.319 179.319 178.460 0.859 18003
4506 1 8 . 1 1 21 21 GLN CA C 22 58.762 58.762 58.591 0.171 18003
4507 1 8 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.351 -0.322 18003
4508 1 8 . 1 1 21 21 GLN H H 22 7.638 7.638 8.013 -0.375 18003
4509 1 8 . 1 1 22 22 VAL N N 23 121.565 121.565 119.578 1.987 18003
4510 1 8 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.616 0.350 18003
4511 1 8 . 1 1 22 22 VAL C C 23 178.026 178.026 177.630 0.396 18003
4512 1 8 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.123 0.019 18003
4513 1 8 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.534 -0.568 18003
4514 1 8 . 1 1 22 22 VAL H H 23 8.442 8.442 7.893 0.549 18003
4515 1 8 . 1 1 23 23 ALA N N 24 121.400 121.400 122.292 -0.892 18003
4516 1 8 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.840 0.256 18003
4517 1 8 . 1 1 23 23 ALA C C 24 178.758 178.758 179.596 -0.838 18003
4518 1 8 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.503 0.412 18003
4519 1 8 . 1 1 23 23 ALA CB C 24 16.650 16.650 17.869 -1.219 18003
4520 1 8 . 1 1 23 23 ALA H H 24 8.495 8.495 8.314 0.181 18003
4521 1 8 . 1 1 24 24 SER N N 25 112.138 112.138 113.368 -1.230 18003
4522 1 8 . 1 1 24 24 SER HA H 25 4.093 4.093 4.079 0.014 18003
4523 1 8 . 1 1 24 24 SER C C 25 177.271 177.271 176.712 0.559 18003
4524 1 8 . 1 1 24 24 SER CA C 25 62.166 62.166 61.279 0.887 18003
4525 1 8 . 1 1 24 24 SER CB C 25 63.032 63.032 63.060 -0.028 18003
4526 1 8 . 1 1 24 24 SER H H 25 7.936 7.936 8.196 -0.260 18003
4527 1 8 . 1 1 25 25 THR N N 26 119.701 119.701 119.466 0.235 18003
4528 1 8 . 1 1 25 25 THR HA H 26 4.380 4.380 4.012 0.368 18003
4529 1 8 . 1 1 25 25 THR C C 26 175.456 175.456 176.680 -1.224 18003
4530 1 8 . 1 1 25 25 THR CA C 26 67.129 67.129 66.783 0.346 18003
4531 1 8 . 1 1 25 25 THR CB C 26 68.800 68.800 68.704 0.096 18003
4532 1 8 . 1 1 25 25 THR H H 26 7.775 7.775 7.617 0.158 18003
4533 1 8 . 1 1 26 26 LEU N N 27 119.270 119.270 120.604 -1.334 18003
4534 1 8 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.064 -0.501 18003
4535 1 8 . 1 1 26 26 LEU C C 27 178.390 178.390 179.200 -0.810 18003
4536 1 8 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.263 0.406 18003
4537 1 8 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.324 0.706 18003
4538 1 8 . 1 1 26 26 LEU H H 27 8.006 8.006 8.672 -0.666 18003
4539 1 8 . 1 1 27 27 GLN N N 28 115.843 115.843 120.109 -4.266 18003
4540 1 8 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.056 -0.252 18003
4541 1 8 . 1 1 27 27 GLN C C 28 178.657 178.657 177.917 0.740 18003
4542 1 8 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.976 -0.264 18003
4543 1 8 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.854 -0.825 18003
4544 1 8 . 1 1 27 27 GLN H H 28 8.485 8.485 8.173 0.312 18003
4545 1 8 . 1 1 28 28 ALA N N 29 118.779 118.779 123.033 -4.254 18003
4546 1 8 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.013 -0.005 18003
4547 1 8 . 1 1 28 28 ALA C C 29 178.259 178.259 179.955 -1.696 18003
4548 1 8 . 1 1 28 28 ALA CA C 29 53.962 53.962 55.090 -1.127 18003
4549 1 8 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.416 0.323 18003
4550 1 8 . 1 1 28 28 ALA H H 29 7.432 7.432 8.116 -0.684 18003
4551 1 8 . 1 1 29 29 LEU N N 30 113.442 113.442 118.058 -4.616 18003
4552 1 8 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.976 0.020 18003
4553 1 8 . 1 1 29 29 LEU C C 30 175.924 175.924 180.096 -4.172 18003
4554 1 8 . 1 1 29 29 LEU CA C 30 55.564 55.564 57.794 -2.230 18003
4555 1 8 . 1 1 29 29 LEU CB C 30 42.266 42.266 40.271 1.995 18003
4556 1 8 . 1 1 29 29 LEU H H 30 7.311 7.311 7.884 -0.573 18003
4557 1 8 . 1 1 30 30 ALA N N 31 119.563 119.563 121.291 -1.728 18003
4558 1 8 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.009 0.163 18003
4559 1 8 . 1 1 30 30 ALA C C 31 176.316 176.316 177.289 -0.973 18003
4560 1 8 . 1 1 30 30 ALA CA C 31 51.656 51.656 54.854 -3.198 18003
4561 1 8 . 1 1 30 30 ALA CB C 31 18.077 18.077 18.219 -0.142 18003
4562 1 8 . 1 1 30 30 ALA H H 31 7.223 7.223 7.514 -0.291 18003
4563 1 8 . 1 1 31 31 THR N N 32 114.613 114.613 111.205 3.408 18003
4564 1 8 . 1 1 31 31 THR HA H 32 4.950 4.950 4.103 0.847 18003
4565 1 8 . 1 1 31 31 THR CA C 32 58.129 58.129 62.037 -3.908 18003
4566 1 8 . 1 1 31 31 THR CB C 32 69.098 69.098 67.934 1.164 18003
4567 1 8 . 1 1 31 31 THR H H 32 8.399 8.399 7.808 0.591 18003
4568 1 8 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.122 0.316 18003
4569 1 8 . 1 1 32 32 PRO C C 33 178.207 178.207 178.808 -0.601 18003
4570 1 8 . 1 1 32 32 PRO CA C 33 66.905 66.905 66.202 0.703 18003
4571 1 8 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.753 -0.489 18003
4572 1 8 . 1 1 33 33 SER N N 34 110.767 110.767 112.194 -1.427 18003
4573 1 8 . 1 1 33 33 SER HA H 34 4.026 4.026 4.158 -0.132 18003
4574 1 8 . 1 1 33 33 SER C C 34 176.742 176.742 176.496 0.246 18003
4575 1 8 . 1 1 33 33 SER CA C 34 61.782 61.782 61.521 0.261 18003
4576 1 8 . 1 1 33 33 SER CB C 34 62.432 62.432 62.719 -0.287 18003
4577 1 8 . 1 1 33 33 SER H H 34 8.407 8.407 8.421 -0.014 18003
4578 1 8 . 1 1 34 34 ARG N N 35 120.135 120.135 121.591 -1.456 18003
4579 1 8 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.092 -0.038 18003
4580 1 8 . 1 1 34 34 ARG C C 35 178.283 178.283 178.583 -0.300 18003
4581 1 8 . 1 1 34 34 ARG CA C 35 60.532 60.532 59.125 1.407 18003
4582 1 8 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.863 -0.911 18003
4583 1 8 . 1 1 34 34 ARG H H 35 7.341 7.341 7.381 -0.040 18003
4584 1 8 . 1 1 35 35 LEU N N 36 118.454 118.454 120.269 -1.815 18003
4585 1 8 . 1 1 35 35 LEU HA H 36 4.054 4.054 3.876 0.178 18003
4586 1 8 . 1 1 35 35 LEU C C 36 180.643 180.643 178.966 1.677 18003
4587 1 8 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.152 -0.343 18003
4588 1 8 . 1 1 35 35 LEU CB C 36 41.778 41.778 41.780 -0.002 18003
4589 1 8 . 1 1 35 35 LEU H H 36 8.226 8.226 8.122 0.104 18003
4590 1 8 . 1 1 36 36 MET N N 37 121.073 121.073 119.687 1.386 18003
4591 1 8 . 1 1 36 36 MET HA H 37 3.928 3.928 4.044 -0.116 18003
4592 1 8 . 1 1 36 36 MET C C 37 177.671 177.671 178.898 -1.227 18003
4593 1 8 . 1 1 36 36 MET CA C 37 60.613 60.613 59.108 1.505 18003
4594 1 8 . 1 1 36 36 MET CB C 37 33.128 33.128 32.775 0.353 18003
4595 1 8 . 1 1 36 36 MET H H 37 8.447 8.447 8.019 0.428 18003
4596 1 8 . 1 1 37 37 ILE N N 38 118.239 118.239 119.999 -1.760 18003
4597 1 8 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.620 -0.180 18003
4598 1 8 . 1 1 37 37 ILE C C 38 177.092 177.092 178.027 -0.935 18003
4599 1 8 . 1 1 37 37 ILE CA C 38 65.675 65.675 65.284 0.391 18003
4600 1 8 . 1 1 37 37 ILE CB C 38 38.255 38.255 37.696 0.559 18003
4601 1 8 . 1 1 37 37 ILE H H 38 7.763 7.763 7.969 -0.206 18003
4602 1 8 . 1 1 38 38 LEU N N 39 116.073 116.073 120.449 -4.376 18003
4603 1 8 . 1 1 38 38 LEU HA H 39 3.826 3.826 4.016 -0.190 18003
4604 1 8 . 1 1 38 38 LEU C C 39 178.941 178.941 179.573 -0.632 18003
4605 1 8 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.373 -0.342 18003
4606 1 8 . 1 1 38 38 LEU CB C 39 41.780 41.780 40.806 0.974 18003
4607 1 8 . 1 1 38 38 LEU H H 39 8.538 8.538 8.713 -0.175 18003
4608 1 8 . 1 1 39 39 THR N N 40 106.678 106.678 111.971 -5.293 18003
4609 1 8 . 1 1 39 39 THR HA H 40 3.932 3.932 3.870 0.062 18003
4610 1 8 . 1 1 39 39 THR C C 40 177.747 177.747 177.012 0.735 18003
4611 1 8 . 1 1 39 39 THR CA C 40 65.536 65.536 66.390 -0.854 18003
4612 1 8 . 1 1 39 39 THR CB C 40 68.360 68.360 68.431 -0.071 18003
4613 1 8 . 1 1 39 39 THR H H 40 8.086 8.086 8.600 -0.514 18003
4614 1 8 . 1 1 40 40 GLN N N 41 122.344 122.344 122.134 0.210 18003
4615 1 8 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.117 -0.111 18003
4616 1 8 . 1 1 40 40 GLN C C 41 178.348 178.348 178.837 -0.489 18003
4617 1 8 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.406 -0.481 18003
4618 1 8 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.277 -0.757 18003
4619 1 8 . 1 1 40 40 GLN H H 41 7.593 7.593 7.652 -0.059 18003
4620 1 8 . 1 1 41 41 LEU N N 42 116.302 116.302 120.585 -4.283 18003
4621 1 8 . 1 1 41 41 LEU C C 42 178.418 178.418 179.523 -1.105 18003
4622 1 8 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.232 -1.701 18003
4623 1 8 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.676 -0.327 18003
4624 1 8 . 1 1 41 41 LEU H H 42 7.570 7.570 8.002 -0.432 18003
4625 1 8 . 1 1 42 42 ARG N N 43 119.954 119.954 118.872 1.082 18003
4626 1 8 . 1 1 42 42 ARG HA H 43 3.915 3.915 3.845 0.070 18003
4627 1 8 . 1 1 42 42 ARG C C 43 177.205 177.205 178.186 -0.981 18003
4628 1 8 . 1 1 42 42 ARG CA C 43 58.704 58.704 59.449 -0.745 18003
4629 1 8 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.046 -0.603 18003
4630 1 8 . 1 1 42 42 ARG H H 43 7.612 7.612 8.169 -0.557 18003
4631 1 8 . 1 1 43 43 ASN N N 44 114.682 114.682 116.273 -1.591 18003
4632 1 8 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.600 0.160 18003
4633 1 8 . 1 1 43 43 ASN C C 44 174.507 174.507 175.589 -1.082 18003
4634 1 8 . 1 1 43 43 ASN CA C 44 53.953 53.953 54.593 -0.639 18003
4635 1 8 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.181 -0.151 18003
4636 1 8 . 1 1 43 43 ASN H H 44 7.567 7.567 7.837 -0.270 18003
4637 1 8 . 1 1 44 44 GLY N N 45 109.113 109.113 105.957 3.156 18003
4638 1 8 . 1 1 44 44 GLY CA C 45 44.268 44.268 44.692 -0.424 18003
4639 1 8 . 1 1 44 44 GLY H H 45 7.361 7.361 7.689 -0.328 18003
4640 1 8 . 1 1 45 45 PRO C C 46 178.412 178.412 176.282 2.130 18003
4641 1 8 . 1 1 45 45 PRO CA C 46 62.580 62.580 62.996 -0.416 18003
4642 1 8 . 1 1 45 45 PRO CB C 46 33.129 33.129 32.136 0.993 18003
4643 1 8 . 1 1 46 46 LEU N N 47 120.363 120.363 119.616 0.747 18003
4644 1 8 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.891 0.140 18003
4645 1 8 . 1 1 46 46 LEU CA C 47 52.550 52.550 51.880 0.670 18003
4646 1 8 . 1 1 46 46 LEU CB C 47 48.210 48.210 41.510 6.700 18003
4647 1 8 . 1 1 46 46 LEU H H 47 8.252 8.252 7.995 0.257 18003
4648 1 8 . 1 1 47 47 PRO C C 48 177.313 177.313 178.546 -1.233 18003
4649 1 8 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.204 -0.369 18003
4650 1 8 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.348 0.035 18003
4651 1 8 . 1 1 48 48 VAL N N 49 119.384 119.384 118.106 1.278 18003
4652 1 8 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.675 -0.068 18003
4653 1 8 . 1 1 48 48 VAL C C 49 176.710 176.710 177.387 -0.677 18003
4654 1 8 . 1 1 48 48 VAL CA C 49 66.188 66.188 66.004 0.184 18003
4655 1 8 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.671 -0.090 18003
4656 1 8 . 1 1 48 48 VAL H H 49 9.074 9.074 8.782 0.292 18003
4657 1 8 . 1 1 49 49 THR N N 50 111.293 111.293 116.200 -4.907 18003
4658 1 8 . 1 1 49 49 THR HA H 50 4.181 4.181 3.941 0.240 18003
4659 1 8 . 1 1 49 49 THR C C 50 176.717 176.717 176.275 0.442 18003
4660 1 8 . 1 1 49 49 THR CA C 50 65.063 65.063 67.883 -2.820 18003
4661 1 8 . 1 1 49 49 THR CB C 50 68.032 68.032 67.971 0.061 18003
4662 1 8 . 1 1 49 49 THR H H 50 7.848 7.848 8.061 -0.213 18003
4663 1 8 . 1 1 50 50 ASP N N 51 120.138 120.138 122.395 -2.257 18003
4664 1 8 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.383 -0.178 18003
4665 1 8 . 1 1 50 50 ASP C C 51 174.723 174.723 178.719 -3.996 18003
4666 1 8 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.523 -0.742 18003
4667 1 8 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.168 0.943 18003
4668 1 8 . 1 1 50 50 ASP H H 51 7.108 7.108 8.498 -1.390 18003
4669 1 8 . 1 1 51 51 LEU N N 52 121.089 121.089 120.184 0.905 18003
4670 1 8 . 1 1 51 51 LEU HA H 52 3.985 3.985 3.978 0.007 18003
4671 1 8 . 1 1 51 51 LEU C C 52 177.089 177.089 178.482 -1.393 18003
4672 1 8 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.588 0.573 18003
4673 1 8 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.765 0.015 18003
4674 1 8 . 1 1 51 51 LEU H H 52 7.943 7.943 7.814 0.129 18003
4675 1 8 . 1 1 52 52 ALA N N 53 119.237 119.237 121.246 -2.009 18003
4676 1 8 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.915 -0.043 18003
4677 1 8 . 1 1 52 52 ALA C C 53 179.466 179.466 179.393 0.073 18003
4678 1 8 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.026 0.637 18003
4679 1 8 . 1 1 52 52 ALA CB C 53 17.619 17.619 17.953 -0.334 18003
4680 1 8 . 1 1 52 52 ALA H H 53 8.480 8.480 8.106 0.374 18003
4681 1 8 . 1 1 53 53 GLU N N 54 115.655 115.655 119.270 -3.615 18003
4682 1 8 . 1 1 53 53 GLU HA H 54 4.054 4.054 4.010 0.044 18003
4683 1 8 . 1 1 53 53 GLU C C 54 179.073 179.073 178.242 0.831 18003
4684 1 8 . 1 1 53 53 GLU CA C 54 58.827 58.827 59.004 -0.177 18003
4685 1 8 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.519 -0.119 18003
4686 1 8 . 1 1 53 53 GLU H H 54 7.705 7.705 8.146 -0.441 18003
4687 1 8 . 1 1 54 54 ALA N N 55 120.276 120.276 121.071 -0.795 18003
4688 1 8 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.187 -0.050 18003
4689 1 8 . 1 1 54 54 ALA C C 55 179.771 179.771 178.664 1.107 18003
4690 1 8 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.306 0.355 18003
4691 1 8 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.114 -0.879 18003
4692 1 8 . 1 1 54 54 ALA H H 55 7.928 7.928 7.626 0.302 18003
4693 1 8 . 1 1 55 55 ILE N N 56 107.195 107.195 117.081 -9.886 18003
4694 1 8 . 1 1 55 55 ILE C C 56 176.053 176.053 177.122 -1.069 18003
4695 1 8 . 1 1 55 55 ILE CA C 56 60.551 60.551 62.917 -2.366 18003
4696 1 8 . 1 1 55 55 ILE CB C 56 38.497 38.497 39.150 -0.653 18003
4697 1 8 . 1 1 55 55 ILE H H 56 7.507 7.507 7.469 0.038 18003
4698 1 8 . 1 1 56 56 GLY N N 57 111.108 111.108 107.059 4.049 18003
4699 1 8 . 1 1 56 56 GLY C C 57 174.421 174.421 173.904 0.517 18003
4700 1 8 . 1 1 56 56 GLY CA C 57 46.960 46.960 45.028 1.932 18003
4701 1 8 . 1 1 56 56 GLY H H 57 7.757 7.757 8.261 -0.504 18003
4702 1 8 . 1 1 57 57 MET N N 58 118.089 118.089 117.081 1.008 18003
4703 1 8 . 1 1 57 57 MET HA H 58 3.933 3.933 4.069 -0.136 18003
4704 1 8 . 1 1 57 57 MET C C 58 174.157 174.157 175.106 -0.949 18003
4705 1 8 . 1 1 57 57 MET CA C 58 54.091 54.091 56.368 -2.277 18003
4706 1 8 . 1 1 57 57 MET CB C 58 38.062 38.062 30.788 7.274 18003
4707 1 8 . 1 1 57 57 MET H H 58 7.659 7.659 7.825 -0.166 18003
4708 1 8 . 1 1 58 58 GLU N N 59 121.656 121.656 118.740 2.916 18003
4709 1 8 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.424 -0.084 18003
4710 1 8 . 1 1 58 58 GLU C C 59 178.355 178.355 176.799 1.556 18003
4711 1 8 . 1 1 58 58 GLU CA C 59 56.643 56.643 56.217 0.426 18003
4712 1 8 . 1 1 58 58 GLU CB C 59 30.029 30.029 30.142 -0.113 18003
4713 1 8 . 1 1 58 58 GLU H H 59 8.523 8.523 8.449 0.074 18003
4714 1 8 . 1 1 59 59 GLN N N 60 123.686 123.686 120.385 3.301 18003
4715 1 8 . 1 1 59 59 GLN HA H 60 4.214 4.214 3.952 0.262 18003
4716 1 8 . 1 1 59 59 GLN C C 60 177.961 177.961 177.697 0.264 18003
4717 1 8 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.774 1.842 18003
4718 1 8 . 1 1 59 59 GLN CB C 60 29.015 29.015 27.968 1.047 18003
4719 1 8 . 1 1 59 59 GLN H H 60 9.009 9.009 8.509 0.500 18003
4720 1 8 . 1 1 60 60 SER N N 61 115.101 115.101 115.791 -0.690 18003
4721 1 8 . 1 1 60 60 SER C C 61 176.801 176.801 175.945 0.856 18003
4722 1 8 . 1 1 60 60 SER CA C 61 61.213 61.213 60.736 0.477 18003
4723 1 8 . 1 1 60 60 SER H H 61 8.964 8.964 8.346 0.618 18003
4724 1 8 . 1 1 61 61 ALA N N 62 126.069 126.069 123.493 2.576 18003
4725 1 8 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.219 0.132 18003
4726 1 8 . 1 1 61 61 ALA C C 62 180.635 180.635 179.744 0.891 18003
4727 1 8 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.797 -0.539 18003
4728 1 8 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.029 0.594 18003
4729 1 8 . 1 1 61 61 ALA H H 62 7.103 7.103 7.578 -0.475 18003
4730 1 8 . 1 1 62 62 VAL N N 63 119.252 119.252 119.053 0.199 18003
4731 1 8 . 1 1 62 62 VAL C C 63 177.842 177.842 177.817 0.025 18003
4732 1 8 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.391 0.407 18003
4733 1 8 . 1 1 62 62 VAL CB C 63 31.264 31.264 30.882 0.382 18003
4734 1 8 . 1 1 62 62 VAL H H 63 7.971 7.971 7.481 0.489 18003
4735 1 8 . 1 1 63 63 SER N N 64 115.494 115.494 115.923 -0.429 18003
4736 1 8 . 1 1 63 63 SER HA H 64 4.034 4.034 4.020 0.014 18003
4737 1 8 . 1 1 63 63 SER C C 64 176.835 176.835 176.789 0.046 18003
4738 1 8 . 1 1 63 63 SER CA C 64 62.400 62.400 62.180 0.220 18003
4739 1 8 . 1 1 63 63 SER CB C 64 62.752 62.752 62.932 -0.180 18003
4740 1 8 . 1 1 63 63 SER H H 64 8.743 8.743 8.104 0.639 18003
4741 1 8 . 1 1 64 64 HIS N N 65 120.010 120.010 121.479 -1.469 18003
4742 1 8 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.297 0.063 18003
4743 1 8 . 1 1 64 64 HIS C C 65 177.731 177.731 177.619 0.112 18003
4744 1 8 . 1 1 64 64 HIS CA C 65 59.998 59.998 59.526 0.472 18003
4745 1 8 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.785 0.149 18003
4746 1 8 . 1 1 64 64 HIS H H 65 7.804 7.804 8.126 -0.322 18003
4747 1 8 . 1 1 65 65 GLN N N 66 115.590 115.590 118.458 -2.868 18003
4748 1 8 . 1 1 65 65 GLN HA H 66 4.035 4.035 3.778 0.257 18003
4749 1 8 . 1 1 65 65 GLN C C 66 179.055 179.055 178.481 0.574 18003
4750 1 8 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.758 -1.228 18003
4751 1 8 . 1 1 65 65 GLN H H 66 7.751 7.751 7.892 -0.141 18003
4752 1 8 . 1 1 66 66 LEU N N 67 118.746 118.746 121.364 -2.618 18003
4753 1 8 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.960 -0.013 18003
4754 1 8 . 1 1 66 66 LEU C C 67 178.334 178.334 178.483 -0.149 18003
4755 1 8 . 1 1 66 66 LEU CA C 67 57.846 57.846 58.393 -0.547 18003
4756 1 8 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.902 -0.799 18003
4757 1 8 . 1 1 66 66 LEU H H 67 8.648 8.648 8.485 0.163 18003
4758 1 8 . 1 1 67 67 ARG N N 68 119.610 119.610 118.835 0.775 18003
4759 1 8 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.951 -0.008 18003
4760 1 8 . 1 1 67 67 ARG C C 68 178.807 178.807 178.778 0.029 18003
4761 1 8 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.675 -0.298 18003
4762 1 8 . 1 1 67 67 ARG CB C 68 29.475 29.475 30.030 -0.555 18003
4763 1 8 . 1 1 67 67 ARG H H 68 7.607 7.607 7.956 -0.349 18003
4764 1 8 . 1 1 68 68 VAL N N 69 119.719 119.719 120.113 -0.394 18003
4765 1 8 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.639 -0.006 18003
4766 1 8 . 1 1 68 68 VAL C C 69 178.690 178.690 178.043 0.647 18003
4767 1 8 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.368 0.086 18003
4768 1 8 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.205 0.574 18003
4769 1 8 . 1 1 68 68 VAL H H 69 7.259 7.259 7.639 -0.380 18003
4770 1 8 . 1 1 69 69 LEU N N 70 117.532 117.532 119.626 -2.094 18003
4771 1 8 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.881 0.067 18003
4772 1 8 . 1 1 69 69 LEU C C 70 179.144 179.144 178.773 0.371 18003
4773 1 8 . 1 1 69 69 LEU CA C 70 57.750 57.750 58.197 -0.446 18003
4774 1 8 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.486 0.374 18003
4775 1 8 . 1 1 69 69 LEU H H 70 8.375 8.375 8.304 0.071 18003
4776 1 8 . 1 1 70 70 ARG N N 71 122.498 122.498 119.516 2.982 18003
4777 1 8 . 1 1 70 70 ARG HA H 71 3.931 3.931 3.905 0.026 18003
4778 1 8 . 1 1 70 70 ARG C C 71 180.499 180.499 178.724 1.775 18003
4779 1 8 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.524 -0.747 18003
4780 1 8 . 1 1 70 70 ARG CB C 71 30.155 30.155 30.048 0.107 18003
4781 1 8 . 1 1 70 70 ARG H H 71 8.822 8.822 8.601 0.221 18003
4782 1 8 . 1 1 71 71 ASN N N 72 121.816 121.816 117.231 4.585 18003
4783 1 8 . 1 1 71 71 ASN C C 72 177.170 177.170 177.923 -0.753 18003
4784 1 8 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.511 0.266 18003
4785 1 8 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.128 -0.394 18003
4786 1 8 . 1 1 71 71 ASN H H 72 8.144 8.144 7.848 0.296 18003
4787 1 8 . 1 1 72 72 LEU N N 73 117.044 117.044 118.198 -1.154 18003
4788 1 8 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.169 0.176 18003
4789 1 8 . 1 1 72 72 LEU C C 73 176.984 176.984 178.038 -1.054 18003
4790 1 8 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.172 -1.047 18003
4791 1 8 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.403 0.866 18003
4792 1 8 . 1 1 72 72 LEU H H 73 7.804 7.804 7.526 0.278 18003
4793 1 8 . 1 1 73 73 GLY N N 74 106.621 106.621 106.723 -0.102 18003
4794 1 8 . 1 1 73 73 GLY C C 74 173.266 173.266 173.338 -0.072 18003
4795 1 8 . 1 1 73 73 GLY CA C 74 46.022 46.022 44.946 1.076 18003
4796 1 8 . 1 1 73 73 GLY H H 74 7.851 7.851 8.270 -0.419 18003
4797 1 8 . 1 1 74 74 LEU N N 75 114.582 114.582 121.753 -7.171 18003
4798 1 8 . 1 1 74 74 LEU C C 75 177.562 177.562 174.998 2.564 18003
4799 1 8 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.651 0.380 18003
4800 1 8 . 1 1 74 74 LEU CB C 75 44.444 44.444 44.008 0.436 18003
4801 1 8 . 1 1 74 74 LEU H H 75 7.808 7.808 8.024 -0.216 18003
4802 1 8 . 1 1 75 75 VAL N N 76 110.980 110.980 112.724 -1.744 18003
4803 1 8 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.682 -0.155 18003
4804 1 8 . 1 1 75 75 VAL C C 76 173.922 173.922 174.061 -0.139 18003
4805 1 8 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.111 -2.168 18003
4806 1 8 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.155 0.874 18003
4807 1 8 . 1 1 75 75 VAL H H 76 7.079 7.079 7.298 -0.219 18003
4808 1 8 . 1 1 76 76 VAL N N 77 118.619 118.619 120.087 -1.468 18003
4809 1 8 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.653 0.649 18003
4810 1 8 . 1 1 76 76 VAL C C 77 174.041 174.041 174.880 -0.839 18003
4811 1 8 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.275 -0.276 18003
4812 1 8 . 1 1 76 76 VAL H H 77 9.024 9.024 8.953 0.071 18003
4813 1 8 . 1 1 77 77 GLY N N 78 109.451 109.451 108.509 0.942 18003
4814 1 8 . 1 1 77 77 GLY C C 78 172.225 172.225 172.376 -0.151 18003
4815 1 8 . 1 1 77 77 GLY CA C 78 44.462 44.462 45.448 -0.986 18003
4816 1 8 . 1 1 77 77 GLY H H 78 8.265 8.265 8.238 0.027 18003
4817 1 8 . 1 1 78 78 ASP N N 79 122.826 122.826 121.413 1.413 18003
4818 1 8 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.902 -0.156 18003
4819 1 8 . 1 1 78 78 ASP C C 79 174.817 174.817 175.603 -0.786 18003
4820 1 8 . 1 1 78 78 ASP CA C 79 53.111 53.111 52.110 1.001 18003
4821 1 8 . 1 1 78 78 ASP CB C 79 43.655 43.655 43.512 0.143 18003
4822 1 8 . 1 1 78 78 ASP H H 79 8.479 8.479 8.312 0.167 18003
4823 1 8 . 1 1 79 79 ARG N N 80 122.613 122.613 123.624 -1.011 18003
4824 1 8 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.163 0.249 18003
4825 1 8 . 1 1 79 79 ARG C C 80 175.546 175.546 175.715 -0.169 18003
4826 1 8 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.725 -0.407 18003
4827 1 8 . 1 1 79 79 ARG CB C 80 30.376 30.376 31.316 -0.940 18003
4828 1 8 . 1 1 79 79 ARG H H 80 8.580 8.580 8.645 -0.065 18003
4829 1 8 . 1 1 80 80 ALA N N 81 129.263 129.263 124.295 4.968 18003
4830 1 8 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.487 -0.035 18003
4831 1 8 . 1 1 80 80 ALA C C 81 177.126 177.126 176.831 0.295 18003
4832 1 8 . 1 1 80 80 ALA CA C 81 51.620 51.620 52.120 -0.500 18003
4833 1 8 . 1 1 80 80 ALA CB C 81 19.260 19.260 20.156 -0.896 18003
4834 1 8 . 1 1 80 80 ALA H H 81 8.396 8.396 8.526 -0.130 18003
4835 1 8 . 1 1 81 81 GLY N N 82 112.739 112.739 114.335 -1.596 18003
4836 1 8 . 1 1 81 81 GLY C C 82 174.856 174.856 174.638 0.218 18003
4837 1 8 . 1 1 81 81 GLY CA C 82 46.392 46.392 46.005 0.387 18003
4838 1 8 . 1 1 81 81 GLY H H 82 8.641 8.641 8.445 0.196 18003
4839 1 8 . 1 1 82 82 ARG N N 83 124.780 124.780 122.194 2.586 18003
4840 1 8 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.604 -0.281 18003
4841 1 8 . 1 1 82 82 ARG C C 83 176.339 176.339 175.642 0.697 18003
4842 1 8 . 1 1 82 82 ARG CA C 83 56.690 56.690 55.791 0.898 18003
4843 1 8 . 1 1 82 82 ARG CB C 83 30.221 30.221 30.497 -0.276 18003
4844 1 8 . 1 1 82 82 ARG H H 83 8.728 8.728 8.556 0.172 18003
4845 1 8 . 1 1 83 83 SER N N 84 114.678 114.678 115.073 -0.395 18003
4846 1 8 . 1 1 83 83 SER C C 84 172.869 172.869 172.333 0.536 18003
4847 1 8 . 1 1 83 83 SER CA C 84 56.834 56.834 56.941 -0.107 18003
4848 1 8 . 1 1 83 83 SER CB C 84 65.191 65.191 67.023 -1.832 18003
4849 1 8 . 1 1 83 83 SER H H 84 7.821 7.821 7.733 0.088 18003
4850 1 8 . 1 1 84 84 ILE N N 85 122.996 122.996 117.345 5.651 18003
4851 1 8 . 1 1 84 84 ILE C C 85 175.521 175.521 173.806 1.715 18003
4852 1 8 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.513 0.723 18003
4853 1 8 . 1 1 84 84 ILE CB C 85 38.136 38.136 41.744 -3.608 18003
4854 1 8 . 1 1 84 84 ILE H H 85 8.232 8.232 8.298 -0.066 18003
4855 1 8 . 1 1 85 85 VAL N N 86 121.845 121.845 120.319 1.526 18003
4856 1 8 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.190 0.120 18003
4857 1 8 . 1 1 85 85 VAL C C 86 174.818 174.818 174.436 0.382 18003
4858 1 8 . 1 1 85 85 VAL CA C 86 59.738 59.738 60.508 -0.770 18003
4859 1 8 . 1 1 85 85 VAL CB C 86 34.221 34.221 34.770 -0.549 18003
4860 1 8 . 1 1 85 85 VAL H H 86 8.495 8.495 8.415 0.080 18003
4861 1 8 . 1 1 86 86 TYR N N 87 125.020 125.020 126.288 -1.268 18003
4862 1 8 . 1 1 86 86 TYR HA H 87 4.319 4.319 5.196 -0.877 18003
4863 1 8 . 1 1 86 86 TYR C C 87 173.808 173.808 175.548 -1.740 18003
4864 1 8 . 1 1 86 86 TYR CA C 87 57.465 57.465 56.538 0.927 18003
4865 1 8 . 1 1 86 86 TYR CB C 87 41.480 41.480 40.506 0.974 18003
4866 1 8 . 1 1 86 86 TYR H H 87 8.488 8.488 8.807 -0.319 18003
4867 1 8 . 1 1 87 87 SER N N 88 110.681 110.681 114.975 -4.294 18003
4868 1 8 . 1 1 87 87 SER HA H 88 5.414 5.414 4.846 0.568 18003
4869 1 8 . 1 1 87 87 SER C C 88 174.693 174.693 173.021 1.672 18003
4870 1 8 . 1 1 87 87 SER CA C 88 56.113 56.113 56.959 -0.847 18003
4871 1 8 . 1 1 87 87 SER CB C 88 66.309 66.309 67.119 -0.810 18003
4872 1 8 . 1 1 87 87 SER H H 88 8.718 8.718 9.020 -0.302 18003
4873 1 8 . 1 1 88 88 LEU N N 89 119.612 119.612 122.272 -2.660 18003
4874 1 8 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.405 0.522 18003
4875 1 8 . 1 1 88 88 LEU C C 89 179.031 179.031 177.120 1.911 18003
4876 1 8 . 1 1 88 88 LEU CA C 89 55.325 55.325 54.729 0.596 18003
4877 1 8 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.554 -0.834 18003
4878 1 8 . 1 1 88 88 LEU H H 89 9.034 9.034 8.476 0.558 18003
4879 1 8 . 1 1 89 89 TYR N N 90 120.540 120.540 124.999 -4.459 18003
4880 1 8 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.163 0.459 18003
4881 1 8 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.417 1.295 18003
4882 1 8 . 1 1 89 89 TYR H H 90 8.075 8.075 8.783 -0.708 18003
4883 1 8 . 1 1 92 92 HIS C C 93 177.850 177.850 177.730 0.120 18003
4884 1 8 . 1 1 93 93 VAL N N 94 120.211 120.211 118.327 1.884 18003
4885 1 8 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.681 -0.180 18003
4886 1 8 . 1 1 93 93 VAL C C 94 176.785 176.785 177.504 -0.719 18003
4887 1 8 . 1 1 93 93 VAL CA C 94 66.666 66.666 66.593 0.073 18003
4888 1 8 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.175 0.462 18003
4889 1 8 . 1 1 93 93 VAL H H 94 8.164 8.164 7.995 0.169 18003
4890 1 8 . 1 1 94 94 ALA N N 95 119.221 119.221 120.806 -1.585 18003
4891 1 8 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.939 -0.149 18003
4892 1 8 . 1 1 94 94 ALA C C 95 177.979 177.979 180.040 -2.061 18003
4893 1 8 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.163 0.316 18003
4894 1 8 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.195 -0.085 18003
4895 1 8 . 1 1 94 94 ALA H H 95 6.942 6.942 8.055 -1.113 18003
4896 1 8 . 1 1 95 95 GLN N N 96 115.416 115.416 118.639 -3.223 18003
4897 1 8 . 1 1 95 95 GLN HA H 96 4.035 4.035 3.981 0.054 18003
4898 1 8 . 1 1 95 95 GLN C C 96 177.993 177.993 178.507 -0.514 18003
4899 1 8 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.713 0.129 18003
4900 1 8 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.682 -0.653 18003
4901 1 8 . 1 1 95 95 GLN H H 96 7.795 7.795 8.179 -0.384 18003
4902 1 8 . 1 1 96 96 LEU N N 97 120.758 120.758 121.914 -1.156 18003
4903 1 8 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.078 -0.229 18003
4904 1 8 . 1 1 96 96 LEU C C 97 177.974 177.974 178.713 -0.739 18003
4905 1 8 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.094 1.188 18003
4906 1 8 . 1 1 96 96 LEU CB C 97 41.046 41.046 42.000 -0.954 18003
4907 1 8 . 1 1 96 96 LEU H H 97 8.197 8.197 7.955 0.242 18003
4908 1 8 . 1 1 97 97 LEU N N 98 117.567 117.567 118.904 -1.337 18003
4909 1 8 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.872 -0.042 18003
4910 1 8 . 1 1 97 97 LEU C C 98 178.219 178.219 178.887 -0.668 18003
4911 1 8 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.251 -0.521 18003
4912 1 8 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.117 0.745 18003
4913 1 8 . 1 1 97 97 LEU H H 98 7.660 7.660 8.235 -0.575 18003
4914 1 8 . 1 1 98 98 ASP N N 99 118.607 118.607 119.864 -1.257 18003
4915 1 8 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.343 -0.234 18003
4916 1 8 . 1 1 98 98 ASP C C 99 179.382 179.382 178.779 0.603 18003
4917 1 8 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.749 0.286 18003
4918 1 8 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.558 -0.719 18003
4919 1 8 . 1 1 98 98 ASP H H 99 8.295 8.295 8.196 0.099 18003
4920 1 8 . 1 1 99 99 GLU N N 100 117.542 117.542 119.865 -2.323 18003
4921 1 8 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.109 -0.260 18003
4922 1 8 . 1 1 99 99 GLU C C 100 179.389 179.389 178.914 0.475 18003
4923 1 8 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.345 -1.322 18003
4924 1 8 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.755 -0.726 18003
4925 1 8 . 1 1 99 99 GLU H H 100 8.334 8.334 7.947 0.387 18003
4926 1 8 . 1 1 100 100 ALA N N 101 122.890 122.890 123.420 -0.530 18003
4927 1 8 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.152 -0.154 18003
4928 1 8 . 1 1 100 100 ALA C C 101 180.184 180.184 180.079 0.105 18003
4929 1 8 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.465 0.055 18003
4930 1 8 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.285 -0.666 18003
4931 1 8 . 1 1 100 100 ALA H H 101 8.550 8.550 8.201 0.349 18003
4932 1 8 . 1 1 101 101 ILE N N 102 119.952 119.952 118.683 1.269 18003
4933 1 8 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.757 -0.168 18003
4934 1 8 . 1 1 101 101 ILE C C 102 178.114 178.114 177.756 0.358 18003
4935 1 8 . 1 1 101 101 ILE CA C 102 65.376 65.376 64.876 0.500 18003
4936 1 8 . 1 1 101 101 ILE CB C 102 38.029 38.029 36.996 1.033 18003
4937 1 8 . 1 1 101 101 ILE H H 102 8.493 8.493 8.586 -0.093 18003
4938 1 8 . 1 1 102 102 TYR N N 103 120.625 120.625 121.779 -1.154 18003
4939 1 8 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.053 0.118 18003
4940 1 8 . 1 1 102 102 TYR C C 103 179.772 179.772 177.448 2.324 18003
4941 1 8 . 1 1 102 102 TYR CA C 103 60.724 60.724 62.269 -1.545 18003
4942 1 8 . 1 1 102 102 TYR CB C 103 37.500 37.500 38.293 -0.793 18003
4943 1 8 . 1 1 102 102 TYR H H 103 8.520 8.520 8.381 0.139 18003
4944 1 8 . 1 1 103 103 HIS N N 104 117.456 117.456 118.875 -1.419 18003
4945 1 8 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.203 0.222 18003
4946 1 8 . 1 1 103 103 HIS C C 104 176.377 176.377 177.725 -1.348 18003
4947 1 8 . 1 1 103 103 HIS CA C 104 60.043 60.043 58.961 1.082 18003
4948 1 8 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.655 -0.626 18003
4949 1 8 . 1 1 103 103 HIS H H 104 8.622 8.622 9.105 -0.483 18003
4950 1 8 . 1 1 104 104 SER N N 105 113.596 113.596 114.831 -1.235 18003
4951 1 8 . 1 1 104 104 SER C C 105 176.712 176.712 176.110 0.602 18003
4952 1 8 . 1 1 104 104 SER CA C 105 61.852 61.852 61.079 0.773 18003
4953 1 8 . 1 1 104 104 SER CB C 105 63.550 63.550 63.078 0.472 18003
4954 1 8 . 1 1 104 104 SER H H 105 7.900 7.900 8.276 -0.376 18003
4955 1 8 . 1 1 105 105 GLU N N 106 119.022 119.022 121.165 -2.143 18003
4956 1 8 . 1 1 105 105 GLU HA H 106 4.013 4.013 3.974 0.039 18003
4957 1 8 . 1 1 105 105 GLU C C 106 177.902 177.902 177.897 0.005 18003
4958 1 8 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.458 -0.427 18003
4959 1 8 . 1 1 105 105 GLU CB C 106 29.279 29.279 30.017 -0.738 18003
4960 1 8 . 1 1 105 105 GLU H H 106 8.181 8.181 7.756 0.425 18003
4961 1 8 . 1 1 106 106 HIS N N 107 116.482 116.482 116.858 -0.376 18003
4962 1 8 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.168 0.239 18003
4963 1 8 . 1 1 106 106 HIS C C 107 175.575 175.575 176.039 -0.464 18003
4964 1 8 . 1 1 106 106 HIS CA C 107 57.343 57.343 58.030 -0.687 18003
4965 1 8 . 1 1 106 106 HIS CB C 107 28.580 28.580 29.802 -1.222 18003
4966 1 8 . 1 1 106 106 HIS H H 107 7.770 7.770 7.887 -0.117 18003
4967 1 8 . 1 1 107 107 LEU N N 108 120.346 120.346 120.258 0.088 18003
4968 1 8 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.320 -0.266 18003
4969 1 8 . 1 1 107 107 LEU C C 108 177.404 177.404 174.734 2.670 18003
4970 1 8 . 1 1 107 107 LEU CA C 108 55.991 55.991 54.039 1.952 18003
4971 1 8 . 1 1 107 107 LEU CB C 108 42.030 42.030 40.171 1.859 18003
4972 1 8 . 1 1 107 107 LEU H H 108 7.682 7.682 7.520 0.162 18003
4973 1 8 . 1 1 108 108 HIS N N 109 117.222 117.222 123.190 -5.968 18003
4974 1 8 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.542 -0.488 18003
4975 1 8 . 1 1 108 108 HIS C C 109 174.606 174.606 175.726 -1.120 18003
4976 1 8 . 1 1 108 108 HIS CA C 109 56.029 56.029 56.230 -0.201 18003
4977 1 8 . 1 1 108 108 HIS CB C 109 28.517 28.517 30.870 -2.353 18003
4978 1 8 . 1 1 108 108 HIS H H 109 8.030 8.030 8.333 -0.303 18003
4979 1 8 . 1 1 109 109 LEU N N 110 121.114 121.114 120.906 0.208 18003
4980 1 8 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.091 0.207 18003
4981 1 8 . 1 1 109 109 LEU C C 110 178.028 178.028 177.518 0.510 18003
4982 1 8 . 1 1 109 109 LEU CA C 110 55.574 55.574 55.693 -0.119 18003
4983 1 8 . 1 1 109 109 LEU CB C 110 42.076 42.076 41.860 0.216 18003
4984 1 8 . 1 1 109 109 LEU H H 110 7.973 7.973 8.259 -0.286 18003
4985 1 8 . 1 1 110 110 GLY N N 111 108.631 108.631 106.185 2.446 18003
4986 1 8 . 1 1 110 110 GLY C C 111 174.606 174.606 173.209 1.397 18003
4987 1 8 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.623 0.957 18003
4988 1 8 . 1 1 110 110 GLY H H 111 8.255 8.255 7.793 0.462 18003
4989 1 8 . 1 1 111 111 LEU N N 112 121.022 121.022 118.608 2.414 18003
4990 1 8 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.730 -0.371 18003
4991 1 8 . 1 1 111 111 LEU C C 112 177.701 177.701 176.737 0.964 18003
4992 1 8 . 1 1 111 111 LEU CA C 112 55.476 55.476 53.661 1.815 18003
4993 1 8 . 1 1 111 111 LEU CB C 112 41.899 41.899 40.981 0.918 18003
4994 1 8 . 1 1 111 111 LEU H H 112 7.981 7.981 8.221 -0.240 18003
4995 1 8 . 1 1 112 112 SER N N 113 115.471 115.471 117.885 -2.414 18003
4996 1 8 . 1 1 112 112 SER HA H 113 4.432 4.432 4.015 0.417 18003
4997 1 8 . 1 1 112 112 SER C C 113 174.381 174.381 174.366 0.015 18003
4998 1 8 . 1 1 112 112 SER CA C 113 58.527 58.527 59.300 -0.772 18003
4999 1 8 . 1 1 112 112 SER CB C 113 63.593 63.593 63.029 0.564 18003
5000 1 8 . 1 1 112 112 SER H H 113 8.215 8.215 8.398 -0.183 18003
5001 1 8 . 1 1 113 113 ASP N N 114 121.696 121.696 120.920 0.776 18003
5002 1 8 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.406 0.021 18003
5003 1 8 . 1 1 113 113 ASP C C 114 175.958 175.958 174.941 1.017 18003
5004 1 8 . 1 1 113 113 ASP CA C 114 54.213 54.213 55.176 -0.963 18003
5005 1 8 . 1 1 113 113 ASP CB C 114 41.030 41.030 41.291 -0.261 18003
5006 1 8 . 1 1 113 113 ASP H H 114 8.203 8.203 8.450 -0.247 18003
5007 1 8 . 1 1 114 114 ARG N N 115 120.088 120.088 120.453 -0.365 18003
5008 1 8 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.660 -0.388 18003
5009 1 8 . 1 1 114 114 ARG C C 115 175.792 175.792 174.869 0.923 18003
5010 1 8 . 1 1 114 114 ARG CA C 115 55.735 55.735 55.386 0.348 18003
5011 1 8 . 1 1 114 114 ARG CB C 115 30.586 30.586 32.053 -1.467 18003
5012 1 8 . 1 1 114 114 ARG H H 115 8.016 8.016 8.320 -0.304 18003
5013 1 8 . 1 1 115 115 HIS N N 116 120.597 120.597 117.642 2.955 18003
5014 1 8 . 1 1 115 115 HIS CA C 116 53.697 53.697 54.619 -0.922 18003
5015 1 8 . 1 1 115 115 HIS CB C 116 29.299 29.299 29.322 -0.023 18003
5016 1 8 . 1 1 115 115 HIS H H 116 8.385 8.385 8.412 -0.027 18003
5017 1 8 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.106 0.376 18003
5018 1 8 . 1 1 116 116 PRO C C 117 177.090 177.090 176.785 0.305 18003
5019 1 8 . 1 1 116 116 PRO CA C 117 63.177 63.177 63.646 -0.469 18003
5020 1 8 . 1 1 116 116 PRO CB C 117 31.820 31.820 31.977 -0.157 18003
5021 1 8 . 1 1 117 117 SER N N 118 116.220 116.220 112.675 3.545 18003
5022 1 8 . 1 1 117 117 SER HA H 118 4.465 4.465 4.639 -0.174 18003
5023 1 8 . 1 1 117 117 SER C C 118 174.287 174.287 174.639 -0.352 18003
5024 1 8 . 1 1 117 117 SER CA C 118 58.110 58.110 57.008 1.102 18003
5025 1 8 . 1 1 117 117 SER CB C 118 63.750 63.750 64.987 -1.237 18003
5026 1 8 . 1 1 117 117 SER H H 118 8.487 8.487 7.738 0.749 18003
5027 1 8 . 1 1 118 118 ALA N N 119 126.082 126.082 124.270 1.812 18003
5028 1 8 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.249 0.190 18003
5029 1 8 . 1 1 118 118 ALA C C 119 176.879 176.879 178.256 -1.377 18003
5030 1 8 . 1 1 118 118 ALA CA C 119 52.449 52.449 53.673 -1.224 18003
5031 1 8 . 1 1 118 118 ALA CB C 119 19.483 19.483 19.154 0.329 18003
5032 1 8 . 1 1 118 118 ALA H H 119 8.295 8.295 8.511 -0.216 18003
5033 1 9 . 1 1 2 2 HIS C C 3 175.176 175.176 175.461 -0.285 18003
5034 1 9 . 1 1 2 2 HIS CA C 3 55.900 55.900 55.931 -0.030 18003
5035 1 9 . 1 1 2 2 HIS CB C 3 30.029 30.029 29.046 0.984 18003
5036 1 9 . 1 1 3 3 GLY N N 4 110.613 110.613 109.792 0.821 18003
5037 1 9 . 1 1 3 3 GLY C C 4 174.068 174.068 173.773 0.295 18003
5038 1 9 . 1 1 3 3 GLY CA C 4 45.141 45.141 45.745 -0.605 18003
5039 1 9 . 1 1 3 3 GLY H H 4 8.500 8.500 8.538 -0.038 18003
5040 1 9 . 1 1 4 4 VAL N N 5 119.318 119.318 114.066 5.252 18003
5041 1 9 . 1 1 4 4 VAL HA H 5 4.128 4.128 4.463 -0.335 18003
5042 1 9 . 1 1 4 4 VAL C C 5 176.361 176.361 173.708 2.653 18003
5043 1 9 . 1 1 4 4 VAL CA C 5 61.987 61.987 60.075 1.913 18003
5044 1 9 . 1 1 4 4 VAL CB C 5 32.635 32.635 34.033 -1.398 18003
5045 1 9 . 1 1 4 4 VAL H H 5 8.094 8.094 7.620 0.474 18003
5046 1 9 . 1 1 5 5 GLU N N 6 124.369 124.369 121.950 2.419 18003
5047 1 9 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.547 -0.259 18003
5048 1 9 . 1 1 5 5 GLU C C 6 177.012 177.012 176.633 0.379 18003
5049 1 9 . 1 1 5 5 GLU CA C 6 56.699 56.699 56.189 0.510 18003
5050 1 9 . 1 1 5 5 GLU CB C 6 30.029 30.029 31.809 -1.780 18003
5051 1 9 . 1 1 5 5 GLU H H 6 8.545 8.545 8.576 -0.031 18003
5052 1 9 . 1 1 6 6 GLY N N 7 109.747 109.747 110.217 -0.470 18003
5053 1 9 . 1 1 6 6 GLY C C 7 174.117 174.117 174.149 -0.032 18003
5054 1 9 . 1 1 6 6 GLY CA C 7 45.568 45.568 45.344 0.224 18003
5055 1 9 . 1 1 6 6 GLY H H 7 8.352 8.352 8.662 -0.310 18003
5056 1 9 . 1 1 7 7 ARG N N 8 120.059 120.059 120.095 -0.036 18003
5057 1 9 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.530 -0.188 18003
5058 1 9 . 1 1 7 7 ARG C C 8 176.016 176.016 173.827 2.189 18003
5059 1 9 . 1 1 7 7 ARG CA C 8 55.833 55.833 55.782 0.051 18003
5060 1 9 . 1 1 7 7 ARG CB C 8 30.444 30.444 31.531 -1.087 18003
5061 1 9 . 1 1 7 7 ARG H H 8 8.084 8.084 7.832 0.252 18003
5062 1 9 . 1 1 8 8 ASN N N 9 119.379 119.379 121.538 -2.159 18003
5063 1 9 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.778 -0.446 18003
5064 1 9 . 1 1 8 8 ASN C C 9 174.667 174.667 174.504 0.163 18003
5065 1 9 . 1 1 8 8 ASN CA C 9 53.441 53.441 53.699 -0.258 18003
5066 1 9 . 1 1 8 8 ASN CB C 9 38.480 38.480 40.225 -1.746 18003
5067 1 9 . 1 1 8 8 ASN H H 9 8.411 8.411 8.614 -0.203 18003
5068 1 9 . 1 1 9 9 ARG N N 10 121.700 121.700 123.392 -1.692 18003
5069 1 9 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.082 0.567 18003
5070 1 9 . 1 1 9 9 ARG CA C 10 53.147 53.147 55.858 -2.711 18003
5071 1 9 . 1 1 9 9 ARG CB C 10 30.197 30.197 29.412 0.785 18003
5072 1 9 . 1 1 9 9 ARG H H 10 8.138 8.138 8.777 -0.639 18003
5073 1 9 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.440 0.003 18003
5074 1 9 . 1 1 10 10 PRO C C 11 176.815 176.815 176.766 0.049 18003
5075 1 9 . 1 1 10 10 PRO CA C 11 63.177 63.177 62.806 0.371 18003
5076 1 9 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.045 -0.225 18003
5077 1 9 . 1 1 11 11 SER N N 12 116.291 116.291 116.073 0.218 18003
5078 1 9 . 1 1 11 11 SER HA H 12 4.418 4.418 4.063 0.355 18003
5079 1 9 . 1 1 11 11 SER C C 12 173.702 173.702 173.278 0.424 18003
5080 1 9 . 1 1 11 11 SER CA C 12 58.031 58.031 59.402 -1.371 18003
5081 1 9 . 1 1 11 11 SER CB C 12 64.032 64.032 63.017 1.015 18003
5082 1 9 . 1 1 11 11 SER H H 12 8.325 8.325 8.718 -0.393 18003
5083 1 9 . 1 1 12 12 ALA N N 13 126.862 126.862 125.982 0.880 18003
5084 1 9 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.493 -0.105 18003
5085 1 9 . 1 1 12 12 ALA CA C 13 50.458 50.458 52.683 -2.225 18003
5086 1 9 . 1 1 12 12 ALA CB C 13 18.257 18.257 18.345 -0.088 18003
5087 1 9 . 1 1 12 12 ALA H H 13 8.166 8.166 8.466 -0.300 18003
5088 1 9 . 1 1 13 13 PRO C C 14 176.368 176.368 176.879 -0.511 18003
5089 1 9 . 1 1 13 13 PRO CA C 14 62.937 62.937 64.431 -1.494 18003
5090 1 9 . 1 1 13 13 PRO CB C 14 32.022 32.022 31.818 0.204 18003
5091 1 9 . 1 1 14 14 LEU N N 15 120.969 120.969 120.473 0.496 18003
5092 1 9 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.616 -0.358 18003
5093 1 9 . 1 1 14 14 LEU C C 15 176.124 176.124 176.708 -0.584 18003
5094 1 9 . 1 1 14 14 LEU CA C 15 54.527 54.527 53.662 0.865 18003
5095 1 9 . 1 1 14 14 LEU CB C 15 43.418 43.418 41.730 1.688 18003
5096 1 9 . 1 1 14 14 LEU H H 15 7.875 7.875 7.561 0.314 18003
5097 1 9 . 1 1 15 15 ASP N N 16 121.780 121.780 123.247 -1.467 18003
5098 1 9 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.159 0.434 18003
5099 1 9 . 1 1 15 15 ASP C C 16 176.208 176.208 178.072 -1.864 18003
5100 1 9 . 1 1 15 15 ASP CA C 16 52.468 52.468 57.564 -5.096 18003
5101 1 9 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.594 1.035 18003
5102 1 9 . 1 1 15 15 ASP H H 16 7.850 7.850 8.825 -0.975 18003
5103 1 9 . 1 1 16 16 SER N N 17 114.435 114.435 114.085 0.350 18003
5104 1 9 . 1 1 16 16 SER HA H 17 4.120 4.120 4.017 0.103 18003
5105 1 9 . 1 1 16 16 SER C C 17 177.207 177.207 176.691 0.516 18003
5106 1 9 . 1 1 16 16 SER CA C 17 62.322 62.322 61.286 1.036 18003
5107 1 9 . 1 1 16 16 SER H H 17 8.658 8.658 8.051 0.607 18003
5108 1 9 . 1 1 17 17 GLN N N 18 122.403 122.403 120.034 2.369 18003
5109 1 9 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.045 0.152 18003
5110 1 9 . 1 1 17 17 GLN C C 18 178.715 178.715 177.985 0.730 18003
5111 1 9 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.391 -0.278 18003
5112 1 9 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.058 -0.018 18003
5113 1 9 . 1 1 17 17 GLN H H 18 8.140 8.140 8.452 -0.312 18003
5114 1 9 . 1 1 18 18 ALA N N 19 124.743 124.743 122.429 2.314 18003
5115 1 9 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.249 -0.073 18003
5116 1 9 . 1 1 18 18 ALA C C 19 180.616 180.616 179.391 1.225 18003
5117 1 9 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.669 -0.064 18003
5118 1 9 . 1 1 18 18 ALA CB C 19 19.028 19.028 18.136 0.892 18003
5119 1 9 . 1 1 18 18 ALA H H 19 8.455 8.455 7.744 0.711 18003
5120 1 9 . 1 1 19 19 ALA N N 20 119.089 119.089 121.009 -1.920 18003
5121 1 9 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.069 0.110 18003
5122 1 9 . 1 1 19 19 ALA C C 20 179.239 179.239 179.350 -0.111 18003
5123 1 9 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.823 0.448 18003
5124 1 9 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.322 -0.130 18003
5125 1 9 . 1 1 19 19 ALA H H 20 8.993 8.993 8.197 0.796 18003
5126 1 9 . 1 1 20 20 ALA N N 21 119.226 119.226 121.262 -2.036 18003
5127 1 9 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.932 0.128 18003
5128 1 9 . 1 1 20 20 ALA C C 21 180.230 180.230 179.965 0.265 18003
5129 1 9 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.107 0.036 18003
5130 1 9 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.096 -0.068 18003
5131 1 9 . 1 1 20 20 ALA H H 21 7.724 7.724 7.824 -0.100 18003
5132 1 9 . 1 1 21 21 GLN N N 22 119.310 119.310 118.508 0.802 18003
5133 1 9 . 1 1 21 21 GLN HA H 22 4.129 4.129 3.957 0.172 18003
5134 1 9 . 1 1 21 21 GLN C C 22 179.319 179.319 178.723 0.596 18003
5135 1 9 . 1 1 21 21 GLN CA C 22 58.762 58.762 59.058 -0.296 18003
5136 1 9 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.820 -0.791 18003
5137 1 9 . 1 1 21 21 GLN H H 22 7.638 7.638 8.269 -0.631 18003
5138 1 9 . 1 1 22 22 VAL N N 23 121.565 121.565 120.588 0.977 18003
5139 1 9 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.670 0.296 18003
5140 1 9 . 1 1 22 22 VAL C C 23 178.026 178.026 177.994 0.032 18003
5141 1 9 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.059 0.083 18003
5142 1 9 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.640 -0.673 18003
5143 1 9 . 1 1 22 22 VAL H H 23 8.442 8.442 7.998 0.444 18003
5144 1 9 . 1 1 23 23 ALA N N 24 121.400 121.400 121.930 -0.530 18003
5145 1 9 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.904 0.192 18003
5146 1 9 . 1 1 23 23 ALA C C 24 178.758 178.758 179.689 -0.931 18003
5147 1 9 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.516 0.399 18003
5148 1 9 . 1 1 23 23 ALA CB C 24 16.650 16.650 18.053 -1.403 18003
5149 1 9 . 1 1 23 23 ALA H H 24 8.495 8.495 8.449 0.046 18003
5150 1 9 . 1 1 24 24 SER N N 25 112.138 112.138 114.074 -1.936 18003
5151 1 9 . 1 1 24 24 SER HA H 25 4.093 4.093 4.117 -0.024 18003
5152 1 9 . 1 1 24 24 SER C C 25 177.271 177.271 176.766 0.505 18003
5153 1 9 . 1 1 24 24 SER CA C 25 62.166 62.166 62.230 -0.063 18003
5154 1 9 . 1 1 24 24 SER CB C 25 63.032 63.032 63.154 -0.122 18003
5155 1 9 . 1 1 24 24 SER H H 25 7.936 7.936 8.202 -0.266 18003
5156 1 9 . 1 1 25 25 THR N N 26 119.701 119.701 117.382 2.319 18003
5157 1 9 . 1 1 25 25 THR HA H 26 4.380 4.380 4.043 0.337 18003
5158 1 9 . 1 1 25 25 THR C C 26 175.456 175.456 176.370 -0.914 18003
5159 1 9 . 1 1 25 25 THR CA C 26 67.129 67.129 65.852 1.277 18003
5160 1 9 . 1 1 25 25 THR CB C 26 68.800 68.800 68.691 0.109 18003
5161 1 9 . 1 1 25 25 THR H H 26 7.775 7.775 7.768 0.007 18003
5162 1 9 . 1 1 26 26 LEU N N 27 119.270 119.270 121.753 -2.483 18003
5163 1 9 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.103 -0.540 18003
5164 1 9 . 1 1 26 26 LEU C C 27 178.390 178.390 179.428 -1.038 18003
5165 1 9 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.511 0.158 18003
5166 1 9 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.011 1.019 18003
5167 1 9 . 1 1 26 26 LEU H H 27 8.006 8.006 8.411 -0.405 18003
5168 1 9 . 1 1 27 27 GLN N N 28 115.843 115.843 119.814 -3.971 18003
5169 1 9 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.080 -0.276 18003
5170 1 9 . 1 1 27 27 GLN C C 28 178.657 178.657 177.738 0.919 18003
5171 1 9 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.639 0.073 18003
5172 1 9 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.849 -0.820 18003
5173 1 9 . 1 1 27 27 GLN H H 28 8.485 8.485 8.053 0.432 18003
5174 1 9 . 1 1 28 28 ALA N N 29 118.779 118.779 122.405 -3.626 18003
5175 1 9 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.063 -0.055 18003
5176 1 9 . 1 1 28 28 ALA C C 29 178.259 178.259 178.953 -0.694 18003
5177 1 9 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.627 -0.665 18003
5178 1 9 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.779 -0.041 18003
5179 1 9 . 1 1 28 28 ALA H H 29 7.432 7.432 7.875 -0.443 18003
5180 1 9 . 1 1 29 29 LEU N N 30 113.442 113.442 117.956 -4.514 18003
5181 1 9 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.923 0.073 18003
5182 1 9 . 1 1 29 29 LEU C C 30 175.924 175.924 177.523 -1.599 18003
5183 1 9 . 1 1 29 29 LEU CA C 30 55.564 55.564 57.362 -1.798 18003
5184 1 9 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.544 0.723 18003
5185 1 9 . 1 1 29 29 LEU H H 30 7.311 7.311 7.807 -0.496 18003
5186 1 9 . 1 1 30 30 ALA N N 31 119.563 119.563 118.438 1.125 18003
5187 1 9 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.112 0.060 18003
5188 1 9 . 1 1 30 30 ALA C C 31 176.316 176.316 176.669 -0.353 18003
5189 1 9 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.427 -1.771 18003
5190 1 9 . 1 1 30 30 ALA CB C 31 18.077 18.077 19.157 -1.080 18003
5191 1 9 . 1 1 30 30 ALA H H 31 7.223 7.223 7.050 0.173 18003
5192 1 9 . 1 1 31 31 THR N N 32 114.613 114.613 111.016 3.597 18003
5193 1 9 . 1 1 31 31 THR HA H 32 4.950 4.950 4.109 0.841 18003
5194 1 9 . 1 1 31 31 THR CA C 32 58.129 58.129 61.976 -3.847 18003
5195 1 9 . 1 1 31 31 THR CB C 32 69.098 69.098 68.310 0.788 18003
5196 1 9 . 1 1 31 31 THR H H 32 8.399 8.399 8.303 0.096 18003
5197 1 9 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.147 0.291 18003
5198 1 9 . 1 1 32 32 PRO C C 33 178.207 178.207 178.468 -0.261 18003
5199 1 9 . 1 1 32 32 PRO CA C 33 66.905 66.905 66.173 0.732 18003
5200 1 9 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.461 -0.197 18003
5201 1 9 . 1 1 33 33 SER N N 34 110.767 110.767 113.917 -3.150 18003
5202 1 9 . 1 1 33 33 SER HA H 34 4.026 4.026 4.168 -0.142 18003
5203 1 9 . 1 1 33 33 SER C C 34 176.742 176.742 176.623 0.119 18003
5204 1 9 . 1 1 33 33 SER CA C 34 61.782 61.782 61.827 -0.045 18003
5205 1 9 . 1 1 33 33 SER CB C 34 62.432 62.432 62.610 -0.178 18003
5206 1 9 . 1 1 33 33 SER H H 34 8.407 8.407 8.399 0.008 18003
5207 1 9 . 1 1 34 34 ARG N N 35 120.135 120.135 120.753 -0.618 18003
5208 1 9 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.141 -0.087 18003
5209 1 9 . 1 1 34 34 ARG C C 35 178.283 178.283 178.359 -0.076 18003
5210 1 9 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.331 2.201 18003
5211 1 9 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.378 -0.425 18003
5212 1 9 . 1 1 34 34 ARG H H 35 7.341 7.341 8.101 -0.760 18003
5213 1 9 . 1 1 35 35 LEU N N 36 118.454 118.454 123.802 -5.348 18003
5214 1 9 . 1 1 35 35 LEU HA H 36 4.054 4.054 4.156 -0.102 18003
5215 1 9 . 1 1 35 35 LEU C C 36 180.643 180.643 179.167 1.476 18003
5216 1 9 . 1 1 35 35 LEU CA C 36 57.809 57.809 57.872 -0.063 18003
5217 1 9 . 1 1 35 35 LEU CB C 36 41.778 41.778 41.272 0.506 18003
5218 1 9 . 1 1 35 35 LEU H H 36 8.226 8.226 8.683 -0.457 18003
5219 1 9 . 1 1 36 36 MET N N 37 121.073 121.073 118.760 2.313 18003
5220 1 9 . 1 1 36 36 MET HA H 37 3.928 3.928 4.132 -0.204 18003
5221 1 9 . 1 1 36 36 MET C C 37 177.671 177.671 178.846 -1.175 18003
5222 1 9 . 1 1 36 36 MET CA C 37 60.613 60.613 58.297 2.316 18003
5223 1 9 . 1 1 36 36 MET CB C 37 33.128 33.128 32.047 1.081 18003
5224 1 9 . 1 1 36 36 MET H H 37 8.447 8.447 8.224 0.223 18003
5225 1 9 . 1 1 37 37 ILE N N 38 118.239 118.239 119.926 -1.687 18003
5226 1 9 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.596 -0.156 18003
5227 1 9 . 1 1 37 37 ILE C C 38 177.092 177.092 178.224 -1.132 18003
5228 1 9 . 1 1 37 37 ILE CA C 38 65.675 65.675 65.503 0.172 18003
5229 1 9 . 1 1 37 37 ILE CB C 38 38.255 38.255 37.673 0.582 18003
5230 1 9 . 1 1 37 37 ILE H H 38 7.763 7.763 7.993 -0.230 18003
5231 1 9 . 1 1 38 38 LEU N N 39 116.073 116.073 120.243 -4.170 18003
5232 1 9 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.914 -0.088 18003
5233 1 9 . 1 1 38 38 LEU C C 39 178.941 178.941 179.054 -0.113 18003
5234 1 9 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.346 -0.315 18003
5235 1 9 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.575 0.205 18003
5236 1 9 . 1 1 38 38 LEU H H 39 8.538 8.538 8.571 -0.033 18003
5237 1 9 . 1 1 39 39 THR N N 40 106.678 106.678 115.830 -9.152 18003
5238 1 9 . 1 1 39 39 THR HA H 40 3.932 3.932 3.918 0.014 18003
5239 1 9 . 1 1 39 39 THR C C 40 177.747 177.747 176.855 0.892 18003
5240 1 9 . 1 1 39 39 THR CA C 40 65.536 65.536 67.131 -1.595 18003
5241 1 9 . 1 1 39 39 THR CB C 40 68.360 68.360 68.318 0.042 18003
5242 1 9 . 1 1 39 39 THR H H 40 8.086 8.086 8.216 -0.130 18003
5243 1 9 . 1 1 40 40 GLN N N 41 122.344 122.344 121.098 1.246 18003
5244 1 9 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.004 0.002 18003
5245 1 9 . 1 1 40 40 GLN C C 41 178.348 178.348 178.581 -0.233 18003
5246 1 9 . 1 1 40 40 GLN CA C 41 57.925 57.925 59.277 -1.352 18003
5247 1 9 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.576 -1.056 18003
5248 1 9 . 1 1 40 40 GLN H H 41 7.593 7.593 7.766 -0.173 18003
5249 1 9 . 1 1 41 41 LEU N N 42 116.302 116.302 119.164 -2.862 18003
5250 1 9 . 1 1 41 41 LEU C C 42 178.418 178.418 179.304 -0.886 18003
5251 1 9 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.575 -2.043 18003
5252 1 9 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.892 -0.543 18003
5253 1 9 . 1 1 41 41 LEU H H 42 7.570 7.570 7.729 -0.159 18003
5254 1 9 . 1 1 42 42 ARG N N 43 119.954 119.954 118.387 1.567 18003
5255 1 9 . 1 1 42 42 ARG HA H 43 3.915 3.915 4.059 -0.144 18003
5256 1 9 . 1 1 42 42 ARG C C 43 177.205 177.205 178.646 -1.441 18003
5257 1 9 . 1 1 42 42 ARG CA C 43 58.704 58.704 58.793 -0.089 18003
5258 1 9 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.233 -0.790 18003
5259 1 9 . 1 1 42 42 ARG H H 43 7.612 7.612 8.170 -0.558 18003
5260 1 9 . 1 1 43 43 ASN N N 44 114.682 114.682 116.903 -2.221 18003
5261 1 9 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.572 0.188 18003
5262 1 9 . 1 1 43 43 ASN C C 44 174.507 174.507 175.757 -1.250 18003
5263 1 9 . 1 1 43 43 ASN CA C 44 53.953 53.953 55.104 -1.151 18003
5264 1 9 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.448 -0.418 18003
5265 1 9 . 1 1 43 43 ASN H H 44 7.567 7.567 8.115 -0.548 18003
5266 1 9 . 1 1 44 44 GLY N N 45 109.113 109.113 107.114 1.999 18003
5267 1 9 . 1 1 44 44 GLY CA C 45 44.268 44.268 44.768 -0.500 18003
5268 1 9 . 1 1 44 44 GLY H H 45 7.361 7.361 7.592 -0.231 18003
5269 1 9 . 1 1 45 45 PRO C C 46 178.412 178.412 175.993 2.419 18003
5270 1 9 . 1 1 45 45 PRO CA C 46 62.580 62.580 62.822 -0.242 18003
5271 1 9 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.976 1.153 18003
5272 1 9 . 1 1 46 46 LEU N N 47 120.363 120.363 120.910 -0.547 18003
5273 1 9 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.692 0.339 18003
5274 1 9 . 1 1 46 46 LEU CA C 47 52.550 52.550 52.351 0.199 18003
5275 1 9 . 1 1 46 46 LEU CB C 47 48.210 48.210 42.124 6.086 18003
5276 1 9 . 1 1 46 46 LEU H H 47 8.252 8.252 8.056 0.196 18003
5277 1 9 . 1 1 47 47 PRO C C 48 177.313 177.313 178.746 -1.433 18003
5278 1 9 . 1 1 47 47 PRO CA C 48 61.835 61.835 61.965 -0.130 18003
5279 1 9 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.605 -0.222 18003
5280 1 9 . 1 1 48 48 VAL N N 49 119.384 119.384 118.774 0.610 18003
5281 1 9 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.703 -0.096 18003
5282 1 9 . 1 1 48 48 VAL C C 49 176.710 176.710 178.223 -1.513 18003
5283 1 9 . 1 1 48 48 VAL CA C 49 66.188 66.188 67.246 -1.058 18003
5284 1 9 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.337 0.244 18003
5285 1 9 . 1 1 48 48 VAL H H 49 9.074 9.074 8.977 0.097 18003
5286 1 9 . 1 1 49 49 THR N N 50 111.293 111.293 110.498 0.795 18003
5287 1 9 . 1 1 49 49 THR HA H 50 4.181 4.181 4.079 0.102 18003
5288 1 9 . 1 1 49 49 THR C C 50 176.717 176.717 176.786 -0.069 18003
5289 1 9 . 1 1 49 49 THR CA C 50 65.063 65.063 66.603 -1.540 18003
5290 1 9 . 1 1 49 49 THR CB C 50 68.032 68.032 67.806 0.226 18003
5291 1 9 . 1 1 49 49 THR H H 50 7.848 7.848 8.330 -0.482 18003
5292 1 9 . 1 1 50 50 ASP N N 51 120.138 120.138 123.514 -3.376 18003
5293 1 9 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.483 -0.278 18003
5294 1 9 . 1 1 50 50 ASP C C 51 174.723 174.723 178.442 -3.719 18003
5295 1 9 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.906 -1.125 18003
5296 1 9 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.484 0.627 18003
5297 1 9 . 1 1 50 50 ASP H H 51 7.108 7.108 7.636 -0.528 18003
5298 1 9 . 1 1 51 51 LEU N N 52 121.089 121.089 121.618 -0.529 18003
5299 1 9 . 1 1 51 51 LEU HA H 52 3.985 3.985 4.106 -0.121 18003
5300 1 9 . 1 1 51 51 LEU C C 52 177.089 177.089 178.425 -1.336 18003
5301 1 9 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.671 0.490 18003
5302 1 9 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.154 0.626 18003
5303 1 9 . 1 1 51 51 LEU H H 52 7.943 7.943 8.177 -0.234 18003
5304 1 9 . 1 1 52 52 ALA N N 53 119.237 119.237 121.394 -2.157 18003
5305 1 9 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.889 -0.017 18003
5306 1 9 . 1 1 52 52 ALA C C 53 179.466 179.466 179.683 -0.217 18003
5307 1 9 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.440 0.223 18003
5308 1 9 . 1 1 52 52 ALA CB C 53 17.619 17.619 18.061 -0.442 18003
5309 1 9 . 1 1 52 52 ALA H H 53 8.480 8.480 8.069 0.411 18003
5310 1 9 . 1 1 53 53 GLU N N 54 115.655 115.655 119.107 -3.452 18003
5311 1 9 . 1 1 53 53 GLU HA H 54 4.054 4.054 3.990 0.064 18003
5312 1 9 . 1 1 53 53 GLU C C 54 179.073 179.073 178.226 0.847 18003
5313 1 9 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.846 -0.019 18003
5314 1 9 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.369 0.031 18003
5315 1 9 . 1 1 53 53 GLU H H 54 7.705 7.705 7.863 -0.158 18003
5316 1 9 . 1 1 54 54 ALA N N 55 120.276 120.276 121.147 -0.871 18003
5317 1 9 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.099 0.038 18003
5318 1 9 . 1 1 54 54 ALA C C 55 179.771 179.771 179.356 0.415 18003
5319 1 9 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.466 0.195 18003
5320 1 9 . 1 1 54 54 ALA CB C 55 18.235 18.235 18.910 -0.675 18003
5321 1 9 . 1 1 54 54 ALA H H 55 7.928 7.928 7.802 0.126 18003
5322 1 9 . 1 1 55 55 ILE N N 56 107.195 107.195 117.172 -9.977 18003
5323 1 9 . 1 1 55 55 ILE C C 56 176.053 176.053 176.413 -0.360 18003
5324 1 9 . 1 1 55 55 ILE CA C 56 60.551 60.551 62.988 -2.437 18003
5325 1 9 . 1 1 55 55 ILE CB C 56 38.497 38.497 39.005 -0.508 18003
5326 1 9 . 1 1 55 55 ILE H H 56 7.507 7.507 8.103 -0.596 18003
5327 1 9 . 1 1 56 56 GLY N N 57 111.108 111.108 106.952 4.156 18003
5328 1 9 . 1 1 56 56 GLY C C 57 174.421 174.421 173.767 0.654 18003
5329 1 9 . 1 1 56 56 GLY CA C 57 46.960 46.960 44.717 2.243 18003
5330 1 9 . 1 1 56 56 GLY H H 57 7.757 7.757 7.958 -0.201 18003
5331 1 9 . 1 1 57 57 MET N N 58 118.089 118.089 118.901 -0.812 18003
5332 1 9 . 1 1 57 57 MET HA H 58 3.933 3.933 4.070 -0.137 18003
5333 1 9 . 1 1 57 57 MET C C 58 174.157 174.157 175.189 -1.032 18003
5334 1 9 . 1 1 57 57 MET CA C 58 54.091 54.091 56.100 -2.009 18003
5335 1 9 . 1 1 57 57 MET CB C 58 38.062 38.062 30.469 7.593 18003
5336 1 9 . 1 1 57 57 MET H H 58 7.659 7.659 8.077 -0.418 18003
5337 1 9 . 1 1 58 58 GLU N N 59 121.656 121.656 121.037 0.619 18003
5338 1 9 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.319 0.021 18003
5339 1 9 . 1 1 58 58 GLU C C 59 178.355 178.355 176.588 1.767 18003
5340 1 9 . 1 1 58 58 GLU CA C 59 56.643 56.643 56.909 -0.266 18003
5341 1 9 . 1 1 58 58 GLU CB C 59 30.029 30.029 29.765 0.264 18003
5342 1 9 . 1 1 58 58 GLU H H 59 8.523 8.523 8.366 0.157 18003
5343 1 9 . 1 1 59 59 GLN N N 60 123.686 123.686 120.251 3.435 18003
5344 1 9 . 1 1 59 59 GLN HA H 60 4.214 4.214 4.032 0.182 18003
5345 1 9 . 1 1 59 59 GLN C C 60 177.961 177.961 177.334 0.627 18003
5346 1 9 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.762 1.854 18003
5347 1 9 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.474 0.541 18003
5348 1 9 . 1 1 59 59 GLN H H 60 9.009 9.009 8.618 0.391 18003
5349 1 9 . 1 1 60 60 SER N N 61 115.101 115.101 115.397 -0.296 18003
5350 1 9 . 1 1 60 60 SER C C 61 176.801 176.801 176.279 0.522 18003
5351 1 9 . 1 1 60 60 SER CA C 61 61.213 61.213 61.533 -0.320 18003
5352 1 9 . 1 1 60 60 SER H H 61 8.964 8.964 8.378 0.586 18003
5353 1 9 . 1 1 61 61 ALA N N 62 126.069 126.069 123.498 2.571 18003
5354 1 9 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.157 0.194 18003
5355 1 9 . 1 1 61 61 ALA C C 62 180.635 180.635 179.677 0.958 18003
5356 1 9 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.751 -0.493 18003
5357 1 9 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.215 0.408 18003
5358 1 9 . 1 1 61 61 ALA H H 62 7.103 7.103 7.758 -0.655 18003
5359 1 9 . 1 1 62 62 VAL N N 63 119.252 119.252 119.226 0.026 18003
5360 1 9 . 1 1 62 62 VAL C C 63 177.842 177.842 177.963 -0.121 18003
5361 1 9 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.349 0.449 18003
5362 1 9 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.235 0.029 18003
5363 1 9 . 1 1 62 62 VAL H H 63 7.971 7.971 7.439 0.532 18003
5364 1 9 . 1 1 63 63 SER N N 64 115.494 115.494 116.038 -0.544 18003
5365 1 9 . 1 1 63 63 SER HA H 64 4.034 4.034 3.959 0.075 18003
5366 1 9 . 1 1 63 63 SER C C 64 176.835 176.835 176.810 0.025 18003
5367 1 9 . 1 1 63 63 SER CA C 64 62.400 62.400 62.235 0.165 18003
5368 1 9 . 1 1 63 63 SER CB C 64 62.752 62.752 62.444 0.308 18003
5369 1 9 . 1 1 63 63 SER H H 64 8.743 8.743 8.314 0.429 18003
5370 1 9 . 1 1 64 64 HIS N N 65 120.010 120.010 122.360 -2.350 18003
5371 1 9 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.260 0.100 18003
5372 1 9 . 1 1 64 64 HIS C C 65 177.731 177.731 177.378 0.353 18003
5373 1 9 . 1 1 64 64 HIS CA C 65 59.998 59.998 60.258 -0.260 18003
5374 1 9 . 1 1 64 64 HIS CB C 65 29.934 29.934 30.171 -0.237 18003
5375 1 9 . 1 1 64 64 HIS H H 65 7.804 7.804 8.332 -0.528 18003
5376 1 9 . 1 1 65 65 GLN N N 66 115.590 115.590 118.677 -3.087 18003
5377 1 9 . 1 1 65 65 GLN HA H 66 4.035 4.035 3.935 0.100 18003
5378 1 9 . 1 1 65 65 GLN C C 66 179.055 179.055 178.391 0.664 18003
5379 1 9 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.465 -0.935 18003
5380 1 9 . 1 1 65 65 GLN H H 66 7.751 7.751 8.028 -0.277 18003
5381 1 9 . 1 1 66 66 LEU N N 67 118.746 118.746 121.020 -2.274 18003
5382 1 9 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.897 0.050 18003
5383 1 9 . 1 1 66 66 LEU C C 67 178.334 178.334 178.533 -0.199 18003
5384 1 9 . 1 1 66 66 LEU CA C 67 57.846 57.846 58.063 -0.217 18003
5385 1 9 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.617 -0.514 18003
5386 1 9 . 1 1 66 66 LEU H H 67 8.648 8.648 8.650 -0.002 18003
5387 1 9 . 1 1 67 67 ARG N N 68 119.610 119.610 118.676 0.934 18003
5388 1 9 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.925 0.018 18003
5389 1 9 . 1 1 67 67 ARG C C 68 178.807 178.807 178.879 -0.072 18003
5390 1 9 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.048 0.329 18003
5391 1 9 . 1 1 67 67 ARG CB C 68 29.475 29.475 29.473 0.002 18003
5392 1 9 . 1 1 67 67 ARG H H 68 7.607 7.607 7.965 -0.358 18003
5393 1 9 . 1 1 68 68 VAL N N 69 119.719 119.719 120.324 -0.605 18003
5394 1 9 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.616 0.017 18003
5395 1 9 . 1 1 68 68 VAL C C 69 178.690 178.690 178.310 0.380 18003
5396 1 9 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.404 0.050 18003
5397 1 9 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.267 0.512 18003
5398 1 9 . 1 1 68 68 VAL H H 69 7.259 7.259 7.756 -0.497 18003
5399 1 9 . 1 1 69 69 LEU N N 70 117.532 117.532 119.419 -1.887 18003
5400 1 9 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.936 0.012 18003
5401 1 9 . 1 1 69 69 LEU C C 70 179.144 179.144 178.751 0.393 18003
5402 1 9 . 1 1 69 69 LEU CA C 70 57.750 57.750 58.192 -0.442 18003
5403 1 9 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.273 0.587 18003
5404 1 9 . 1 1 69 69 LEU H H 70 8.375 8.375 7.980 0.395 18003
5405 1 9 . 1 1 70 70 ARG N N 71 122.498 122.498 119.757 2.741 18003
5406 1 9 . 1 1 70 70 ARG HA H 71 3.931 3.931 3.851 0.080 18003
5407 1 9 . 1 1 70 70 ARG C C 71 180.499 180.499 178.599 1.900 18003
5408 1 9 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.664 -0.887 18003
5409 1 9 . 1 1 70 70 ARG CB C 71 30.155 30.155 29.980 0.176 18003
5410 1 9 . 1 1 70 70 ARG H H 71 8.822 8.822 8.556 0.266 18003
5411 1 9 . 1 1 71 71 ASN N N 72 121.816 121.816 117.320 4.496 18003
5412 1 9 . 1 1 71 71 ASN C C 72 177.170 177.170 177.963 -0.793 18003
5413 1 9 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.484 0.293 18003
5414 1 9 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.137 -0.403 18003
5415 1 9 . 1 1 71 71 ASN H H 72 8.144 8.144 7.741 0.403 18003
5416 1 9 . 1 1 72 72 LEU N N 73 117.044 117.044 118.076 -1.032 18003
5417 1 9 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.138 0.207 18003
5418 1 9 . 1 1 72 72 LEU C C 73 176.984 176.984 178.257 -1.273 18003
5419 1 9 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.195 -1.070 18003
5420 1 9 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.303 0.966 18003
5421 1 9 . 1 1 72 72 LEU H H 73 7.804 7.804 7.402 0.402 18003
5422 1 9 . 1 1 73 73 GLY N N 74 106.621 106.621 105.453 1.168 18003
5423 1 9 . 1 1 73 73 GLY C C 74 173.266 173.266 174.609 -1.343 18003
5424 1 9 . 1 1 73 73 GLY CA C 74 46.022 46.022 45.349 0.673 18003
5425 1 9 . 1 1 73 73 GLY H H 74 7.851 7.851 8.323 -0.472 18003
5426 1 9 . 1 1 74 74 LEU N N 75 114.582 114.582 118.545 -3.963 18003
5427 1 9 . 1 1 74 74 LEU C C 75 177.562 177.562 176.138 1.424 18003
5428 1 9 . 1 1 74 74 LEU CA C 75 56.031 56.031 54.540 1.491 18003
5429 1 9 . 1 1 74 74 LEU CB C 75 44.444 44.444 42.536 1.908 18003
5430 1 9 . 1 1 74 74 LEU H H 75 7.808 7.808 7.491 0.317 18003
5431 1 9 . 1 1 75 75 VAL N N 76 110.980 110.980 113.751 -2.771 18003
5432 1 9 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.981 -0.454 18003
5433 1 9 . 1 1 75 75 VAL C C 76 173.922 173.922 174.253 -0.331 18003
5434 1 9 . 1 1 75 75 VAL CA C 76 57.943 57.943 59.873 -1.930 18003
5435 1 9 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.618 0.411 18003
5436 1 9 . 1 1 75 75 VAL H H 76 7.079 7.079 7.295 -0.216 18003
5437 1 9 . 1 1 76 76 VAL N N 77 118.619 118.619 122.162 -3.543 18003
5438 1 9 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.578 0.724 18003
5439 1 9 . 1 1 76 76 VAL C C 77 174.041 174.041 175.040 -0.999 18003
5440 1 9 . 1 1 76 76 VAL CA C 77 59.999 59.999 61.120 -1.121 18003
5441 1 9 . 1 1 76 76 VAL H H 77 9.024 9.024 9.273 -0.249 18003
5442 1 9 . 1 1 77 77 GLY N N 78 109.451 109.451 112.559 -3.108 18003
5443 1 9 . 1 1 77 77 GLY C C 78 172.225 172.225 172.968 -0.743 18003
5444 1 9 . 1 1 77 77 GLY CA C 78 44.462 44.462 43.977 0.485 18003
5445 1 9 . 1 1 77 77 GLY H H 78 8.265 8.265 8.431 -0.166 18003
5446 1 9 . 1 1 78 78 ASP N N 79 122.826 122.826 125.256 -2.430 18003
5447 1 9 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.712 0.034 18003
5448 1 9 . 1 1 78 78 ASP C C 79 174.817 174.817 174.890 -0.073 18003
5449 1 9 . 1 1 78 78 ASP CA C 79 53.111 53.111 52.737 0.374 18003
5450 1 9 . 1 1 78 78 ASP CB C 79 43.655 43.655 42.468 1.187 18003
5451 1 9 . 1 1 78 78 ASP H H 79 8.479 8.479 8.279 0.200 18003
5452 1 9 . 1 1 79 79 ARG N N 80 122.613 122.613 126.174 -3.561 18003
5453 1 9 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.354 0.058 18003
5454 1 9 . 1 1 79 79 ARG C C 80 175.546 175.546 174.911 0.635 18003
5455 1 9 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.347 -0.029 18003
5456 1 9 . 1 1 79 79 ARG CB C 80 30.376 30.376 30.746 -0.370 18003
5457 1 9 . 1 1 79 79 ARG H H 80 8.580 8.580 8.587 -0.007 18003
5458 1 9 . 1 1 80 80 ALA N N 81 129.263 129.263 128.990 0.273 18003
5459 1 9 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.395 0.057 18003
5460 1 9 . 1 1 80 80 ALA C C 81 177.126 177.126 175.935 1.191 18003
5461 1 9 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.874 -0.254 18003
5462 1 9 . 1 1 80 80 ALA CB C 81 19.260 19.260 20.691 -1.431 18003
5463 1 9 . 1 1 80 80 ALA H H 81 8.396 8.396 8.559 -0.163 18003
5464 1 9 . 1 1 81 81 GLY N N 82 112.739 112.739 109.720 3.019 18003
5465 1 9 . 1 1 81 81 GLY C C 82 174.856 174.856 174.345 0.511 18003
5466 1 9 . 1 1 81 81 GLY CA C 82 46.392 46.392 45.416 0.976 18003
5467 1 9 . 1 1 81 81 GLY H H 82 8.641 8.641 8.403 0.238 18003
5468 1 9 . 1 1 82 82 ARG N N 83 124.780 124.780 116.044 8.736 18003
5469 1 9 . 1 1 82 82 ARG HA H 83 4.323 4.323 3.911 0.412 18003
5470 1 9 . 1 1 82 82 ARG C C 83 176.339 176.339 174.735 1.604 18003
5471 1 9 . 1 1 82 82 ARG CA C 83 56.690 56.690 57.163 -0.473 18003
5472 1 9 . 1 1 82 82 ARG CB C 83 30.221 30.221 28.222 1.999 18003
5473 1 9 . 1 1 82 82 ARG H H 83 8.728 8.728 8.517 0.211 18003
5474 1 9 . 1 1 83 83 SER N N 84 114.678 114.678 113.329 1.349 18003
5475 1 9 . 1 1 83 83 SER C C 84 172.869 172.869 172.916 -0.047 18003
5476 1 9 . 1 1 83 83 SER CA C 84 56.834 56.834 56.843 -0.009 18003
5477 1 9 . 1 1 83 83 SER CB C 84 65.191 65.191 65.899 -0.708 18003
5478 1 9 . 1 1 83 83 SER H H 84 7.821 7.821 7.938 -0.117 18003
5479 1 9 . 1 1 84 84 ILE N N 85 122.996 122.996 126.436 -3.440 18003
5480 1 9 . 1 1 84 84 ILE C C 85 175.521 175.521 173.588 1.933 18003
5481 1 9 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.209 1.026 18003
5482 1 9 . 1 1 84 84 ILE CB C 85 38.136 38.136 40.380 -2.244 18003
5483 1 9 . 1 1 84 84 ILE H H 85 8.232 8.232 8.556 -0.324 18003
5484 1 9 . 1 1 85 85 VAL N N 86 121.845 121.845 129.938 -8.093 18003
5485 1 9 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.185 0.125 18003
5486 1 9 . 1 1 85 85 VAL C C 86 174.818 174.818 174.390 0.428 18003
5487 1 9 . 1 1 85 85 VAL CA C 86 59.738 59.738 60.870 -1.132 18003
5488 1 9 . 1 1 85 85 VAL CB C 86 34.221 34.221 32.543 1.678 18003
5489 1 9 . 1 1 85 85 VAL H H 86 8.495 8.495 8.135 0.360 18003
5490 1 9 . 1 1 86 86 TYR N N 87 125.020 125.020 128.318 -3.298 18003
5491 1 9 . 1 1 86 86 TYR HA H 87 4.319 4.319 4.985 -0.666 18003
5492 1 9 . 1 1 86 86 TYR C C 87 173.808 173.808 175.773 -1.965 18003
5493 1 9 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.257 0.208 18003
5494 1 9 . 1 1 86 86 TYR CB C 87 41.480 41.480 39.061 2.419 18003
5495 1 9 . 1 1 86 86 TYR H H 87 8.488 8.488 8.651 -0.163 18003
5496 1 9 . 1 1 87 87 SER N N 88 110.681 110.681 115.434 -4.753 18003
5497 1 9 . 1 1 87 87 SER HA H 88 5.414 5.414 4.970 0.444 18003
5498 1 9 . 1 1 87 87 SER C C 88 174.693 174.693 173.183 1.510 18003
5499 1 9 . 1 1 87 87 SER CA C 88 56.113 56.113 56.327 -0.214 18003
5500 1 9 . 1 1 87 87 SER CB C 88 66.309 66.309 66.288 0.021 18003
5501 1 9 . 1 1 87 87 SER H H 88 8.718 8.718 8.963 -0.245 18003
5502 1 9 . 1 1 88 88 LEU N N 89 119.612 119.612 123.235 -3.623 18003
5503 1 9 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.305 0.622 18003
5504 1 9 . 1 1 88 88 LEU C C 89 179.031 179.031 177.358 1.673 18003
5505 1 9 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.463 -0.138 18003
5506 1 9 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.319 -0.599 18003
5507 1 9 . 1 1 88 88 LEU H H 89 9.034 9.034 8.473 0.561 18003
5508 1 9 . 1 1 89 89 TYR N N 90 120.540 120.540 125.505 -4.965 18003
5509 1 9 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.226 0.396 18003
5510 1 9 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.946 0.766 18003
5511 1 9 . 1 1 89 89 TYR H H 90 8.075 8.075 8.904 -0.829 18003
5512 1 9 . 1 1 92 92 HIS C C 93 177.850 177.850 177.308 0.542 18003
5513 1 9 . 1 1 93 93 VAL N N 94 120.211 120.211 117.394 2.817 18003
5514 1 9 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.802 -0.301 18003
5515 1 9 . 1 1 93 93 VAL C C 94 176.785 176.785 177.487 -0.702 18003
5516 1 9 . 1 1 93 93 VAL CA C 94 66.666 66.666 66.028 0.637 18003
5517 1 9 . 1 1 93 93 VAL CB C 94 31.637 31.637 30.502 1.135 18003
5518 1 9 . 1 1 93 93 VAL H H 94 8.164 8.164 8.172 -0.008 18003
5519 1 9 . 1 1 94 94 ALA N N 95 119.221 119.221 122.302 -3.081 18003
5520 1 9 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.933 -0.143 18003
5521 1 9 . 1 1 94 94 ALA C C 95 177.979 177.979 179.551 -1.572 18003
5522 1 9 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.205 0.274 18003
5523 1 9 . 1 1 94 94 ALA CB C 95 18.110 18.110 17.997 0.114 18003
5524 1 9 . 1 1 94 94 ALA H H 95 6.942 6.942 8.055 -1.113 18003
5525 1 9 . 1 1 95 95 GLN N N 96 115.416 115.416 119.711 -4.295 18003
5526 1 9 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.249 -0.214 18003
5527 1 9 . 1 1 95 95 GLN C C 96 177.993 177.993 178.404 -0.411 18003
5528 1 9 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.270 0.572 18003
5529 1 9 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.459 -0.430 18003
5530 1 9 . 1 1 95 95 GLN H H 96 7.795 7.795 7.765 0.030 18003
5531 1 9 . 1 1 96 96 LEU N N 97 120.758 120.758 121.249 -0.491 18003
5532 1 9 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.027 -0.178 18003
5533 1 9 . 1 1 96 96 LEU C C 97 177.974 177.974 178.593 -0.619 18003
5534 1 9 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.311 0.971 18003
5535 1 9 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.870 -0.824 18003
5536 1 9 . 1 1 96 96 LEU H H 97 8.197 8.197 8.412 -0.215 18003
5537 1 9 . 1 1 97 97 LEU N N 98 117.567 117.567 119.234 -1.667 18003
5538 1 9 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.858 -0.028 18003
5539 1 9 . 1 1 97 97 LEU C C 98 178.219 178.219 179.039 -0.820 18003
5540 1 9 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.414 -0.684 18003
5541 1 9 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.202 0.660 18003
5542 1 9 . 1 1 97 97 LEU H H 98 7.660 7.660 8.262 -0.602 18003
5543 1 9 . 1 1 98 98 ASP N N 99 118.607 118.607 119.772 -1.165 18003
5544 1 9 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.378 -0.269 18003
5545 1 9 . 1 1 98 98 ASP C C 99 179.382 179.382 179.245 0.137 18003
5546 1 9 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.861 0.174 18003
5547 1 9 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.238 -0.399 18003
5548 1 9 . 1 1 98 98 ASP H H 99 8.295 8.295 8.164 0.131 18003
5549 1 9 . 1 1 99 99 GLU N N 100 117.542 117.542 119.857 -2.315 18003
5550 1 9 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.186 -0.337 18003
5551 1 9 . 1 1 99 99 GLU C C 100 179.389 179.389 179.010 0.379 18003
5552 1 9 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.105 -1.082 18003
5553 1 9 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.443 -0.414 18003
5554 1 9 . 1 1 99 99 GLU H H 100 8.334 8.334 7.920 0.414 18003
5555 1 9 . 1 1 100 100 ALA N N 101 122.890 122.890 122.976 -0.086 18003
5556 1 9 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.108 -0.110 18003
5557 1 9 . 1 1 100 100 ALA C C 101 180.184 180.184 179.832 0.352 18003
5558 1 9 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.385 0.135 18003
5559 1 9 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.414 -0.795 18003
5560 1 9 . 1 1 100 100 ALA H H 101 8.550 8.550 8.279 0.271 18003
5561 1 9 . 1 1 101 101 ILE N N 102 119.952 119.952 118.924 1.028 18003
5562 1 9 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.737 -0.148 18003
5563 1 9 . 1 1 101 101 ILE C C 102 178.114 178.114 177.578 0.536 18003
5564 1 9 . 1 1 101 101 ILE CA C 102 65.376 65.376 65.032 0.344 18003
5565 1 9 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.044 0.985 18003
5566 1 9 . 1 1 101 101 ILE H H 102 8.493 8.493 8.652 -0.159 18003
5567 1 9 . 1 1 102 102 TYR N N 103 120.625 120.625 121.339 -0.714 18003
5568 1 9 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.058 0.113 18003
5569 1 9 . 1 1 102 102 TYR C C 103 179.772 179.772 177.476 2.296 18003
5570 1 9 . 1 1 102 102 TYR CA C 103 60.724 60.724 62.278 -1.554 18003
5571 1 9 . 1 1 102 102 TYR CB C 103 37.500 37.500 38.169 -0.669 18003
5572 1 9 . 1 1 102 102 TYR H H 103 8.520 8.520 8.341 0.178 18003
5573 1 9 . 1 1 103 103 HIS N N 104 117.456 117.456 118.995 -1.539 18003
5574 1 9 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.116 0.309 18003
5575 1 9 . 1 1 103 103 HIS C C 104 176.377 176.377 177.488 -1.111 18003
5576 1 9 . 1 1 103 103 HIS CA C 104 60.043 60.043 59.111 0.932 18003
5577 1 9 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.666 -0.637 18003
5578 1 9 . 1 1 103 103 HIS H H 104 8.622 8.622 8.416 0.206 18003
5579 1 9 . 1 1 104 104 SER N N 105 113.596 113.596 113.742 -0.146 18003
5580 1 9 . 1 1 104 104 SER C C 105 176.712 176.712 176.150 0.562 18003
5581 1 9 . 1 1 104 104 SER CA C 105 61.852 61.852 60.904 0.948 18003
5582 1 9 . 1 1 104 104 SER CB C 105 63.550 63.550 63.273 0.277 18003
5583 1 9 . 1 1 104 104 SER H H 105 7.900 7.900 7.866 0.034 18003
5584 1 9 . 1 1 105 105 GLU N N 106 119.022 119.022 120.171 -1.149 18003
5585 1 9 . 1 1 105 105 GLU HA H 106 4.013 4.013 3.938 0.075 18003
5586 1 9 . 1 1 105 105 GLU C C 106 177.902 177.902 178.499 -0.597 18003
5587 1 9 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.310 -0.279 18003
5588 1 9 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.893 -0.614 18003
5589 1 9 . 1 1 105 105 GLU H H 106 8.181 8.181 8.191 -0.010 18003
5590 1 9 . 1 1 106 106 HIS N N 107 116.482 116.482 118.285 -1.803 18003
5591 1 9 . 1 1 106 106 HIS HA H 107 4.407 4.407 3.779 0.628 18003
5592 1 9 . 1 1 106 106 HIS C C 107 175.575 175.575 176.409 -0.834 18003
5593 1 9 . 1 1 106 106 HIS CA C 107 57.343 57.343 58.831 -1.488 18003
5594 1 9 . 1 1 106 106 HIS CB C 107 28.580 28.580 29.761 -1.181 18003
5595 1 9 . 1 1 106 106 HIS H H 107 7.770 7.770 7.632 0.138 18003
5596 1 9 . 1 1 107 107 LEU N N 108 120.346 120.346 117.095 3.251 18003
5597 1 9 . 1 1 107 107 LEU HA H 108 4.054 4.054 3.675 0.379 18003
5598 1 9 . 1 1 107 107 LEU C C 108 177.404 177.404 178.222 -0.818 18003
5599 1 9 . 1 1 107 107 LEU CA C 108 55.991 55.991 58.072 -2.081 18003
5600 1 9 . 1 1 107 107 LEU CB C 108 42.030 42.030 40.991 1.039 18003
5601 1 9 . 1 1 107 107 LEU H H 108 7.682 7.682 7.606 0.076 18003
5602 1 9 . 1 1 108 108 HIS N N 109 117.222 117.222 112.523 4.699 18003
5603 1 9 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.016 0.038 18003
5604 1 9 . 1 1 108 108 HIS C C 109 174.606 174.606 176.339 -1.733 18003
5605 1 9 . 1 1 108 108 HIS CA C 109 56.029 56.029 58.325 -2.296 18003
5606 1 9 . 1 1 108 108 HIS CB C 109 28.517 28.517 28.044 0.473 18003
5607 1 9 . 1 1 108 108 HIS H H 109 8.030 8.030 7.718 0.312 18003
5608 1 9 . 1 1 109 109 LEU N N 110 121.114 121.114 120.424 0.690 18003
5609 1 9 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.173 0.125 18003
5610 1 9 . 1 1 109 109 LEU C C 110 178.028 178.028 177.327 0.701 18003
5611 1 9 . 1 1 109 109 LEU CA C 110 55.574 55.574 56.472 -0.898 18003
5612 1 9 . 1 1 109 109 LEU CB C 110 42.076 42.076 42.539 -0.463 18003
5613 1 9 . 1 1 109 109 LEU H H 110 7.973 7.973 8.137 -0.164 18003
5614 1 9 . 1 1 110 110 GLY N N 111 108.631 108.631 106.860 1.771 18003
5615 1 9 . 1 1 110 110 GLY C C 111 174.606 174.606 174.712 -0.106 18003
5616 1 9 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.857 0.723 18003
5617 1 9 . 1 1 110 110 GLY H H 111 8.255 8.255 8.059 0.196 18003
5618 1 9 . 1 1 111 111 LEU N N 112 121.022 121.022 122.016 -0.994 18003
5619 1 9 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.425 -0.066 18003
5620 1 9 . 1 1 111 111 LEU C C 112 177.701 177.701 177.854 -0.153 18003
5621 1 9 . 1 1 111 111 LEU CA C 112 55.476 55.476 54.074 1.403 18003
5622 1 9 . 1 1 111 111 LEU CB C 112 41.899 41.899 42.475 -0.576 18003
5623 1 9 . 1 1 111 111 LEU H H 112 7.981 7.981 8.056 -0.075 18003
5624 1 9 . 1 1 112 112 SER N N 113 115.471 115.471 118.033 -2.562 18003
5625 1 9 . 1 1 112 112 SER HA H 113 4.432 4.432 4.248 0.184 18003
5626 1 9 . 1 1 112 112 SER C C 113 174.381 174.381 173.885 0.496 18003
5627 1 9 . 1 1 112 112 SER CA C 113 58.527 58.527 59.084 -0.557 18003
5628 1 9 . 1 1 112 112 SER CB C 113 63.593 63.593 62.860 0.733 18003
5629 1 9 . 1 1 112 112 SER H H 113 8.215 8.215 8.504 -0.289 18003
5630 1 9 . 1 1 113 113 ASP N N 114 121.696 121.696 124.029 -2.333 18003
5631 1 9 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.775 -0.348 18003
5632 1 9 . 1 1 113 113 ASP C C 114 175.958 175.958 175.911 0.047 18003
5633 1 9 . 1 1 113 113 ASP CA C 114 54.213 54.213 53.772 0.441 18003
5634 1 9 . 1 1 113 113 ASP CB C 114 41.030 41.030 41.989 -0.959 18003
5635 1 9 . 1 1 113 113 ASP H H 114 8.203 8.203 8.138 0.065 18003
5636 1 9 . 1 1 114 114 ARG N N 115 120.088 120.088 121.886 -1.798 18003
5637 1 9 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.455 -0.183 18003
5638 1 9 . 1 1 114 114 ARG C C 115 175.792 175.792 175.653 0.139 18003
5639 1 9 . 1 1 114 114 ARG CA C 115 55.735 55.735 56.255 -0.520 18003
5640 1 9 . 1 1 114 114 ARG CB C 115 30.586 30.586 30.851 -0.265 18003
5641 1 9 . 1 1 114 114 ARG H H 115 8.016 8.016 8.671 -0.655 18003
5642 1 9 . 1 1 115 115 HIS N N 116 120.597 120.597 118.405 2.192 18003
5643 1 9 . 1 1 115 115 HIS CA C 116 53.697 53.697 53.782 -0.085 18003
5644 1 9 . 1 1 115 115 HIS CB C 116 29.299 29.299 29.617 -0.319 18003
5645 1 9 . 1 1 115 115 HIS H H 116 8.385 8.385 8.852 -0.467 18003
5646 1 9 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.514 -0.032 18003
5647 1 9 . 1 1 116 116 PRO C C 117 177.090 177.090 175.619 1.471 18003
5648 1 9 . 1 1 116 116 PRO CA C 117 63.177 63.177 62.485 0.692 18003
5649 1 9 . 1 1 116 116 PRO CB C 117 31.820 31.820 33.197 -1.377 18003
5650 1 9 . 1 1 117 117 SER N N 118 116.220 116.220 116.709 -0.489 18003
5651 1 9 . 1 1 117 117 SER HA H 118 4.465 4.465 4.434 0.031 18003
5652 1 9 . 1 1 117 117 SER C C 118 174.287 174.287 174.267 0.020 18003
5653 1 9 . 1 1 117 117 SER CA C 118 58.110 58.110 58.264 -0.153 18003
5654 1 9 . 1 1 117 117 SER CB C 118 63.750 63.750 62.816 0.934 18003
5655 1 9 . 1 1 117 117 SER H H 118 8.487 8.487 8.232 0.255 18003
5656 1 9 . 1 1 118 118 ALA N N 119 126.082 126.082 127.181 -1.099 18003
5657 1 9 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.025 0.414 18003
5658 1 9 . 1 1 118 118 ALA C C 119 176.879 176.879 177.995 -1.116 18003
5659 1 9 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.605 -0.156 18003
5660 1 9 . 1 1 118 118 ALA CB C 119 19.483 19.483 18.264 1.219 18003
5661 1 9 . 1 1 118 118 ALA H H 119 8.295 8.295 8.282 0.013 18003
5662 1 10 . 1 1 2 2 HIS C C 3 175.176 175.176 176.608 -1.432 18003
5663 1 10 . 1 1 2 2 HIS CA C 3 55.900 55.900 55.838 0.062 18003
5664 1 10 . 1 1 2 2 HIS CB C 3 30.029 30.029 29.886 0.143 18003
5665 1 10 . 1 1 3 3 GLY N N 4 110.613 110.613 107.073 3.540 18003
5666 1 10 . 1 1 3 3 GLY C C 4 174.068 174.068 175.607 -1.539 18003
5667 1 10 . 1 1 3 3 GLY CA C 4 45.141 45.141 45.180 -0.039 18003
5668 1 10 . 1 1 3 3 GLY H H 4 8.500 8.500 8.304 0.196 18003
5669 1 10 . 1 1 4 4 VAL N N 5 119.318 119.318 116.524 2.794 18003
5670 1 10 . 1 1 4 4 VAL HA H 5 4.128 4.128 3.968 0.160 18003
5671 1 10 . 1 1 4 4 VAL C C 5 176.361 176.361 176.517 -0.156 18003
5672 1 10 . 1 1 4 4 VAL CA C 5 61.987 61.987 63.673 -1.686 18003
5673 1 10 . 1 1 4 4 VAL CB C 5 32.635 32.635 31.259 1.376 18003
5674 1 10 . 1 1 4 4 VAL H H 5 8.094 8.094 7.118 0.976 18003
5675 1 10 . 1 1 5 5 GLU N N 6 124.369 124.369 121.023 3.346 18003
5676 1 10 . 1 1 5 5 GLU HA H 6 4.288 4.288 3.981 0.307 18003
5677 1 10 . 1 1 5 5 GLU C C 6 177.012 177.012 176.776 0.236 18003
5678 1 10 . 1 1 5 5 GLU CA C 6 56.699 56.699 57.256 -0.557 18003
5679 1 10 . 1 1 5 5 GLU CB C 6 30.029 30.029 30.052 -0.023 18003
5680 1 10 . 1 1 5 5 GLU H H 6 8.545 8.545 7.486 1.059 18003
5681 1 10 . 1 1 6 6 GLY N N 7 109.747 109.747 111.469 -1.722 18003
5682 1 10 . 1 1 6 6 GLY C C 7 174.117 174.117 174.014 0.103 18003
5683 1 10 . 1 1 6 6 GLY CA C 7 45.568 45.568 45.259 0.309 18003
5684 1 10 . 1 1 6 6 GLY H H 7 8.352 8.352 8.344 0.008 18003
5685 1 10 . 1 1 7 7 ARG N N 8 120.059 120.059 122.169 -2.110 18003
5686 1 10 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.342 -0.000 18003
5687 1 10 . 1 1 7 7 ARG C C 8 176.016 176.016 176.312 -0.296 18003
5688 1 10 . 1 1 7 7 ARG CA C 8 55.833 55.833 56.001 -0.168 18003
5689 1 10 . 1 1 7 7 ARG CB C 8 30.444 30.444 30.418 0.026 18003
5690 1 10 . 1 1 7 7 ARG H H 8 8.084 8.084 8.454 -0.370 18003
5691 1 10 . 1 1 8 8 ASN N N 9 119.379 119.379 114.865 4.514 18003
5692 1 10 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.397 -0.065 18003
5693 1 10 . 1 1 8 8 ASN C C 9 174.667 174.667 174.145 0.522 18003
5694 1 10 . 1 1 8 8 ASN CA C 9 53.441 53.441 53.765 -0.324 18003
5695 1 10 . 1 1 8 8 ASN CB C 9 38.480 38.480 37.560 0.920 18003
5696 1 10 . 1 1 8 8 ASN H H 9 8.411 8.411 8.487 -0.076 18003
5697 1 10 . 1 1 9 9 ARG N N 10 121.700 121.700 119.549 2.151 18003
5698 1 10 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.710 -0.061 18003
5699 1 10 . 1 1 9 9 ARG CA C 10 53.147 53.147 53.625 -0.478 18003
5700 1 10 . 1 1 9 9 ARG CB C 10 30.197 30.197 31.791 -1.594 18003
5701 1 10 . 1 1 9 9 ARG H H 10 8.138 8.138 8.122 0.016 18003
5702 1 10 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.479 -0.036 18003
5703 1 10 . 1 1 10 10 PRO C C 11 176.815 176.815 176.233 0.582 18003
5704 1 10 . 1 1 10 10 PRO CA C 11 63.177 63.177 62.776 0.401 18003
5705 1 10 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.294 -0.474 18003
5706 1 10 . 1 1 11 11 SER N N 12 116.291 116.291 116.927 -0.636 18003
5707 1 10 . 1 1 11 11 SER HA H 12 4.418 4.418 4.579 -0.161 18003
5708 1 10 . 1 1 11 11 SER C C 12 173.702 173.702 173.370 0.332 18003
5709 1 10 . 1 1 11 11 SER CA C 12 58.031 58.031 58.325 -0.294 18003
5710 1 10 . 1 1 11 11 SER CB C 12 64.032 64.032 63.502 0.530 18003
5711 1 10 . 1 1 11 11 SER H H 12 8.325 8.325 8.418 -0.093 18003
5712 1 10 . 1 1 12 12 ALA N N 13 126.862 126.862 125.727 1.135 18003
5713 1 10 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.452 -0.064 18003
5714 1 10 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.589 -1.131 18003
5715 1 10 . 1 1 12 12 ALA CB C 13 18.257 18.257 19.007 -0.750 18003
5716 1 10 . 1 1 12 12 ALA H H 13 8.166 8.166 8.240 -0.074 18003
5717 1 10 . 1 1 13 13 PRO C C 14 176.368 176.368 176.327 0.041 18003
5718 1 10 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.616 0.321 18003
5719 1 10 . 1 1 13 13 PRO CB C 14 32.022 32.022 31.720 0.302 18003
5720 1 10 . 1 1 14 14 LEU N N 15 120.969 120.969 125.928 -4.959 18003
5721 1 10 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.411 -0.153 18003
5722 1 10 . 1 1 14 14 LEU C C 15 176.124 176.124 178.102 -1.978 18003
5723 1 10 . 1 1 14 14 LEU CA C 15 54.527 54.527 54.776 -0.249 18003
5724 1 10 . 1 1 14 14 LEU CB C 15 43.418 43.418 41.974 1.444 18003
5725 1 10 . 1 1 14 14 LEU H H 15 7.875 7.875 8.202 -0.327 18003
5726 1 10 . 1 1 15 15 ASP N N 16 121.780 121.780 119.350 2.430 18003
5727 1 10 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.286 0.307 18003
5728 1 10 . 1 1 15 15 ASP C C 16 176.208 176.208 178.355 -2.147 18003
5729 1 10 . 1 1 15 15 ASP CA C 16 52.468 52.468 57.055 -4.587 18003
5730 1 10 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.283 1.345 18003
5731 1 10 . 1 1 15 15 ASP H H 16 7.850 7.850 8.577 -0.727 18003
5732 1 10 . 1 1 16 16 SER N N 17 114.435 114.435 115.140 -0.705 18003
5733 1 10 . 1 1 16 16 SER HA H 17 4.120 4.120 3.995 0.125 18003
5734 1 10 . 1 1 16 16 SER C C 17 177.207 177.207 176.416 0.791 18003
5735 1 10 . 1 1 16 16 SER CA C 17 62.322 62.322 61.590 0.732 18003
5736 1 10 . 1 1 16 16 SER H H 17 8.658 8.658 8.296 0.362 18003
5737 1 10 . 1 1 17 17 GLN N N 18 122.403 122.403 118.729 3.674 18003
5738 1 10 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.082 0.115 18003
5739 1 10 . 1 1 17 17 GLN C C 18 178.715 178.715 177.965 0.750 18003
5740 1 10 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.509 -0.396 18003
5741 1 10 . 1 1 17 17 GLN CB C 18 28.040 28.040 27.933 0.107 18003
5742 1 10 . 1 1 17 17 GLN H H 18 8.140 8.140 8.001 0.139 18003
5743 1 10 . 1 1 18 18 ALA N N 19 124.743 124.743 122.101 2.642 18003
5744 1 10 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.024 0.152 18003
5745 1 10 . 1 1 18 18 ALA C C 19 180.616 180.616 179.575 1.041 18003
5746 1 10 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.477 0.128 18003
5747 1 10 . 1 1 18 18 ALA CB C 19 19.028 19.028 17.895 1.133 18003
5748 1 10 . 1 1 18 18 ALA H H 19 8.455 8.455 8.125 0.330 18003
5749 1 10 . 1 1 19 19 ALA N N 20 119.089 119.089 121.203 -2.114 18003
5750 1 10 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.060 0.119 18003
5751 1 10 . 1 1 19 19 ALA C C 20 179.239 179.239 179.350 -0.111 18003
5752 1 10 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.880 0.391 18003
5753 1 10 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.349 -0.157 18003
5754 1 10 . 1 1 19 19 ALA H H 20 8.993 8.993 8.437 0.556 18003
5755 1 10 . 1 1 20 20 ALA N N 21 119.226 119.226 121.136 -1.910 18003
5756 1 10 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.975 0.085 18003
5757 1 10 . 1 1 20 20 ALA C C 21 180.230 180.230 179.815 0.415 18003
5758 1 10 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.057 0.086 18003
5759 1 10 . 1 1 20 20 ALA CB C 21 18.028 18.028 17.983 0.045 18003
5760 1 10 . 1 1 20 20 ALA H H 21 7.724 7.724 7.869 -0.145 18003
5761 1 10 . 1 1 21 21 GLN N N 22 119.310 119.310 118.727 0.583 18003
5762 1 10 . 1 1 21 21 GLN HA H 22 4.129 4.129 4.073 0.056 18003
5763 1 10 . 1 1 21 21 GLN C C 22 179.319 179.319 178.392 0.927 18003
5764 1 10 . 1 1 21 21 GLN CA C 22 58.762 58.762 58.794 -0.032 18003
5765 1 10 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.535 -0.506 18003
5766 1 10 . 1 1 21 21 GLN H H 22 7.638 7.638 8.289 -0.651 18003
5767 1 10 . 1 1 22 22 VAL N N 23 121.565 121.565 120.576 0.989 18003
5768 1 10 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.747 0.219 18003
5769 1 10 . 1 1 22 22 VAL C C 23 178.026 178.026 178.165 -0.139 18003
5770 1 10 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.133 0.009 18003
5771 1 10 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.254 -0.288 18003
5772 1 10 . 1 1 22 22 VAL H H 23 8.442 8.442 7.999 0.443 18003
5773 1 10 . 1 1 23 23 ALA N N 24 121.400 121.400 121.892 -0.492 18003
5774 1 10 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.931 0.165 18003
5775 1 10 . 1 1 23 23 ALA C C 24 178.758 178.758 179.771 -1.013 18003
5776 1 10 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.502 0.413 18003
5777 1 10 . 1 1 23 23 ALA CB C 24 16.650 16.650 17.971 -1.321 18003
5778 1 10 . 1 1 23 23 ALA H H 24 8.495 8.495 8.424 0.071 18003
5779 1 10 . 1 1 24 24 SER N N 25 112.138 112.138 114.254 -2.116 18003
5780 1 10 . 1 1 24 24 SER HA H 25 4.093 4.093 4.128 -0.035 18003
5781 1 10 . 1 1 24 24 SER C C 25 177.271 177.271 176.687 0.584 18003
5782 1 10 . 1 1 24 24 SER CA C 25 62.166 62.166 62.514 -0.348 18003
5783 1 10 . 1 1 24 24 SER CB C 25 63.032 63.032 63.218 -0.186 18003
5784 1 10 . 1 1 24 24 SER H H 25 7.936 7.936 8.129 -0.193 18003
5785 1 10 . 1 1 25 25 THR N N 26 119.701 119.701 116.330 3.371 18003
5786 1 10 . 1 1 25 25 THR HA H 26 4.380 4.380 3.992 0.388 18003
5787 1 10 . 1 1 25 25 THR C C 26 175.456 175.456 176.644 -1.188 18003
5788 1 10 . 1 1 25 25 THR CA C 26 67.129 67.129 66.042 1.087 18003
5789 1 10 . 1 1 25 25 THR CB C 26 68.800 68.800 68.727 0.073 18003
5790 1 10 . 1 1 25 25 THR H H 26 7.775 7.775 7.748 0.027 18003
5791 1 10 . 1 1 26 26 LEU N N 27 119.270 119.270 121.038 -1.768 18003
5792 1 10 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.032 -0.469 18003
5793 1 10 . 1 1 26 26 LEU C C 27 178.390 178.390 179.252 -0.862 18003
5794 1 10 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.191 0.478 18003
5795 1 10 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.298 0.732 18003
5796 1 10 . 1 1 26 26 LEU H H 27 8.006 8.006 8.420 -0.414 18003
5797 1 10 . 1 1 27 27 GLN N N 28 115.843 115.843 119.851 -4.008 18003
5798 1 10 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.032 -0.228 18003
5799 1 10 . 1 1 27 27 GLN C C 28 178.657 178.657 177.083 1.574 18003
5800 1 10 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.657 0.055 18003
5801 1 10 . 1 1 27 27 GLN CB C 28 28.029 28.029 29.012 -0.983 18003
5802 1 10 . 1 1 27 27 GLN H H 28 8.485 8.485 8.035 0.450 18003
5803 1 10 . 1 1 28 28 ALA N N 29 118.779 118.779 120.970 -2.191 18003
5804 1 10 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.062 -0.054 18003
5805 1 10 . 1 1 28 28 ALA C C 29 178.259 178.259 179.890 -1.631 18003
5806 1 10 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.477 -0.515 18003
5807 1 10 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.796 -0.058 18003
5808 1 10 . 1 1 28 28 ALA H H 29 7.432 7.432 7.707 -0.275 18003
5809 1 10 . 1 1 29 29 LEU N N 30 113.442 113.442 119.214 -5.772 18003
5810 1 10 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.952 0.044 18003
5811 1 10 . 1 1 29 29 LEU C C 30 175.924 175.924 176.372 -0.448 18003
5812 1 10 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.624 -1.060 18003
5813 1 10 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.509 0.757 18003
5814 1 10 . 1 1 29 29 LEU H H 30 7.311 7.311 7.897 -0.586 18003
5815 1 10 . 1 1 30 30 ALA N N 31 119.563 119.563 118.793 0.770 18003
5816 1 10 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.177 -0.005 18003
5817 1 10 . 1 1 30 30 ALA C C 31 176.316 176.316 176.647 -0.331 18003
5818 1 10 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.013 -1.357 18003
5819 1 10 . 1 1 30 30 ALA CB C 31 18.077 18.077 19.259 -1.182 18003
5820 1 10 . 1 1 30 30 ALA H H 31 7.223 7.223 7.083 0.140 18003
5821 1 10 . 1 1 31 31 THR N N 32 114.613 114.613 111.464 3.149 18003
5822 1 10 . 1 1 31 31 THR HA H 32 4.950 4.950 4.126 0.824 18003
5823 1 10 . 1 1 31 31 THR CA C 32 58.129 58.129 61.929 -3.800 18003
5824 1 10 . 1 1 31 31 THR CB C 32 69.098 69.098 68.397 0.701 18003
5825 1 10 . 1 1 31 31 THR H H 32 8.399 8.399 8.334 0.065 18003
5826 1 10 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.156 0.282 18003
5827 1 10 . 1 1 32 32 PRO C C 33 178.207 178.207 178.664 -0.457 18003
5828 1 10 . 1 1 32 32 PRO CA C 33 66.905 66.905 65.924 0.981 18003
5829 1 10 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.658 -0.394 18003
5830 1 10 . 1 1 33 33 SER N N 34 110.767 110.767 112.716 -1.949 18003
5831 1 10 . 1 1 33 33 SER HA H 34 4.026 4.026 4.140 -0.114 18003
5832 1 10 . 1 1 33 33 SER C C 34 176.742 176.742 177.014 -0.272 18003
5833 1 10 . 1 1 33 33 SER CA C 34 61.782 61.782 61.578 0.204 18003
5834 1 10 . 1 1 33 33 SER CB C 34 62.432 62.432 62.691 -0.259 18003
5835 1 10 . 1 1 33 33 SER H H 34 8.407 8.407 8.403 0.004 18003
5836 1 10 . 1 1 34 34 ARG N N 35 120.135 120.135 121.267 -1.132 18003
5837 1 10 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.151 -0.097 18003
5838 1 10 . 1 1 34 34 ARG C C 35 178.283 178.283 178.745 -0.462 18003
5839 1 10 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.469 2.063 18003
5840 1 10 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.841 -0.888 18003
5841 1 10 . 1 1 34 34 ARG H H 35 7.341 7.341 7.608 -0.267 18003
5842 1 10 . 1 1 35 35 LEU N N 36 118.454 118.454 121.869 -3.415 18003
5843 1 10 . 1 1 35 35 LEU HA H 36 4.054 4.054 4.083 -0.029 18003
5844 1 10 . 1 1 35 35 LEU C C 36 180.643 180.643 179.140 1.503 18003
5845 1 10 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.260 -0.451 18003
5846 1 10 . 1 1 35 35 LEU CB C 36 41.778 41.778 41.213 0.565 18003
5847 1 10 . 1 1 35 35 LEU H H 36 8.226 8.226 7.822 0.404 18003
5848 1 10 . 1 1 36 36 MET N N 37 121.073 121.073 116.993 4.080 18003
5849 1 10 . 1 1 36 36 MET HA H 37 3.928 3.928 4.165 -0.237 18003
5850 1 10 . 1 1 36 36 MET C C 37 177.671 177.671 179.204 -1.533 18003
5851 1 10 . 1 1 36 36 MET CA C 37 60.613 60.613 58.887 1.726 18003
5852 1 10 . 1 1 36 36 MET CB C 37 33.128 33.128 32.166 0.962 18003
5853 1 10 . 1 1 36 36 MET H H 37 8.447 8.447 8.065 0.382 18003
5854 1 10 . 1 1 37 37 ILE N N 38 118.239 118.239 120.636 -2.397 18003
5855 1 10 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.693 -0.253 18003
5856 1 10 . 1 1 37 37 ILE C C 38 177.092 177.092 178.119 -1.027 18003
5857 1 10 . 1 1 37 37 ILE CA C 38 65.675 65.675 64.689 0.986 18003
5858 1 10 . 1 1 37 37 ILE CB C 38 38.255 38.255 37.530 0.725 18003
5859 1 10 . 1 1 37 37 ILE H H 38 7.763 7.763 7.803 -0.040 18003
5860 1 10 . 1 1 38 38 LEU N N 39 116.073 116.073 121.293 -5.220 18003
5861 1 10 . 1 1 38 38 LEU HA H 39 3.826 3.826 4.011 -0.185 18003
5862 1 10 . 1 1 38 38 LEU C C 39 178.941 178.941 178.444 0.497 18003
5863 1 10 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.457 -0.426 18003
5864 1 10 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.553 0.227 18003
5865 1 10 . 1 1 38 38 LEU H H 39 8.538 8.538 8.440 0.099 18003
5866 1 10 . 1 1 39 39 THR N N 40 106.678 106.678 112.699 -6.021 18003
5867 1 10 . 1 1 39 39 THR HA H 40 3.932 3.932 3.945 -0.013 18003
5868 1 10 . 1 1 39 39 THR C C 40 177.747 177.747 177.059 0.688 18003
5869 1 10 . 1 1 39 39 THR CA C 40 65.536 65.536 65.948 -0.412 18003
5870 1 10 . 1 1 39 39 THR CB C 40 68.360 68.360 68.155 0.205 18003
5871 1 10 . 1 1 39 39 THR H H 40 8.086 8.086 8.368 -0.282 18003
5872 1 10 . 1 1 40 40 GLN N N 41 122.344 122.344 120.993 1.351 18003
5873 1 10 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.087 -0.081 18003
5874 1 10 . 1 1 40 40 GLN C C 41 178.348 178.348 178.683 -0.335 18003
5875 1 10 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.805 -0.880 18003
5876 1 10 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.385 -0.865 18003
5877 1 10 . 1 1 40 40 GLN H H 41 7.593 7.593 7.696 -0.103 18003
5878 1 10 . 1 1 41 41 LEU N N 42 116.302 116.302 119.082 -2.780 18003
5879 1 10 . 1 1 41 41 LEU C C 42 178.418 178.418 179.657 -1.239 18003
5880 1 10 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.149 -1.618 18003
5881 1 10 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.735 -0.386 18003
5882 1 10 . 1 1 41 41 LEU H H 42 7.570 7.570 8.086 -0.516 18003
5883 1 10 . 1 1 42 42 ARG N N 43 119.954 119.954 118.682 1.272 18003
5884 1 10 . 1 1 42 42 ARG HA H 43 3.915 3.915 3.994 -0.079 18003
5885 1 10 . 1 1 42 42 ARG C C 43 177.205 177.205 178.323 -1.118 18003
5886 1 10 . 1 1 42 42 ARG CA C 43 58.704 58.704 59.085 -0.381 18003
5887 1 10 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.080 -0.637 18003
5888 1 10 . 1 1 42 42 ARG H H 43 7.612 7.612 8.142 -0.530 18003
5889 1 10 . 1 1 43 43 ASN N N 44 114.682 114.682 117.235 -2.553 18003
5890 1 10 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.588 0.172 18003
5891 1 10 . 1 1 43 43 ASN C C 44 174.507 174.507 175.195 -0.688 18003
5892 1 10 . 1 1 43 43 ASN CA C 44 53.953 53.953 54.553 -0.600 18003
5893 1 10 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.397 -0.367 18003
5894 1 10 . 1 1 43 43 ASN H H 44 7.567 7.567 7.753 -0.186 18003
5895 1 10 . 1 1 44 44 GLY N N 45 109.113 109.113 105.719 3.394 18003
5896 1 10 . 1 1 44 44 GLY CA C 45 44.268 44.268 44.534 -0.266 18003
5897 1 10 . 1 1 44 44 GLY H H 45 7.361 7.361 7.289 0.072 18003
5898 1 10 . 1 1 45 45 PRO C C 46 178.412 178.412 176.338 2.074 18003
5899 1 10 . 1 1 45 45 PRO CA C 46 62.580 62.580 62.512 0.068 18003
5900 1 10 . 1 1 45 45 PRO CB C 46 33.129 33.129 32.260 0.869 18003
5901 1 10 . 1 1 46 46 LEU N N 47 120.363 120.363 116.153 4.210 18003
5902 1 10 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.782 0.249 18003
5903 1 10 . 1 1 46 46 LEU CA C 47 52.550 52.550 52.913 -0.364 18003
5904 1 10 . 1 1 46 46 LEU CB C 47 48.210 48.210 42.287 5.923 18003
5905 1 10 . 1 1 46 46 LEU H H 47 8.252 8.252 7.828 0.424 18003
5906 1 10 . 1 1 47 47 PRO C C 48 177.313 177.313 178.162 -0.849 18003
5907 1 10 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.388 -0.553 18003
5908 1 10 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.655 -0.272 18003
5909 1 10 . 1 1 48 48 VAL N N 49 119.384 119.384 114.295 5.089 18003
5910 1 10 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.997 -0.390 18003
5911 1 10 . 1 1 48 48 VAL C C 49 176.710 176.710 177.535 -0.825 18003
5912 1 10 . 1 1 48 48 VAL CA C 49 66.188 66.188 65.967 0.221 18003
5913 1 10 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.578 0.003 18003
5914 1 10 . 1 1 48 48 VAL H H 49 9.074 9.074 8.614 0.460 18003
5915 1 10 . 1 1 49 49 THR N N 50 111.293 111.293 113.038 -1.745 18003
5916 1 10 . 1 1 49 49 THR HA H 50 4.181 4.181 3.845 0.336 18003
5917 1 10 . 1 1 49 49 THR C C 50 176.717 176.717 176.173 0.544 18003
5918 1 10 . 1 1 49 49 THR CA C 50 65.063 65.063 66.082 -1.019 18003
5919 1 10 . 1 1 49 49 THR CB C 50 68.032 68.032 67.646 0.386 18003
5920 1 10 . 1 1 49 49 THR H H 50 7.848 7.848 8.418 -0.570 18003
5921 1 10 . 1 1 50 50 ASP N N 51 120.138 120.138 120.795 -0.657 18003
5922 1 10 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.481 -0.276 18003
5923 1 10 . 1 1 50 50 ASP C C 51 174.723 174.723 178.485 -3.762 18003
5924 1 10 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.016 -0.235 18003
5925 1 10 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.171 0.940 18003
5926 1 10 . 1 1 50 50 ASP H H 51 7.108 7.108 8.450 -1.342 18003
5927 1 10 . 1 1 51 51 LEU N N 52 121.089 121.089 121.114 -0.025 18003
5928 1 10 . 1 1 51 51 LEU HA H 52 3.985 3.985 4.085 -0.100 18003
5929 1 10 . 1 1 51 51 LEU C C 52 177.089 177.089 178.395 -1.306 18003
5930 1 10 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.620 0.541 18003
5931 1 10 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.006 0.774 18003
5932 1 10 . 1 1 51 51 LEU H H 52 7.943 7.943 8.470 -0.527 18003
5933 1 10 . 1 1 52 52 ALA N N 53 119.237 119.237 122.062 -2.825 18003
5934 1 10 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.945 -0.073 18003
5935 1 10 . 1 1 52 52 ALA C C 53 179.466 179.466 179.569 -0.103 18003
5936 1 10 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.094 0.569 18003
5937 1 10 . 1 1 52 52 ALA CB C 53 17.619 17.619 18.399 -0.780 18003
5938 1 10 . 1 1 52 52 ALA H H 53 8.480 8.480 8.224 0.256 18003
5939 1 10 . 1 1 53 53 GLU N N 54 115.655 115.655 119.014 -3.359 18003
5940 1 10 . 1 1 53 53 GLU HA H 54 4.054 4.054 3.957 0.097 18003
5941 1 10 . 1 1 53 53 GLU C C 54 179.073 179.073 178.917 0.156 18003
5942 1 10 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.738 0.089 18003
5943 1 10 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.634 -0.234 18003
5944 1 10 . 1 1 53 53 GLU H H 54 7.705 7.705 7.872 -0.167 18003
5945 1 10 . 1 1 54 54 ALA N N 55 120.276 120.276 121.066 -0.790 18003
5946 1 10 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.110 0.027 18003
5947 1 10 . 1 1 54 54 ALA C C 55 179.771 179.771 178.950 0.821 18003
5948 1 10 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.539 0.122 18003
5949 1 10 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.281 -1.046 18003
5950 1 10 . 1 1 54 54 ALA H H 55 7.928 7.928 7.725 0.203 18003
5951 1 10 . 1 1 55 55 ILE N N 56 107.195 107.195 116.965 -9.770 18003
5952 1 10 . 1 1 55 55 ILE C C 56 176.053 176.053 176.287 -0.234 18003
5953 1 10 . 1 1 55 55 ILE CA C 56 60.551 60.551 62.714 -2.163 18003
5954 1 10 . 1 1 55 55 ILE CB C 56 38.497 38.497 39.253 -0.756 18003
5955 1 10 . 1 1 55 55 ILE H H 56 7.507 7.507 8.260 -0.753 18003
5956 1 10 . 1 1 56 56 GLY N N 57 111.108 111.108 107.118 3.990 18003
5957 1 10 . 1 1 56 56 GLY C C 57 174.421 174.421 173.567 0.854 18003
5958 1 10 . 1 1 56 56 GLY CA C 57 46.960 46.960 44.879 2.081 18003
5959 1 10 . 1 1 56 56 GLY H H 57 7.757 7.757 7.848 -0.091 18003
5960 1 10 . 1 1 57 57 MET N N 58 118.089 118.089 120.216 -2.127 18003
5961 1 10 . 1 1 57 57 MET HA H 58 3.933 3.933 4.080 -0.147 18003
5962 1 10 . 1 1 57 57 MET C C 58 174.157 174.157 174.218 -0.061 18003
5963 1 10 . 1 1 57 57 MET CA C 58 54.091 54.091 56.525 -2.434 18003
5964 1 10 . 1 1 57 57 MET CB C 58 38.062 38.062 32.813 5.249 18003
5965 1 10 . 1 1 57 57 MET H H 58 7.659 7.659 8.321 -0.662 18003
5966 1 10 . 1 1 58 58 GLU N N 59 121.656 121.656 121.379 0.277 18003
5967 1 10 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.305 0.035 18003
5968 1 10 . 1 1 58 58 GLU C C 59 178.355 178.355 176.343 2.012 18003
5969 1 10 . 1 1 58 58 GLU CA C 59 56.643 56.643 56.505 0.138 18003
5970 1 10 . 1 1 58 58 GLU CB C 59 30.029 30.029 30.220 -0.191 18003
5971 1 10 . 1 1 58 58 GLU H H 59 8.523 8.523 8.673 -0.150 18003
5972 1 10 . 1 1 59 59 GLN N N 60 123.686 123.686 120.364 3.322 18003
5973 1 10 . 1 1 59 59 GLN HA H 60 4.214 4.214 4.051 0.163 18003
5974 1 10 . 1 1 59 59 GLN C C 60 177.961 177.961 177.841 0.120 18003
5975 1 10 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.568 2.048 18003
5976 1 10 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.382 0.633 18003
5977 1 10 . 1 1 59 59 GLN H H 60 9.009 9.009 8.635 0.374 18003
5978 1 10 . 1 1 60 60 SER N N 61 115.101 115.101 115.315 -0.214 18003
5979 1 10 . 1 1 60 60 SER C C 61 176.801 176.801 176.292 0.509 18003
5980 1 10 . 1 1 60 60 SER CA C 61 61.213 61.213 61.612 -0.399 18003
5981 1 10 . 1 1 60 60 SER H H 61 8.964 8.964 8.425 0.539 18003
5982 1 10 . 1 1 61 61 ALA N N 62 126.069 126.069 122.838 3.231 18003
5983 1 10 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.077 0.274 18003
5984 1 10 . 1 1 61 61 ALA C C 62 180.635 180.635 179.854 0.781 18003
5985 1 10 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.946 -0.688 18003
5986 1 10 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.293 0.330 18003
5987 1 10 . 1 1 61 61 ALA H H 62 7.103 7.103 8.377 -1.274 18003
5988 1 10 . 1 1 62 62 VAL N N 63 119.252 119.252 119.549 -0.297 18003
5989 1 10 . 1 1 62 62 VAL C C 63 177.842 177.842 177.969 -0.127 18003
5990 1 10 . 1 1 62 62 VAL CA C 63 66.798 66.798 65.941 0.857 18003
5991 1 10 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.459 -0.195 18003
5992 1 10 . 1 1 62 62 VAL H H 63 7.971 7.971 7.722 0.249 18003
5993 1 10 . 1 1 63 63 SER N N 64 115.494 115.494 115.804 -0.310 18003
5994 1 10 . 1 1 63 63 SER HA H 64 4.034 4.034 3.915 0.119 18003
5995 1 10 . 1 1 63 63 SER C C 64 176.835 176.835 176.687 0.148 18003
5996 1 10 . 1 1 63 63 SER CA C 64 62.400 62.400 61.908 0.492 18003
5997 1 10 . 1 1 63 63 SER CB C 64 62.752 62.752 62.548 0.204 18003
5998 1 10 . 1 1 63 63 SER H H 64 8.743 8.743 8.419 0.324 18003
5999 1 10 . 1 1 64 64 HIS N N 65 120.010 120.010 121.916 -1.906 18003
6000 1 10 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.244 0.116 18003
6001 1 10 . 1 1 64 64 HIS C C 65 177.731 177.731 177.349 0.382 18003
6002 1 10 . 1 1 64 64 HIS CA C 65 59.998 59.998 60.191 -0.193 18003
6003 1 10 . 1 1 64 64 HIS CB C 65 29.934 29.934 30.132 -0.198 18003
6004 1 10 . 1 1 64 64 HIS H H 65 7.804 7.804 8.513 -0.709 18003
6005 1 10 . 1 1 65 65 GLN N N 66 115.590 115.590 118.687 -3.097 18003
6006 1 10 . 1 1 65 65 GLN HA H 66 4.035 4.035 4.013 0.022 18003
6007 1 10 . 1 1 65 65 GLN C C 66 179.055 179.055 178.466 0.589 18003
6008 1 10 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.843 -1.313 18003
6009 1 10 . 1 1 65 65 GLN H H 66 7.751 7.751 8.182 -0.431 18003
6010 1 10 . 1 1 66 66 LEU N N 67 118.746 118.746 121.167 -2.421 18003
6011 1 10 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.912 0.035 18003
6012 1 10 . 1 1 66 66 LEU C C 67 178.334 178.334 178.169 0.165 18003
6013 1 10 . 1 1 66 66 LEU CA C 67 57.846 57.846 57.958 -0.112 18003
6014 1 10 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.493 -0.390 18003
6015 1 10 . 1 1 66 66 LEU H H 67 8.648 8.648 8.598 0.050 18003
6016 1 10 . 1 1 67 67 ARG N N 68 119.610 119.610 119.096 0.514 18003
6017 1 10 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.877 0.066 18003
6018 1 10 . 1 1 67 67 ARG C C 68 178.807 178.807 178.594 0.213 18003
6019 1 10 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.490 -0.113 18003
6020 1 10 . 1 1 67 67 ARG CB C 68 29.475 29.475 30.029 -0.554 18003
6021 1 10 . 1 1 67 67 ARG H H 68 7.607 7.607 7.782 -0.175 18003
6022 1 10 . 1 1 68 68 VAL N N 69 119.719 119.719 119.919 -0.200 18003
6023 1 10 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.512 0.121 18003
6024 1 10 . 1 1 68 68 VAL C C 69 178.690 178.690 178.000 0.690 18003
6025 1 10 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.451 0.003 18003
6026 1 10 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.765 0.014 18003
6027 1 10 . 1 1 68 68 VAL H H 69 7.259 7.259 7.671 -0.412 18003
6028 1 10 . 1 1 69 69 LEU N N 70 117.532 117.532 119.136 -1.604 18003
6029 1 10 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.858 0.090 18003
6030 1 10 . 1 1 69 69 LEU C C 70 179.144 179.144 178.805 0.339 18003
6031 1 10 . 1 1 69 69 LEU CA C 70 57.750 57.750 58.052 -0.302 18003
6032 1 10 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.281 0.579 18003
6033 1 10 . 1 1 69 69 LEU H H 70 8.375 8.375 8.372 0.003 18003
6034 1 10 . 1 1 70 70 ARG N N 71 122.498 122.498 119.157 3.341 18003
6035 1 10 . 1 1 70 70 ARG HA H 71 3.931 3.931 3.916 0.015 18003
6036 1 10 . 1 1 70 70 ARG C C 71 180.499 180.499 178.674 1.825 18003
6037 1 10 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.494 -0.717 18003
6038 1 10 . 1 1 70 70 ARG CB C 71 30.155 30.155 30.052 0.103 18003
6039 1 10 . 1 1 70 70 ARG H H 71 8.822 8.822 8.499 0.323 18003
6040 1 10 . 1 1 71 71 ASN N N 72 121.816 121.816 117.202 4.614 18003
6041 1 10 . 1 1 71 71 ASN C C 72 177.170 177.170 177.908 -0.738 18003
6042 1 10 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.447 0.330 18003
6043 1 10 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.085 -0.351 18003
6044 1 10 . 1 1 71 71 ASN H H 72 8.144 8.144 7.716 0.428 18003
6045 1 10 . 1 1 72 72 LEU N N 73 117.044 117.044 118.344 -1.300 18003
6046 1 10 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.162 0.183 18003
6047 1 10 . 1 1 72 72 LEU C C 73 176.984 176.984 178.018 -1.034 18003
6048 1 10 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.292 -1.167 18003
6049 1 10 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.383 0.886 18003
6050 1 10 . 1 1 72 72 LEU H H 73 7.804 7.804 7.546 0.258 18003
6051 1 10 . 1 1 73 73 GLY N N 74 106.621 106.621 107.494 -0.873 18003
6052 1 10 . 1 1 73 73 GLY C C 74 173.266 173.266 173.442 -0.176 18003
6053 1 10 . 1 1 73 73 GLY CA C 74 46.022 46.022 44.702 1.320 18003
6054 1 10 . 1 1 73 73 GLY H H 74 7.851 7.851 8.027 -0.176 18003
6055 1 10 . 1 1 74 74 LEU N N 75 114.582 114.582 116.558 -1.976 18003
6056 1 10 . 1 1 74 74 LEU C C 75 177.562 177.562 174.705 2.857 18003
6057 1 10 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.298 0.733 18003
6058 1 10 . 1 1 74 74 LEU CB C 75 44.444 44.444 42.892 1.552 18003
6059 1 10 . 1 1 74 74 LEU H H 75 7.808 7.808 7.724 0.084 18003
6060 1 10 . 1 1 75 75 VAL N N 76 110.980 110.980 115.708 -4.728 18003
6061 1 10 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.624 -0.097 18003
6062 1 10 . 1 1 75 75 VAL C C 76 173.922 173.922 174.201 -0.279 18003
6063 1 10 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.911 -2.968 18003
6064 1 10 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.588 0.441 18003
6065 1 10 . 1 1 75 75 VAL H H 76 7.079 7.079 7.308 -0.229 18003
6066 1 10 . 1 1 76 76 VAL N N 77 118.619 118.619 121.012 -2.393 18003
6067 1 10 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.560 0.742 18003
6068 1 10 . 1 1 76 76 VAL C C 77 174.041 174.041 174.578 -0.537 18003
6069 1 10 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.837 -0.838 18003
6070 1 10 . 1 1 76 76 VAL H H 77 9.024 9.024 9.205 -0.181 18003
6071 1 10 . 1 1 77 77 GLY N N 78 109.451 109.451 110.065 -0.614 18003
6072 1 10 . 1 1 77 77 GLY C C 78 172.225 172.225 172.860 -0.635 18003
6073 1 10 . 1 1 77 77 GLY CA C 78 44.462 44.462 44.381 0.081 18003
6074 1 10 . 1 1 77 77 GLY H H 78 8.265 8.265 8.389 -0.124 18003
6075 1 10 . 1 1 78 78 ASP N N 79 122.826 122.826 123.291 -0.465 18003
6076 1 10 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.824 -0.078 18003
6077 1 10 . 1 1 78 78 ASP C C 79 174.817 174.817 175.137 -0.320 18003
6078 1 10 . 1 1 78 78 ASP CA C 79 53.111 53.111 53.112 -0.001 18003
6079 1 10 . 1 1 78 78 ASP CB C 79 43.655 43.655 42.697 0.958 18003
6080 1 10 . 1 1 78 78 ASP H H 79 8.479 8.479 8.126 0.353 18003
6081 1 10 . 1 1 79 79 ARG N N 80 122.613 122.613 125.663 -3.050 18003
6082 1 10 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.513 -0.101 18003
6083 1 10 . 1 1 79 79 ARG C C 80 175.546 175.546 175.174 0.372 18003
6084 1 10 . 1 1 79 79 ARG CA C 80 56.318 56.318 55.662 0.656 18003
6085 1 10 . 1 1 79 79 ARG CB C 80 30.376 30.376 31.905 -1.529 18003
6086 1 10 . 1 1 79 79 ARG H H 80 8.580 8.580 8.658 -0.078 18003
6087 1 10 . 1 1 80 80 ALA N N 81 129.263 129.263 130.243 -0.980 18003
6088 1 10 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.666 -0.214 18003
6089 1 10 . 1 1 80 80 ALA C C 81 177.126 177.126 177.261 -0.135 18003
6090 1 10 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.606 0.014 18003
6091 1 10 . 1 1 80 80 ALA CB C 81 19.260 19.260 19.955 -0.695 18003
6092 1 10 . 1 1 80 80 ALA H H 81 8.396 8.396 8.548 -0.152 18003
6093 1 10 . 1 1 81 81 GLY N N 82 112.739 112.739 112.758 -0.019 18003
6094 1 10 . 1 1 81 81 GLY C C 82 174.856 174.856 175.377 -0.521 18003
6095 1 10 . 1 1 81 81 GLY CA C 82 46.392 46.392 47.425 -1.033 18003
6096 1 10 . 1 1 81 81 GLY H H 82 8.641 8.641 8.846 -0.205 18003
6097 1 10 . 1 1 82 82 ARG N N 83 124.780 124.780 122.546 2.234 18003
6098 1 10 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.552 -0.229 18003
6099 1 10 . 1 1 82 82 ARG C C 83 176.339 176.339 175.096 1.243 18003
6100 1 10 . 1 1 82 82 ARG CA C 83 56.690 56.690 55.373 1.317 18003
6101 1 10 . 1 1 82 82 ARG CB C 83 30.221 30.221 32.331 -2.110 18003
6102 1 10 . 1 1 82 82 ARG H H 83 8.728 8.728 8.247 0.481 18003
6103 1 10 . 1 1 83 83 SER N N 84 114.678 114.678 117.999 -3.321 18003
6104 1 10 . 1 1 83 83 SER C C 84 172.869 172.869 172.720 0.149 18003
6105 1 10 . 1 1 83 83 SER CA C 84 56.834 56.834 57.986 -1.153 18003
6106 1 10 . 1 1 83 83 SER CB C 84 65.191 65.191 64.431 0.760 18003
6107 1 10 . 1 1 83 83 SER H H 84 7.821 7.821 8.391 -0.570 18003
6108 1 10 . 1 1 84 84 ILE N N 85 122.996 122.996 128.457 -5.461 18003
6109 1 10 . 1 1 84 84 ILE C C 85 175.521 175.521 174.044 1.477 18003
6110 1 10 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.103 1.131 18003
6111 1 10 . 1 1 84 84 ILE CB C 85 38.136 38.136 40.736 -2.600 18003
6112 1 10 . 1 1 84 84 ILE H H 85 8.232 8.232 8.530 -0.298 18003
6113 1 10 . 1 1 85 85 VAL N N 86 121.845 121.845 122.667 -0.822 18003
6114 1 10 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.318 -0.008 18003
6115 1 10 . 1 1 85 85 VAL C C 86 174.818 174.818 173.727 1.091 18003
6116 1 10 . 1 1 85 85 VAL CA C 86 59.738 59.738 58.842 0.896 18003
6117 1 10 . 1 1 85 85 VAL CB C 86 34.221 34.221 34.455 -0.233 18003
6118 1 10 . 1 1 85 85 VAL H H 86 8.495 8.495 8.259 0.236 18003
6119 1 10 . 1 1 86 86 TYR N N 87 125.020 125.020 120.092 4.928 18003
6120 1 10 . 1 1 86 86 TYR HA H 87 4.319 4.319 4.823 -0.504 18003
6121 1 10 . 1 1 86 86 TYR C C 87 173.808 173.808 175.303 -1.495 18003
6122 1 10 . 1 1 86 86 TYR CA C 87 57.465 57.465 56.876 0.589 18003
6123 1 10 . 1 1 86 86 TYR CB C 87 41.480 41.480 40.525 0.955 18003
6124 1 10 . 1 1 86 86 TYR H H 87 8.488 8.488 7.969 0.519 18003
6125 1 10 . 1 1 87 87 SER N N 88 110.681 110.681 114.390 -3.709 18003
6126 1 10 . 1 1 87 87 SER HA H 88 5.414 5.414 4.802 0.612 18003
6127 1 10 . 1 1 87 87 SER C C 88 174.693 174.693 172.961 1.732 18003
6128 1 10 . 1 1 87 87 SER CA C 88 56.113 56.113 57.275 -1.162 18003
6129 1 10 . 1 1 87 87 SER CB C 88 66.309 66.309 66.895 -0.586 18003
6130 1 10 . 1 1 87 87 SER H H 88 8.718 8.718 9.219 -0.501 18003
6131 1 10 . 1 1 88 88 LEU N N 89 119.612 119.612 122.629 -3.017 18003
6132 1 10 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.350 0.577 18003
6133 1 10 . 1 1 88 88 LEU C C 89 179.031 179.031 178.097 0.934 18003
6134 1 10 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.408 -0.083 18003
6135 1 10 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.120 -0.400 18003
6136 1 10 . 1 1 88 88 LEU H H 89 9.034 9.034 8.543 0.491 18003
6137 1 10 . 1 1 89 89 TYR N N 90 120.540 120.540 125.083 -4.543 18003
6138 1 10 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.146 0.476 18003
6139 1 10 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.868 0.844 18003
6140 1 10 . 1 1 89 89 TYR H H 90 8.075 8.075 8.534 -0.459 18003
6141 1 10 . 1 1 92 92 HIS C C 93 177.850 177.850 177.208 0.642 18003
6142 1 10 . 1 1 93 93 VAL N N 94 120.211 120.211 118.968 1.243 18003
6143 1 10 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.667 -0.166 18003
6144 1 10 . 1 1 93 93 VAL C C 94 176.785 176.785 177.559 -0.774 18003
6145 1 10 . 1 1 93 93 VAL CA C 94 66.666 66.666 66.459 0.207 18003
6146 1 10 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.075 0.562 18003
6147 1 10 . 1 1 93 93 VAL H H 94 8.164 8.164 8.402 -0.238 18003
6148 1 10 . 1 1 94 94 ALA N N 95 119.221 119.221 119.996 -0.775 18003
6149 1 10 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.975 -0.185 18003
6150 1 10 . 1 1 94 94 ALA C C 95 177.979 177.979 179.655 -1.676 18003
6151 1 10 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.229 0.250 18003
6152 1 10 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.098 0.013 18003
6153 1 10 . 1 1 94 94 ALA H H 95 6.942 6.942 8.234 -1.292 18003
6154 1 10 . 1 1 95 95 GLN N N 96 115.416 115.416 119.443 -4.027 18003
6155 1 10 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.096 -0.061 18003
6156 1 10 . 1 1 95 95 GLN C C 96 177.993 177.993 178.289 -0.296 18003
6157 1 10 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.660 0.182 18003
6158 1 10 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.293 -0.264 18003
6159 1 10 . 1 1 95 95 GLN H H 96 7.795 7.795 7.868 -0.073 18003
6160 1 10 . 1 1 96 96 LEU N N 97 120.758 120.758 120.091 0.667 18003
6161 1 10 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.089 -0.240 18003
6162 1 10 . 1 1 96 96 LEU C C 97 177.974 177.974 179.330 -1.356 18003
6163 1 10 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.299 0.983 18003
6164 1 10 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.401 -0.354 18003
6165 1 10 . 1 1 96 96 LEU H H 97 8.197 8.197 7.924 0.273 18003
6166 1 10 . 1 1 97 97 LEU N N 98 117.567 117.567 120.473 -2.906 18003
6167 1 10 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.924 -0.094 18003
6168 1 10 . 1 1 97 97 LEU C C 98 178.219 178.219 178.453 -0.234 18003
6169 1 10 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.596 -0.866 18003
6170 1 10 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.614 0.248 18003
6171 1 10 . 1 1 97 97 LEU H H 98 7.660 7.660 8.279 -0.619 18003
6172 1 10 . 1 1 98 98 ASP N N 99 118.607 118.607 119.488 -0.881 18003
6173 1 10 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.294 -0.185 18003
6174 1 10 . 1 1 98 98 ASP C C 99 179.382 179.382 178.619 0.763 18003
6175 1 10 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.789 0.246 18003
6176 1 10 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.509 -0.670 18003
6177 1 10 . 1 1 98 98 ASP H H 99 8.295 8.295 8.503 -0.208 18003
6178 1 10 . 1 1 99 99 GLU N N 100 117.542 117.542 119.692 -2.150 18003
6179 1 10 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.131 -0.282 18003
6180 1 10 . 1 1 99 99 GLU C C 100 179.389 179.389 179.075 0.314 18003
6181 1 10 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.379 -1.356 18003
6182 1 10 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.220 -0.191 18003
6183 1 10 . 1 1 99 99 GLU H H 100 8.334 8.334 7.930 0.404 18003
6184 1 10 . 1 1 100 100 ALA N N 101 122.890 122.890 123.035 -0.145 18003
6185 1 10 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.187 -0.189 18003
6186 1 10 . 1 1 100 100 ALA C C 101 180.184 180.184 180.043 0.141 18003
6187 1 10 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.329 0.191 18003
6188 1 10 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.245 -0.626 18003
6189 1 10 . 1 1 100 100 ALA H H 101 8.550 8.550 8.095 0.455 18003
6190 1 10 . 1 1 101 101 ILE N N 102 119.952 119.952 119.066 0.886 18003
6191 1 10 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.714 -0.125 18003
6192 1 10 . 1 1 101 101 ILE C C 102 178.114 178.114 177.831 0.283 18003
6193 1 10 . 1 1 101 101 ILE CA C 102 65.376 65.376 65.013 0.364 18003
6194 1 10 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.034 0.995 18003
6195 1 10 . 1 1 101 101 ILE H H 102 8.493 8.493 8.637 -0.144 18003
6196 1 10 . 1 1 102 102 TYR N N 103 120.625 120.625 121.661 -1.036 18003
6197 1 10 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.138 0.033 18003
6198 1 10 . 1 1 102 102 TYR C C 103 179.772 179.772 177.985 1.787 18003
6199 1 10 . 1 1 102 102 TYR CA C 103 60.724 60.724 61.746 -1.022 18003
6200 1 10 . 1 1 102 102 TYR CB C 103 37.500 37.500 38.214 -0.714 18003
6201 1 10 . 1 1 102 102 TYR H H 103 8.520 8.520 8.558 -0.038 18003
6202 1 10 . 1 1 103 103 HIS N N 104 117.456 117.456 118.630 -1.174 18003
6203 1 10 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.183 0.242 18003
6204 1 10 . 1 1 103 103 HIS C C 104 176.377 176.377 177.771 -1.394 18003
6205 1 10 . 1 1 103 103 HIS CA C 104 60.043 60.043 59.089 0.954 18003
6206 1 10 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.709 -0.680 18003
6207 1 10 . 1 1 103 103 HIS H H 104 8.622 8.622 8.816 -0.194 18003
6208 1 10 . 1 1 104 104 SER N N 105 113.596 113.596 113.139 0.457 18003
6209 1 10 . 1 1 104 104 SER C C 105 176.712 176.712 176.391 0.321 18003
6210 1 10 . 1 1 104 104 SER CA C 105 61.852 61.852 60.580 1.272 18003
6211 1 10 . 1 1 104 104 SER CB C 105 63.550 63.550 63.048 0.502 18003
6212 1 10 . 1 1 104 104 SER H H 105 7.900 7.900 7.914 -0.014 18003
6213 1 10 . 1 1 105 105 GLU N N 106 119.022 119.022 122.014 -2.992 18003
6214 1 10 . 1 1 105 105 GLU HA H 106 4.013 4.013 3.946 0.067 18003
6215 1 10 . 1 1 105 105 GLU C C 106 177.902 177.902 177.657 0.245 18003
6216 1 10 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.605 -0.574 18003
6217 1 10 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.776 -0.497 18003
6218 1 10 . 1 1 105 105 GLU H H 106 8.181 8.181 8.086 0.095 18003
6219 1 10 . 1 1 106 106 HIS N N 107 116.482 116.482 118.021 -1.539 18003
6220 1 10 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.191 0.216 18003
6221 1 10 . 1 1 106 106 HIS C C 107 175.575 175.575 176.743 -1.168 18003
6222 1 10 . 1 1 106 106 HIS CA C 107 57.343 57.343 58.304 -0.961 18003
6223 1 10 . 1 1 106 106 HIS CB C 107 28.580 28.580 29.770 -1.190 18003
6224 1 10 . 1 1 106 106 HIS H H 107 7.770 7.770 7.736 0.034 18003
6225 1 10 . 1 1 107 107 LEU N N 108 120.346 120.346 119.098 1.248 18003
6226 1 10 . 1 1 107 107 LEU HA H 108 4.054 4.054 3.820 0.234 18003
6227 1 10 . 1 1 107 107 LEU C C 108 177.404 177.404 177.440 -0.036 18003
6228 1 10 . 1 1 107 107 LEU CA C 108 55.991 55.991 56.106 -0.115 18003
6229 1 10 . 1 1 107 107 LEU CB C 108 42.030 42.030 41.359 0.671 18003
6230 1 10 . 1 1 107 107 LEU H H 108 7.682 7.682 7.756 -0.074 18003
6231 1 10 . 1 1 108 108 HIS N N 109 117.222 117.222 115.816 1.406 18003
6232 1 10 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.199 -0.145 18003
6233 1 10 . 1 1 108 108 HIS C C 109 174.606 174.606 175.218 -0.612 18003
6234 1 10 . 1 1 108 108 HIS CA C 109 56.029 56.029 56.532 -0.503 18003
6235 1 10 . 1 1 108 108 HIS CB C 109 28.517 28.517 29.166 -0.649 18003
6236 1 10 . 1 1 108 108 HIS H H 109 8.030 8.030 8.290 -0.260 18003
6237 1 10 . 1 1 109 109 LEU N N 110 121.114 121.114 114.750 6.364 18003
6238 1 10 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.281 0.017 18003
6239 1 10 . 1 1 109 109 LEU C C 110 178.028 178.028 177.599 0.429 18003
6240 1 10 . 1 1 109 109 LEU CA C 110 55.574 55.574 56.034 -0.460 18003
6241 1 10 . 1 1 109 109 LEU CB C 110 42.076 42.076 42.188 -0.112 18003
6242 1 10 . 1 1 109 109 LEU H H 110 7.973 7.973 7.679 0.294 18003
6243 1 10 . 1 1 110 110 GLY N N 111 108.631 108.631 106.288 2.343 18003
6244 1 10 . 1 1 110 110 GLY C C 111 174.606 174.606 174.092 0.514 18003
6245 1 10 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.509 1.071 18003
6246 1 10 . 1 1 110 110 GLY H H 111 8.255 8.255 8.077 0.178 18003
6247 1 10 . 1 1 111 111 LEU N N 112 121.022 121.022 118.513 2.509 18003
6248 1 10 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.860 -0.501 18003
6249 1 10 . 1 1 111 111 LEU C C 112 177.701 177.701 176.980 0.721 18003
6250 1 10 . 1 1 111 111 LEU CA C 112 55.476 55.476 52.186 3.290 18003
6251 1 10 . 1 1 111 111 LEU CB C 112 41.899 41.899 42.347 -0.448 18003
6252 1 10 . 1 1 111 111 LEU H H 112 7.981 7.981 7.552 0.429 18003
6253 1 10 . 1 1 112 112 SER N N 113 115.471 115.471 115.855 -0.384 18003
6254 1 10 . 1 1 112 112 SER HA H 113 4.432 4.432 4.693 -0.261 18003
6255 1 10 . 1 1 112 112 SER C C 113 174.381 174.381 174.423 -0.042 18003
6256 1 10 . 1 1 112 112 SER CA C 113 58.527 58.527 58.018 0.509 18003
6257 1 10 . 1 1 112 112 SER CB C 113 63.593 63.593 63.849 -0.256 18003
6258 1 10 . 1 1 112 112 SER H H 113 8.215 8.215 8.300 -0.085 18003
6259 1 10 . 1 1 113 113 ASP N N 114 121.696 121.696 124.062 -2.366 18003
6260 1 10 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.445 -0.018 18003
6261 1 10 . 1 1 113 113 ASP C C 114 175.958 175.958 175.085 0.873 18003
6262 1 10 . 1 1 113 113 ASP CA C 114 54.213 54.213 55.665 -1.452 18003
6263 1 10 . 1 1 113 113 ASP CB C 114 41.030 41.030 41.686 -0.656 18003
6264 1 10 . 1 1 113 113 ASP H H 114 8.203 8.203 8.882 -0.679 18003
6265 1 10 . 1 1 114 114 ARG N N 115 120.088 120.088 117.667 2.421 18003
6266 1 10 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.538 -0.266 18003
6267 1 10 . 1 1 114 114 ARG C C 115 175.792 175.792 174.437 1.355 18003
6268 1 10 . 1 1 114 114 ARG CA C 115 55.735 55.735 55.917 -0.182 18003
6269 1 10 . 1 1 114 114 ARG CB C 115 30.586 30.586 31.609 -1.023 18003
6270 1 10 . 1 1 114 114 ARG H H 115 8.016 8.016 7.729 0.287 18003
6271 1 10 . 1 1 115 115 HIS N N 116 120.597 120.597 119.893 0.704 18003
6272 1 10 . 1 1 115 115 HIS CA C 116 53.697 53.697 56.727 -3.030 18003
6273 1 10 . 1 1 115 115 HIS CB C 116 29.299 29.299 28.739 0.560 18003
6274 1 10 . 1 1 115 115 HIS H H 116 8.385 8.385 8.340 0.045 18003
6275 1 10 . 1 1 116 116 PRO HA H 117 4.482 4.482 3.742 0.740 18003
6276 1 10 . 1 1 116 116 PRO C C 117 177.090 177.090 177.634 -0.544 18003
6277 1 10 . 1 1 116 116 PRO CA C 117 63.177 63.177 64.452 -1.275 18003
6278 1 10 . 1 1 116 116 PRO CB C 117 31.820 31.820 31.815 0.005 18003
6279 1 10 . 1 1 117 117 SER N N 118 116.220 116.220 113.638 2.582 18003
6280 1 10 . 1 1 117 117 SER HA H 118 4.465 4.465 4.227 0.238 18003
6281 1 10 . 1 1 117 117 SER C C 118 174.287 174.287 174.509 -0.222 18003
6282 1 10 . 1 1 117 117 SER CA C 118 58.110 58.110 59.348 -1.238 18003
6283 1 10 . 1 1 117 117 SER CB C 118 63.750 63.750 62.975 0.775 18003
6284 1 10 . 1 1 117 117 SER H H 118 8.487 8.487 7.919 0.568 18003
6285 1 10 . 1 1 118 118 ALA N N 119 126.082 126.082 123.163 2.919 18003
6286 1 10 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.392 0.047 18003
6287 1 10 . 1 1 118 118 ALA C C 119 176.879 176.879 176.519 0.360 18003
6288 1 10 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.783 -0.334 18003
6289 1 10 . 1 1 118 118 ALA CB C 119 19.483 19.483 19.683 -0.200 18003
6290 1 10 . 1 1 118 118 ALA H H 119 8.295 8.295 8.091 0.204 18003
6291 1 11 . 1 1 2 2 HIS C C 3 175.176 175.176 174.824 0.352 18003
6292 1 11 . 1 1 2 2 HIS CA C 3 55.900 55.900 55.215 0.686 18003
6293 1 11 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.687 -0.658 18003
6294 1 11 . 1 1 3 3 GLY N N 4 110.613 110.613 109.680 0.933 18003
6295 1 11 . 1 1 3 3 GLY C C 4 174.068 174.068 174.141 -0.073 18003
6296 1 11 . 1 1 3 3 GLY CA C 4 45.141 45.141 44.891 0.250 18003
6297 1 11 . 1 1 3 3 GLY H H 4 8.500 8.500 8.411 0.089 18003
6298 1 11 . 1 1 4 4 VAL N N 5 119.318 119.318 122.898 -3.580 18003
6299 1 11 . 1 1 4 4 VAL HA H 5 4.128 4.128 3.883 0.245 18003
6300 1 11 . 1 1 4 4 VAL C C 5 176.361 176.361 176.501 -0.140 18003
6301 1 11 . 1 1 4 4 VAL CA C 5 61.987 61.987 63.684 -1.697 18003
6302 1 11 . 1 1 4 4 VAL CB C 5 32.635 32.635 32.140 0.495 18003
6303 1 11 . 1 1 4 4 VAL H H 5 8.094 8.094 8.224 -0.130 18003
6304 1 11 . 1 1 5 5 GLU N N 6 124.369 124.369 119.791 4.578 18003
6305 1 11 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.251 0.037 18003
6306 1 11 . 1 1 5 5 GLU C C 6 177.012 177.012 175.690 1.322 18003
6307 1 11 . 1 1 5 5 GLU CA C 6 56.699 56.699 56.702 -0.003 18003
6308 1 11 . 1 1 5 5 GLU CB C 6 30.029 30.029 30.075 -0.046 18003
6309 1 11 . 1 1 5 5 GLU H H 6 8.545 8.545 7.993 0.552 18003
6310 1 11 . 1 1 6 6 GLY N N 7 109.747 109.747 106.701 3.046 18003
6311 1 11 . 1 1 6 6 GLY C C 7 174.117 174.117 173.444 0.673 18003
6312 1 11 . 1 1 6 6 GLY CA C 7 45.568 45.568 44.539 1.029 18003
6313 1 11 . 1 1 6 6 GLY H H 7 8.352 8.352 8.086 0.266 18003
6314 1 11 . 1 1 7 7 ARG N N 8 120.059 120.059 121.850 -1.791 18003
6315 1 11 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.378 -0.036 18003
6316 1 11 . 1 1 7 7 ARG C C 8 176.016 176.016 175.570 0.446 18003
6317 1 11 . 1 1 7 7 ARG CA C 8 55.833 55.833 55.575 0.258 18003
6318 1 11 . 1 1 7 7 ARG CB C 8 30.444 30.444 29.639 0.805 18003
6319 1 11 . 1 1 7 7 ARG H H 8 8.084 8.084 8.542 -0.458 18003
6320 1 11 . 1 1 8 8 ASN N N 9 119.379 119.379 119.494 -0.115 18003
6321 1 11 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.533 -0.201 18003
6322 1 11 . 1 1 8 8 ASN C C 9 174.667 174.667 175.189 -0.522 18003
6323 1 11 . 1 1 8 8 ASN CA C 9 53.441 53.441 54.229 -0.788 18003
6324 1 11 . 1 1 8 8 ASN CB C 9 38.480 38.480 38.660 -0.180 18003
6325 1 11 . 1 1 8 8 ASN H H 9 8.411 8.411 8.214 0.197 18003
6326 1 11 . 1 1 9 9 ARG N N 10 121.700 121.700 115.027 6.673 18003
6327 1 11 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.128 0.521 18003
6328 1 11 . 1 1 9 9 ARG CA C 10 53.147 53.147 55.771 -2.624 18003
6329 1 11 . 1 1 9 9 ARG CB C 10 30.197 30.197 27.295 2.902 18003
6330 1 11 . 1 1 9 9 ARG H H 10 8.138 8.138 8.571 -0.433 18003
6331 1 11 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.502 -0.059 18003
6332 1 11 . 1 1 10 10 PRO C C 11 176.815 176.815 176.473 0.342 18003
6333 1 11 . 1 1 10 10 PRO CA C 11 63.177 63.177 63.821 -0.644 18003
6334 1 11 . 1 1 10 10 PRO CB C 11 31.820 31.820 31.600 0.220 18003
6335 1 11 . 1 1 11 11 SER N N 12 116.291 116.291 110.847 5.444 18003
6336 1 11 . 1 1 11 11 SER HA H 12 4.418 4.418 4.583 -0.165 18003
6337 1 11 . 1 1 11 11 SER C C 12 173.702 173.702 175.085 -1.383 18003
6338 1 11 . 1 1 11 11 SER CA C 12 58.031 58.031 57.810 0.221 18003
6339 1 11 . 1 1 11 11 SER CB C 12 64.032 64.032 64.243 -0.212 18003
6340 1 11 . 1 1 11 11 SER H H 12 8.325 8.325 7.685 0.640 18003
6341 1 11 . 1 1 12 12 ALA N N 13 126.862 126.862 125.584 1.278 18003
6342 1 11 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.494 -0.106 18003
6343 1 11 . 1 1 12 12 ALA CA C 13 50.458 50.458 53.025 -2.567 18003
6344 1 11 . 1 1 12 12 ALA CB C 13 18.257 18.257 17.861 0.396 18003
6345 1 11 . 1 1 12 12 ALA H H 13 8.166 8.166 7.667 0.499 18003
6346 1 11 . 1 1 13 13 PRO C C 14 176.368 176.368 177.209 -0.841 18003
6347 1 11 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.898 0.039 18003
6348 1 11 . 1 1 13 13 PRO CB C 14 32.022 32.022 32.136 -0.114 18003
6349 1 11 . 1 1 14 14 LEU N N 15 120.969 120.969 123.158 -2.189 18003
6350 1 11 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.639 -0.381 18003
6351 1 11 . 1 1 14 14 LEU C C 15 176.124 176.124 177.917 -1.793 18003
6352 1 11 . 1 1 14 14 LEU CA C 15 54.527 54.527 56.581 -2.054 18003
6353 1 11 . 1 1 14 14 LEU CB C 15 43.418 43.418 41.391 2.027 18003
6354 1 11 . 1 1 14 14 LEU H H 15 7.875 7.875 8.175 -0.300 18003
6355 1 11 . 1 1 15 15 ASP N N 16 121.780 121.780 120.406 1.374 18003
6356 1 11 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.328 0.265 18003
6357 1 11 . 1 1 15 15 ASP C C 16 176.208 176.208 178.477 -2.269 18003
6358 1 11 . 1 1 15 15 ASP CA C 16 52.468 52.468 57.388 -4.920 18003
6359 1 11 . 1 1 15 15 ASP CB C 16 41.629 41.629 39.619 2.010 18003
6360 1 11 . 1 1 15 15 ASP H H 16 7.850 7.850 8.741 -0.891 18003
6361 1 11 . 1 1 16 16 SER N N 17 114.435 114.435 114.277 0.158 18003
6362 1 11 . 1 1 16 16 SER HA H 17 4.120 4.120 4.007 0.113 18003
6363 1 11 . 1 1 16 16 SER C C 17 177.207 177.207 176.755 0.452 18003
6364 1 11 . 1 1 16 16 SER CA C 17 62.322 62.322 61.240 1.082 18003
6365 1 11 . 1 1 16 16 SER H H 17 8.658 8.658 8.245 0.413 18003
6366 1 11 . 1 1 17 17 GLN N N 18 122.403 122.403 121.217 1.186 18003
6367 1 11 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.041 0.156 18003
6368 1 11 . 1 1 17 17 GLN C C 18 178.715 178.715 178.332 0.383 18003
6369 1 11 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.497 -0.384 18003
6370 1 11 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.436 -0.396 18003
6371 1 11 . 1 1 17 17 GLN H H 18 8.140 8.140 8.567 -0.427 18003
6372 1 11 . 1 1 18 18 ALA N N 19 124.743 124.743 121.849 2.894 18003
6373 1 11 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.023 0.153 18003
6374 1 11 . 1 1 18 18 ALA C C 19 180.616 180.616 179.557 1.059 18003
6375 1 11 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.733 -0.128 18003
6376 1 11 . 1 1 18 18 ALA CB C 19 19.028 19.028 17.959 1.069 18003
6377 1 11 . 1 1 18 18 ALA H H 19 8.455 8.455 7.637 0.818 18003
6378 1 11 . 1 1 19 19 ALA N N 20 119.089 119.089 121.160 -2.071 18003
6379 1 11 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.080 0.099 18003
6380 1 11 . 1 1 19 19 ALA C C 20 179.239 179.239 179.422 -0.183 18003
6381 1 11 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.808 0.463 18003
6382 1 11 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.386 -0.194 18003
6383 1 11 . 1 1 19 19 ALA H H 20 8.993 8.993 8.259 0.734 18003
6384 1 11 . 1 1 20 20 ALA N N 21 119.226 119.226 121.327 -2.101 18003
6385 1 11 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.880 0.180 18003
6386 1 11 . 1 1 20 20 ALA C C 21 180.230 180.230 179.478 0.752 18003
6387 1 11 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.048 0.095 18003
6388 1 11 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.303 -0.275 18003
6389 1 11 . 1 1 20 20 ALA H H 21 7.724 7.724 7.935 -0.211 18003
6390 1 11 . 1 1 21 21 GLN N N 22 119.310 119.310 118.930 0.380 18003
6391 1 11 . 1 1 21 21 GLN HA H 22 4.129 4.129 4.075 0.054 18003
6392 1 11 . 1 1 21 21 GLN C C 22 179.319 179.319 178.413 0.906 18003
6393 1 11 . 1 1 21 21 GLN CA C 22 58.762 58.762 58.566 0.196 18003
6394 1 11 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.452 -0.423 18003
6395 1 11 . 1 1 21 21 GLN H H 22 7.638 7.638 8.458 -0.820 18003
6396 1 11 . 1 1 22 22 VAL N N 23 121.565 121.565 119.852 1.713 18003
6397 1 11 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.575 0.392 18003
6398 1 11 . 1 1 22 22 VAL C C 23 178.026 178.026 177.670 0.356 18003
6399 1 11 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.284 -0.142 18003
6400 1 11 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.524 -0.558 18003
6401 1 11 . 1 1 22 22 VAL H H 23 8.442 8.442 7.850 0.592 18003
6402 1 11 . 1 1 23 23 ALA N N 24 121.400 121.400 121.863 -0.463 18003
6403 1 11 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.879 0.217 18003
6404 1 11 . 1 1 23 23 ALA C C 24 178.758 178.758 179.681 -0.923 18003
6405 1 11 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.507 0.408 18003
6406 1 11 . 1 1 23 23 ALA CB C 24 16.650 16.650 18.003 -1.353 18003
6407 1 11 . 1 1 23 23 ALA H H 24 8.495 8.495 8.423 0.072 18003
6408 1 11 . 1 1 24 24 SER N N 25 112.138 112.138 114.941 -2.803 18003
6409 1 11 . 1 1 24 24 SER HA H 25 4.093 4.093 4.108 -0.015 18003
6410 1 11 . 1 1 24 24 SER C C 25 177.271 177.271 176.773 0.498 18003
6411 1 11 . 1 1 24 24 SER CA C 25 62.166 62.166 61.497 0.669 18003
6412 1 11 . 1 1 24 24 SER CB C 25 63.032 63.032 63.125 -0.093 18003
6413 1 11 . 1 1 24 24 SER H H 25 7.936 7.936 8.157 -0.221 18003
6414 1 11 . 1 1 25 25 THR N N 26 119.701 119.701 119.770 -0.069 18003
6415 1 11 . 1 1 25 25 THR HA H 26 4.380 4.380 4.062 0.318 18003
6416 1 11 . 1 1 25 25 THR C C 26 175.456 175.456 176.293 -0.837 18003
6417 1 11 . 1 1 25 25 THR CA C 26 67.129 67.129 66.821 0.308 18003
6418 1 11 . 1 1 25 25 THR CB C 26 68.800 68.800 68.717 0.083 18003
6419 1 11 . 1 1 25 25 THR H H 26 7.775 7.775 7.654 0.121 18003
6420 1 11 . 1 1 26 26 LEU N N 27 119.270 119.270 120.392 -1.122 18003
6421 1 11 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.145 -0.582 18003
6422 1 11 . 1 1 26 26 LEU C C 27 178.390 178.390 179.059 -0.669 18003
6423 1 11 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.452 0.217 18003
6424 1 11 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.264 0.766 18003
6425 1 11 . 1 1 26 26 LEU H H 27 8.006 8.006 8.491 -0.485 18003
6426 1 11 . 1 1 27 27 GLN N N 28 115.843 115.843 120.211 -4.368 18003
6427 1 11 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.028 -0.224 18003
6428 1 11 . 1 1 27 27 GLN C C 28 178.657 178.657 177.833 0.824 18003
6429 1 11 . 1 1 27 27 GLN CA C 28 58.712 58.712 59.074 -0.362 18003
6430 1 11 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.802 -0.773 18003
6431 1 11 . 1 1 27 27 GLN H H 28 8.485 8.485 8.153 0.332 18003
6432 1 11 . 1 1 28 28 ALA N N 29 118.779 118.779 122.732 -3.953 18003
6433 1 11 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.051 -0.043 18003
6434 1 11 . 1 1 28 28 ALA C C 29 178.259 178.259 180.145 -1.886 18003
6435 1 11 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.880 -0.918 18003
6436 1 11 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.505 0.233 18003
6437 1 11 . 1 1 28 28 ALA H H 29 7.432 7.432 7.856 -0.424 18003
6438 1 11 . 1 1 29 29 LEU N N 30 113.442 113.442 117.591 -4.149 18003
6439 1 11 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.908 0.088 18003
6440 1 11 . 1 1 29 29 LEU C C 30 175.924 175.924 178.189 -2.265 18003
6441 1 11 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.975 -1.411 18003
6442 1 11 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.616 0.650 18003
6443 1 11 . 1 1 29 29 LEU H H 30 7.311 7.311 7.821 -0.510 18003
6444 1 11 . 1 1 30 30 ALA N N 31 119.563 119.563 119.586 -0.023 18003
6445 1 11 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.006 0.166 18003
6446 1 11 . 1 1 30 30 ALA C C 31 176.316 176.316 178.361 -2.045 18003
6447 1 11 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.732 -2.076 18003
6448 1 11 . 1 1 30 30 ALA CB C 31 18.077 18.077 18.643 -0.566 18003
6449 1 11 . 1 1 30 30 ALA H H 31 7.223 7.223 7.343 -0.120 18003
6450 1 11 . 1 1 31 31 THR N N 32 114.613 114.613 114.335 0.278 18003
6451 1 11 . 1 1 31 31 THR HA H 32 4.950 4.950 4.076 0.874 18003
6452 1 11 . 1 1 31 31 THR CA C 32 58.129 58.129 63.742 -5.613 18003
6453 1 11 . 1 1 31 31 THR CB C 32 69.098 69.098 68.192 0.906 18003
6454 1 11 . 1 1 31 31 THR H H 32 8.399 8.399 7.620 0.779 18003
6455 1 11 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.108 0.330 18003
6456 1 11 . 1 1 32 32 PRO C C 33 178.207 178.207 178.626 -0.419 18003
6457 1 11 . 1 1 32 32 PRO CA C 33 66.905 66.905 66.362 0.543 18003
6458 1 11 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.846 -0.582 18003
6459 1 11 . 1 1 33 33 SER N N 34 110.767 110.767 112.266 -1.499 18003
6460 1 11 . 1 1 33 33 SER HA H 34 4.026 4.026 4.156 -0.130 18003
6461 1 11 . 1 1 33 33 SER C C 34 176.742 176.742 176.528 0.214 18003
6462 1 11 . 1 1 33 33 SER CA C 34 61.782 61.782 61.629 0.153 18003
6463 1 11 . 1 1 33 33 SER CB C 34 62.432 62.432 62.701 -0.269 18003
6464 1 11 . 1 1 33 33 SER H H 34 8.407 8.407 8.401 0.006 18003
6465 1 11 . 1 1 34 34 ARG N N 35 120.135 120.135 121.541 -1.406 18003
6466 1 11 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.144 -0.090 18003
6467 1 11 . 1 1 34 34 ARG C C 35 178.283 178.283 178.589 -0.306 18003
6468 1 11 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.982 1.550 18003
6469 1 11 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.928 -0.975 18003
6470 1 11 . 1 1 34 34 ARG H H 35 7.341 7.341 7.476 -0.135 18003
6471 1 11 . 1 1 35 35 LEU N N 36 118.454 118.454 121.268 -2.814 18003
6472 1 11 . 1 1 35 35 LEU HA H 36 4.054 4.054 3.945 0.109 18003
6473 1 11 . 1 1 35 35 LEU C C 36 180.643 180.643 178.535 2.108 18003
6474 1 11 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.280 -0.471 18003
6475 1 11 . 1 1 35 35 LEU CB C 36 41.778 41.778 42.085 -0.307 18003
6476 1 11 . 1 1 35 35 LEU H H 36 8.226 8.226 8.654 -0.428 18003
6477 1 11 . 1 1 36 36 MET N N 37 121.073 121.073 119.280 1.793 18003
6478 1 11 . 1 1 36 36 MET HA H 37 3.928 3.928 3.974 -0.046 18003
6479 1 11 . 1 1 36 36 MET C C 37 177.671 177.671 178.435 -0.764 18003
6480 1 11 . 1 1 36 36 MET CA C 37 60.613 60.613 59.549 1.064 18003
6481 1 11 . 1 1 36 36 MET CB C 37 33.128 33.128 32.613 0.515 18003
6482 1 11 . 1 1 36 36 MET H H 37 8.447 8.447 8.315 0.132 18003
6483 1 11 . 1 1 37 37 ILE N N 38 118.239 118.239 119.951 -1.712 18003
6484 1 11 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.637 -0.197 18003
6485 1 11 . 1 1 37 37 ILE C C 38 177.092 177.092 178.090 -0.998 18003
6486 1 11 . 1 1 37 37 ILE CA C 38 65.675 65.675 65.269 0.406 18003
6487 1 11 . 1 1 37 37 ILE CB C 38 38.255 38.255 37.676 0.579 18003
6488 1 11 . 1 1 37 37 ILE H H 38 7.763 7.763 7.926 -0.163 18003
6489 1 11 . 1 1 38 38 LEU N N 39 116.073 116.073 120.136 -4.063 18003
6490 1 11 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.990 -0.164 18003
6491 1 11 . 1 1 38 38 LEU C C 39 178.941 178.941 179.573 -0.632 18003
6492 1 11 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.079 -0.048 18003
6493 1 11 . 1 1 38 38 LEU CB C 39 41.780 41.780 40.535 1.245 18003
6494 1 11 . 1 1 38 38 LEU H H 39 8.538 8.538 8.442 0.096 18003
6495 1 11 . 1 1 39 39 THR N N 40 106.678 106.678 114.786 -8.108 18003
6496 1 11 . 1 1 39 39 THR HA H 40 3.932 3.932 3.912 0.020 18003
6497 1 11 . 1 1 39 39 THR C C 40 177.747 177.747 176.618 1.129 18003
6498 1 11 . 1 1 39 39 THR CA C 40 65.536 65.536 66.244 -0.708 18003
6499 1 11 . 1 1 39 39 THR CB C 40 68.360 68.360 68.486 -0.126 18003
6500 1 11 . 1 1 39 39 THR H H 40 8.086 8.086 8.599 -0.513 18003
6501 1 11 . 1 1 40 40 GLN N N 41 122.344 122.344 120.333 2.011 18003
6502 1 11 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.161 -0.155 18003
6503 1 11 . 1 1 40 40 GLN C C 41 178.348 178.348 178.613 -0.265 18003
6504 1 11 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.437 -0.512 18003
6505 1 11 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.513 -0.993 18003
6506 1 11 . 1 1 40 40 GLN H H 41 7.593 7.593 7.765 -0.172 18003
6507 1 11 . 1 1 41 41 LEU N N 42 116.302 116.302 119.872 -3.570 18003
6508 1 11 . 1 1 41 41 LEU C C 42 178.418 178.418 178.183 0.235 18003
6509 1 11 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.026 -1.495 18003
6510 1 11 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.701 -0.352 18003
6511 1 11 . 1 1 41 41 LEU H H 42 7.570 7.570 7.842 -0.272 18003
6512 1 11 . 1 1 42 42 ARG N N 43 119.954 119.954 117.214 2.740 18003
6513 1 11 . 1 1 42 42 ARG HA H 43 3.915 3.915 3.816 0.099 18003
6514 1 11 . 1 1 42 42 ARG C C 43 177.205 177.205 177.370 -0.165 18003
6515 1 11 . 1 1 42 42 ARG CA C 43 58.704 58.704 59.220 -0.516 18003
6516 1 11 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.029 -0.585 18003
6517 1 11 . 1 1 42 42 ARG H H 43 7.612 7.612 8.042 -0.430 18003
6518 1 11 . 1 1 43 43 ASN N N 44 114.682 114.682 116.565 -1.883 18003
6519 1 11 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.614 0.146 18003
6520 1 11 . 1 1 43 43 ASN C C 44 174.507 174.507 175.682 -1.175 18003
6521 1 11 . 1 1 43 43 ASN CA C 44 53.953 53.953 55.312 -1.359 18003
6522 1 11 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.211 -0.181 18003
6523 1 11 . 1 1 43 43 ASN H H 44 7.567 7.567 7.570 -0.003 18003
6524 1 11 . 1 1 44 44 GLY N N 45 109.113 109.113 106.434 2.679 18003
6525 1 11 . 1 1 44 44 GLY CA C 45 44.268 44.268 45.095 -0.827 18003
6526 1 11 . 1 1 44 44 GLY H H 45 7.361 7.361 8.544 -1.183 18003
6527 1 11 . 1 1 45 45 PRO C C 46 178.412 178.412 175.656 2.756 18003
6528 1 11 . 1 1 45 45 PRO CA C 46 62.580 62.580 63.004 -0.423 18003
6529 1 11 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.050 2.079 18003
6530 1 11 . 1 1 46 46 LEU N N 47 120.363 120.363 125.446 -5.083 18003
6531 1 11 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.755 0.276 18003
6532 1 11 . 1 1 46 46 LEU CA C 47 52.550 52.550 52.657 -0.107 18003
6533 1 11 . 1 1 46 46 LEU CB C 47 48.210 48.210 43.265 4.945 18003
6534 1 11 . 1 1 46 46 LEU H H 47 8.252 8.252 7.888 0.364 18003
6535 1 11 . 1 1 47 47 PRO C C 48 177.313 177.313 178.444 -1.131 18003
6536 1 11 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.239 -0.404 18003
6537 1 11 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.424 -0.041 18003
6538 1 11 . 1 1 48 48 VAL N N 49 119.384 119.384 118.838 0.546 18003
6539 1 11 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.671 -0.064 18003
6540 1 11 . 1 1 48 48 VAL C C 49 176.710 176.710 178.341 -1.631 18003
6541 1 11 . 1 1 48 48 VAL CA C 49 66.188 66.188 67.413 -1.225 18003
6542 1 11 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.454 0.127 18003
6543 1 11 . 1 1 48 48 VAL H H 49 9.074 9.074 8.948 0.126 18003
6544 1 11 . 1 1 49 49 THR N N 50 111.293 111.293 109.176 2.117 18003
6545 1 11 . 1 1 49 49 THR HA H 50 4.181 4.181 4.363 -0.182 18003
6546 1 11 . 1 1 49 49 THR C C 50 176.717 176.717 176.154 0.563 18003
6547 1 11 . 1 1 49 49 THR CA C 50 65.063 65.063 65.309 -0.246 18003
6548 1 11 . 1 1 49 49 THR CB C 50 68.032 68.032 68.591 -0.559 18003
6549 1 11 . 1 1 49 49 THR H H 50 7.848 7.848 8.207 -0.359 18003
6550 1 11 . 1 1 50 50 ASP N N 51 120.138 120.138 122.477 -2.339 18003
6551 1 11 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.512 -0.307 18003
6552 1 11 . 1 1 50 50 ASP C C 51 174.723 174.723 178.477 -3.754 18003
6553 1 11 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.095 -0.314 18003
6554 1 11 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.258 0.854 18003
6555 1 11 . 1 1 50 50 ASP H H 51 7.108 7.108 8.246 -1.138 18003
6556 1 11 . 1 1 51 51 LEU N N 52 121.089 121.089 120.468 0.621 18003
6557 1 11 . 1 1 51 51 LEU HA H 52 3.985 3.985 3.967 0.018 18003
6558 1 11 . 1 1 51 51 LEU C C 52 177.089 177.089 178.604 -1.515 18003
6559 1 11 . 1 1 51 51 LEU CA C 52 58.161 58.161 58.138 0.023 18003
6560 1 11 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.703 0.077 18003
6561 1 11 . 1 1 51 51 LEU H H 52 7.943 7.943 8.467 -0.524 18003
6562 1 11 . 1 1 52 52 ALA N N 53 119.237 119.237 121.822 -2.585 18003
6563 1 11 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.889 -0.017 18003
6564 1 11 . 1 1 52 52 ALA C C 53 179.466 179.466 179.547 -0.081 18003
6565 1 11 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.369 0.294 18003
6566 1 11 . 1 1 52 52 ALA CB C 53 17.619 17.619 17.980 -0.361 18003
6567 1 11 . 1 1 52 52 ALA H H 53 8.480 8.480 7.928 0.552 18003
6568 1 11 . 1 1 53 53 GLU N N 54 115.655 115.655 119.366 -3.711 18003
6569 1 11 . 1 1 53 53 GLU HA H 54 4.054 4.054 4.026 0.028 18003
6570 1 11 . 1 1 53 53 GLU C C 54 179.073 179.073 178.789 0.284 18003
6571 1 11 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.701 0.126 18003
6572 1 11 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.474 -0.074 18003
6573 1 11 . 1 1 53 53 GLU H H 54 7.705 7.705 7.873 -0.168 18003
6574 1 11 . 1 1 54 54 ALA N N 55 120.276 120.276 121.128 -0.852 18003
6575 1 11 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.118 0.019 18003
6576 1 11 . 1 1 54 54 ALA C C 55 179.771 179.771 179.442 0.329 18003
6577 1 11 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.299 0.362 18003
6578 1 11 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.156 -0.921 18003
6579 1 11 . 1 1 54 54 ALA H H 55 7.928 7.928 7.823 0.105 18003
6580 1 11 . 1 1 55 55 ILE N N 56 107.195 107.195 117.432 -10.237 18003
6581 1 11 . 1 1 55 55 ILE C C 56 176.053 176.053 177.197 -1.144 18003
6582 1 11 . 1 1 55 55 ILE CA C 56 60.551 60.551 63.246 -2.695 18003
6583 1 11 . 1 1 55 55 ILE CB C 56 38.497 38.497 38.889 -0.391 18003
6584 1 11 . 1 1 55 55 ILE H H 56 7.507 7.507 8.265 -0.758 18003
6585 1 11 . 1 1 56 56 GLY N N 57 111.108 111.108 107.213 3.895 18003
6586 1 11 . 1 1 56 56 GLY C C 57 174.421 174.421 173.851 0.570 18003
6587 1 11 . 1 1 56 56 GLY CA C 57 46.960 46.960 44.553 2.407 18003
6588 1 11 . 1 1 56 56 GLY H H 57 7.757 7.757 8.016 -0.259 18003
6589 1 11 . 1 1 57 57 MET N N 58 118.089 118.089 119.510 -1.421 18003
6590 1 11 . 1 1 57 57 MET HA H 58 3.933 3.933 4.075 -0.142 18003
6591 1 11 . 1 1 57 57 MET C C 58 174.157 174.157 174.768 -0.611 18003
6592 1 11 . 1 1 57 57 MET CA C 58 54.091 54.091 57.025 -2.934 18003
6593 1 11 . 1 1 57 57 MET CB C 58 38.062 38.062 32.614 5.448 18003
6594 1 11 . 1 1 57 57 MET H H 58 7.659 7.659 7.861 -0.202 18003
6595 1 11 . 1 1 58 58 GLU N N 59 121.656 121.656 122.659 -1.003 18003
6596 1 11 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.310 0.030 18003
6597 1 11 . 1 1 58 58 GLU C C 59 178.355 178.355 176.381 1.974 18003
6598 1 11 . 1 1 58 58 GLU CA C 59 56.643 56.643 56.663 -0.020 18003
6599 1 11 . 1 1 58 58 GLU CB C 59 30.029 30.029 30.044 -0.015 18003
6600 1 11 . 1 1 58 58 GLU H H 59 8.523 8.523 8.550 -0.027 18003
6601 1 11 . 1 1 59 59 GLN N N 60 123.686 123.686 120.129 3.557 18003
6602 1 11 . 1 1 59 59 GLN HA H 60 4.214 4.214 3.949 0.265 18003
6603 1 11 . 1 1 59 59 GLN C C 60 177.961 177.961 177.409 0.552 18003
6604 1 11 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.962 1.654 18003
6605 1 11 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.372 0.642 18003
6606 1 11 . 1 1 59 59 GLN H H 60 9.009 9.009 8.628 0.381 18003
6607 1 11 . 1 1 60 60 SER N N 61 115.101 115.101 115.103 -0.002 18003
6608 1 11 . 1 1 60 60 SER C C 61 176.801 176.801 176.181 0.620 18003
6609 1 11 . 1 1 60 60 SER CA C 61 61.213 61.213 61.210 0.003 18003
6610 1 11 . 1 1 60 60 SER H H 61 8.964 8.964 8.468 0.496 18003
6611 1 11 . 1 1 61 61 ALA N N 62 126.069 126.069 124.715 1.354 18003
6612 1 11 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.171 0.180 18003
6613 1 11 . 1 1 61 61 ALA C C 62 180.635 180.635 179.598 1.037 18003
6614 1 11 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.926 -0.668 18003
6615 1 11 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.051 0.572 18003
6616 1 11 . 1 1 61 61 ALA H H 62 7.103 7.103 7.690 -0.587 18003
6617 1 11 . 1 1 62 62 VAL N N 63 119.252 119.252 119.659 -0.407 18003
6618 1 11 . 1 1 62 62 VAL C C 63 177.842 177.842 177.996 -0.154 18003
6619 1 11 . 1 1 62 62 VAL CA C 63 66.798 66.798 65.891 0.907 18003
6620 1 11 . 1 1 62 62 VAL CB C 63 31.264 31.264 30.952 0.312 18003
6621 1 11 . 1 1 62 62 VAL H H 63 7.971 7.971 7.782 0.189 18003
6622 1 11 . 1 1 63 63 SER N N 64 115.494 115.494 116.342 -0.848 18003
6623 1 11 . 1 1 63 63 SER HA H 64 4.034 4.034 3.925 0.109 18003
6624 1 11 . 1 1 63 63 SER C C 64 176.835 176.835 176.925 -0.090 18003
6625 1 11 . 1 1 63 63 SER CA C 64 62.400 62.400 62.350 0.050 18003
6626 1 11 . 1 1 63 63 SER CB C 64 62.752 62.752 62.779 -0.027 18003
6627 1 11 . 1 1 63 63 SER H H 64 8.743 8.743 8.178 0.565 18003
6628 1 11 . 1 1 64 64 HIS N N 65 120.010 120.010 119.997 0.013 18003
6629 1 11 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.344 0.016 18003
6630 1 11 . 1 1 64 64 HIS C C 65 177.731 177.731 177.550 0.181 18003
6631 1 11 . 1 1 64 64 HIS CA C 65 59.998 59.998 59.315 0.684 18003
6632 1 11 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.442 0.492 18003
6633 1 11 . 1 1 64 64 HIS H H 65 7.804 7.804 7.976 -0.172 18003
6634 1 11 . 1 1 65 65 GLN N N 66 115.590 115.590 119.693 -4.103 18003
6635 1 11 . 1 1 65 65 GLN HA H 66 4.035 4.035 4.075 -0.040 18003
6636 1 11 . 1 1 65 65 GLN C C 66 179.055 179.055 178.370 0.685 18003
6637 1 11 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.700 -1.170 18003
6638 1 11 . 1 1 65 65 GLN H H 66 7.751 7.751 7.936 -0.185 18003
6639 1 11 . 1 1 66 66 LEU N N 67 118.746 118.746 120.865 -2.119 18003
6640 1 11 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.911 0.036 18003
6641 1 11 . 1 1 66 66 LEU C C 67 178.334 178.334 178.655 -0.321 18003
6642 1 11 . 1 1 66 66 LEU CA C 67 57.846 57.846 58.170 -0.325 18003
6643 1 11 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.765 -0.662 18003
6644 1 11 . 1 1 66 66 LEU H H 67 8.648 8.648 8.681 -0.033 18003
6645 1 11 . 1 1 67 67 ARG N N 68 119.610 119.610 119.232 0.378 18003
6646 1 11 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.975 -0.032 18003
6647 1 11 . 1 1 67 67 ARG C C 68 178.807 178.807 178.942 -0.135 18003
6648 1 11 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.652 -0.275 18003
6649 1 11 . 1 1 67 67 ARG CB C 68 29.475 29.475 30.110 -0.635 18003
6650 1 11 . 1 1 67 67 ARG H H 68 7.607 7.607 8.046 -0.439 18003
6651 1 11 . 1 1 68 68 VAL N N 69 119.719 119.719 120.362 -0.643 18003
6652 1 11 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.728 -0.095 18003
6653 1 11 . 1 1 68 68 VAL C C 69 178.690 178.690 178.242 0.448 18003
6654 1 11 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.362 0.092 18003
6655 1 11 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.358 0.421 18003
6656 1 11 . 1 1 68 68 VAL H H 69 7.259 7.259 7.870 -0.611 18003
6657 1 11 . 1 1 69 69 LEU N N 70 117.532 117.532 120.051 -2.519 18003
6658 1 11 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.993 -0.045 18003
6659 1 11 . 1 1 69 69 LEU C C 70 179.144 179.144 178.826 0.318 18003
6660 1 11 . 1 1 69 69 LEU CA C 70 57.750 57.750 58.324 -0.574 18003
6661 1 11 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.220 0.640 18003
6662 1 11 . 1 1 69 69 LEU H H 70 8.375 8.375 8.318 0.057 18003
6663 1 11 . 1 1 70 70 ARG N N 71 122.498 122.498 120.088 2.410 18003
6664 1 11 . 1 1 70 70 ARG HA H 71 3.931 3.931 3.952 -0.021 18003
6665 1 11 . 1 1 70 70 ARG C C 71 180.499 180.499 178.781 1.718 18003
6666 1 11 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.482 -0.705 18003
6667 1 11 . 1 1 70 70 ARG CB C 71 30.155 30.155 29.986 0.169 18003
6668 1 11 . 1 1 70 70 ARG H H 71 8.822 8.822 8.641 0.181 18003
6669 1 11 . 1 1 71 71 ASN N N 72 121.816 121.816 117.883 3.933 18003
6670 1 11 . 1 1 71 71 ASN C C 72 177.170 177.170 177.225 -0.055 18003
6671 1 11 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.853 -0.076 18003
6672 1 11 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.577 -0.843 18003
6673 1 11 . 1 1 71 71 ASN H H 72 8.144 8.144 7.850 0.294 18003
6674 1 11 . 1 1 72 72 LEU N N 73 117.044 117.044 119.036 -1.992 18003
6675 1 11 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.231 0.114 18003
6676 1 11 . 1 1 72 72 LEU C C 73 176.984 176.984 178.017 -1.033 18003
6677 1 11 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.362 -1.237 18003
6678 1 11 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.422 0.847 18003
6679 1 11 . 1 1 72 72 LEU H H 73 7.804 7.804 7.700 0.104 18003
6680 1 11 . 1 1 73 73 GLY N N 74 106.621 106.621 104.878 1.743 18003
6681 1 11 . 1 1 73 73 GLY C C 74 173.266 173.266 174.393 -1.127 18003
6682 1 11 . 1 1 73 73 GLY CA C 74 46.022 46.022 44.995 1.027 18003
6683 1 11 . 1 1 73 73 GLY H H 74 7.851 7.851 8.495 -0.644 18003
6684 1 11 . 1 1 74 74 LEU N N 75 114.582 114.582 119.861 -5.279 18003
6685 1 11 . 1 1 74 74 LEU C C 75 177.562 177.562 176.266 1.296 18003
6686 1 11 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.329 0.702 18003
6687 1 11 . 1 1 74 74 LEU CB C 75 44.444 44.444 42.929 1.514 18003
6688 1 11 . 1 1 74 74 LEU H H 75 7.808 7.808 8.046 -0.238 18003
6689 1 11 . 1 1 75 75 VAL N N 76 110.980 110.980 112.536 -1.556 18003
6690 1 11 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.638 -0.111 18003
6691 1 11 . 1 1 75 75 VAL C C 76 173.922 173.922 174.226 -0.304 18003
6692 1 11 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.137 -2.194 18003
6693 1 11 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.763 0.266 18003
6694 1 11 . 1 1 75 75 VAL H H 76 7.079 7.079 7.314 -0.235 18003
6695 1 11 . 1 1 76 76 VAL N N 77 118.619 118.619 120.044 -1.425 18003
6696 1 11 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.580 0.722 18003
6697 1 11 . 1 1 76 76 VAL C C 77 174.041 174.041 174.395 -0.354 18003
6698 1 11 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.920 -0.922 18003
6699 1 11 . 1 1 76 76 VAL H H 77 9.024 9.024 9.317 -0.293 18003
6700 1 11 . 1 1 77 77 GLY N N 78 109.451 109.451 110.068 -0.617 18003
6701 1 11 . 1 1 77 77 GLY C C 78 172.225 172.225 172.501 -0.276 18003
6702 1 11 . 1 1 77 77 GLY CA C 78 44.462 44.462 44.080 0.382 18003
6703 1 11 . 1 1 77 77 GLY H H 78 8.265 8.265 8.433 -0.168 18003
6704 1 11 . 1 1 78 78 ASP N N 79 122.826 122.826 122.773 0.053 18003
6705 1 11 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.741 0.005 18003
6706 1 11 . 1 1 78 78 ASP C C 79 174.817 174.817 174.933 -0.116 18003
6707 1 11 . 1 1 78 78 ASP CA C 79 53.111 53.111 52.749 0.362 18003
6708 1 11 . 1 1 78 78 ASP CB C 79 43.655 43.655 43.045 0.610 18003
6709 1 11 . 1 1 78 78 ASP H H 79 8.479 8.479 8.488 -0.009 18003
6710 1 11 . 1 1 79 79 ARG N N 80 122.613 122.613 127.581 -4.968 18003
6711 1 11 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.126 0.286 18003
6712 1 11 . 1 1 79 79 ARG C C 80 175.546 175.546 175.234 0.312 18003
6713 1 11 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.351 -0.033 18003
6714 1 11 . 1 1 79 79 ARG CB C 80 30.376 30.376 30.691 -0.315 18003
6715 1 11 . 1 1 79 79 ARG H H 80 8.580 8.580 8.625 -0.045 18003
6716 1 11 . 1 1 80 80 ALA N N 81 129.263 129.263 130.437 -1.174 18003
6717 1 11 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.625 -0.173 18003
6718 1 11 . 1 1 80 80 ALA C C 81 177.126 177.126 176.737 0.389 18003
6719 1 11 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.434 0.186 18003
6720 1 11 . 1 1 80 80 ALA CB C 81 19.260 19.260 19.950 -0.690 18003
6721 1 11 . 1 1 80 80 ALA H H 81 8.396 8.396 8.796 -0.400 18003
6722 1 11 . 1 1 81 81 GLY N N 82 112.739 112.739 112.595 0.144 18003
6723 1 11 . 1 1 81 81 GLY C C 82 174.856 174.856 175.371 -0.515 18003
6724 1 11 . 1 1 81 81 GLY CA C 82 46.392 46.392 46.758 -0.366 18003
6725 1 11 . 1 1 81 81 GLY H H 82 8.641 8.641 8.563 0.078 18003
6726 1 11 . 1 1 82 82 ARG N N 83 124.780 124.780 123.924 0.856 18003
6727 1 11 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.499 -0.176 18003
6728 1 11 . 1 1 82 82 ARG C C 83 176.339 176.339 175.343 0.996 18003
6729 1 11 . 1 1 82 82 ARG CA C 83 56.690 56.690 55.593 1.097 18003
6730 1 11 . 1 1 82 82 ARG CB C 83 30.221 30.221 30.657 -0.435 18003
6731 1 11 . 1 1 82 82 ARG H H 83 8.728 8.728 8.426 0.302 18003
6732 1 11 . 1 1 83 83 SER N N 84 114.678 114.678 115.007 -0.329 18003
6733 1 11 . 1 1 83 83 SER C C 84 172.869 172.869 172.066 0.803 18003
6734 1 11 . 1 1 83 83 SER CA C 84 56.834 56.834 57.309 -0.475 18003
6735 1 11 . 1 1 83 83 SER CB C 84 65.191 65.191 65.567 -0.376 18003
6736 1 11 . 1 1 83 83 SER H H 84 7.821 7.821 8.087 -0.266 18003
6737 1 11 . 1 1 84 84 ILE N N 85 122.996 122.996 123.398 -0.402 18003
6738 1 11 . 1 1 84 84 ILE C C 85 175.521 175.521 173.631 1.890 18003
6739 1 11 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.039 1.196 18003
6740 1 11 . 1 1 84 84 ILE CB C 85 38.136 38.136 41.419 -3.283 18003
6741 1 11 . 1 1 84 84 ILE H H 85 8.232 8.232 8.347 -0.115 18003
6742 1 11 . 1 1 85 85 VAL N N 86 121.845 121.845 127.231 -5.386 18003
6743 1 11 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.159 0.151 18003
6744 1 11 . 1 1 85 85 VAL C C 86 174.818 174.818 174.263 0.555 18003
6745 1 11 . 1 1 85 85 VAL CA C 86 59.738 59.738 60.403 -0.665 18003
6746 1 11 . 1 1 85 85 VAL CB C 86 34.221 34.221 34.561 -0.340 18003
6747 1 11 . 1 1 85 85 VAL H H 86 8.495 8.495 8.273 0.222 18003
6748 1 11 . 1 1 86 86 TYR N N 87 125.020 125.020 127.177 -2.157 18003
6749 1 11 . 1 1 86 86 TYR HA H 87 4.319 4.319 4.929 -0.610 18003
6750 1 11 . 1 1 86 86 TYR C C 87 173.808 173.808 175.719 -1.911 18003
6751 1 11 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.728 -0.263 18003
6752 1 11 . 1 1 86 86 TYR CB C 87 41.480 41.480 39.777 1.703 18003
6753 1 11 . 1 1 86 86 TYR H H 87 8.488 8.488 8.740 -0.252 18003
6754 1 11 . 1 1 87 87 SER N N 88 110.681 110.681 115.375 -4.694 18003
6755 1 11 . 1 1 87 87 SER HA H 88 5.414 5.414 4.847 0.567 18003
6756 1 11 . 1 1 87 87 SER C C 88 174.693 174.693 173.419 1.274 18003
6757 1 11 . 1 1 87 87 SER CA C 88 56.113 56.113 56.152 -0.039 18003
6758 1 11 . 1 1 87 87 SER CB C 88 66.309 66.309 66.114 0.195 18003
6759 1 11 . 1 1 87 87 SER H H 88 8.718 8.718 9.248 -0.530 18003
6760 1 11 . 1 1 88 88 LEU N N 89 119.612 119.612 122.319 -2.707 18003
6761 1 11 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.283 0.644 18003
6762 1 11 . 1 1 88 88 LEU C C 89 179.031 179.031 178.240 0.791 18003
6763 1 11 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.760 -0.435 18003
6764 1 11 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.080 -0.360 18003
6765 1 11 . 1 1 88 88 LEU H H 89 9.034 9.034 8.555 0.479 18003
6766 1 11 . 1 1 89 89 TYR N N 90 120.540 120.540 124.911 -4.371 18003
6767 1 11 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.147 0.475 18003
6768 1 11 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.649 1.063 18003
6769 1 11 . 1 1 89 89 TYR H H 90 8.075 8.075 8.613 -0.538 18003
6770 1 11 . 1 1 92 92 HIS C C 93 177.850 177.850 177.558 0.292 18003
6771 1 11 . 1 1 93 93 VAL N N 94 120.211 120.211 118.849 1.362 18003
6772 1 11 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.747 -0.246 18003
6773 1 11 . 1 1 93 93 VAL C C 94 176.785 176.785 177.323 -0.538 18003
6774 1 11 . 1 1 93 93 VAL CA C 94 66.666 66.666 65.808 0.858 18003
6775 1 11 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.724 -0.088 18003
6776 1 11 . 1 1 93 93 VAL H H 94 8.164 8.164 7.976 0.188 18003
6777 1 11 . 1 1 94 94 ALA N N 95 119.221 119.221 120.477 -1.256 18003
6778 1 11 . 1 1 94 94 ALA HA H 95 3.790 3.790 4.035 -0.245 18003
6779 1 11 . 1 1 94 94 ALA C C 95 177.979 177.979 179.663 -1.684 18003
6780 1 11 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.269 0.210 18003
6781 1 11 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.087 0.023 18003
6782 1 11 . 1 1 94 94 ALA H H 95 6.942 6.942 7.905 -0.963 18003
6783 1 11 . 1 1 95 95 GLN N N 96 115.416 115.416 118.821 -3.405 18003
6784 1 11 . 1 1 95 95 GLN HA H 96 4.035 4.035 3.967 0.068 18003
6785 1 11 . 1 1 95 95 GLN C C 96 177.993 177.993 178.525 -0.532 18003
6786 1 11 . 1 1 95 95 GLN CA C 96 58.842 58.842 59.050 -0.208 18003
6787 1 11 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.580 -0.551 18003
6788 1 11 . 1 1 95 95 GLN H H 96 7.795 7.795 8.005 -0.210 18003
6789 1 11 . 1 1 96 96 LEU N N 97 120.758 120.758 120.259 0.499 18003
6790 1 11 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.062 -0.213 18003
6791 1 11 . 1 1 96 96 LEU C C 97 177.974 177.974 179.111 -1.137 18003
6792 1 11 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.122 1.160 18003
6793 1 11 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.325 -0.279 18003
6794 1 11 . 1 1 96 96 LEU H H 97 8.197 8.197 7.842 0.355 18003
6795 1 11 . 1 1 97 97 LEU N N 98 117.567 117.567 120.419 -2.852 18003
6796 1 11 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.939 -0.109 18003
6797 1 11 . 1 1 97 97 LEU C C 98 178.219 178.219 178.487 -0.268 18003
6798 1 11 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.570 -0.840 18003
6799 1 11 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.629 0.233 18003
6800 1 11 . 1 1 97 97 LEU H H 98 7.660 7.660 8.019 -0.359 18003
6801 1 11 . 1 1 98 98 ASP N N 99 118.607 118.607 119.622 -1.015 18003
6802 1 11 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.291 -0.182 18003
6803 1 11 . 1 1 98 98 ASP C C 99 179.382 179.382 178.775 0.607 18003
6804 1 11 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.894 0.141 18003
6805 1 11 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.574 -0.735 18003
6806 1 11 . 1 1 98 98 ASP H H 99 8.295 8.295 8.442 -0.147 18003
6807 1 11 . 1 1 99 99 GLU N N 100 117.542 117.542 119.895 -2.353 18003
6808 1 11 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.206 -0.357 18003
6809 1 11 . 1 1 99 99 GLU C C 100 179.389 179.389 178.789 0.600 18003
6810 1 11 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.145 -1.122 18003
6811 1 11 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.521 -0.492 18003
6812 1 11 . 1 1 99 99 GLU H H 100 8.334 8.334 7.957 0.377 18003
6813 1 11 . 1 1 100 100 ALA N N 101 122.890 122.890 123.053 -0.163 18003
6814 1 11 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.042 -0.044 18003
6815 1 11 . 1 1 100 100 ALA C C 101 180.184 180.184 179.799 0.385 18003
6816 1 11 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.598 -0.078 18003
6817 1 11 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.438 -0.819 18003
6818 1 11 . 1 1 100 100 ALA H H 101 8.550 8.550 8.428 0.122 18003
6819 1 11 . 1 1 101 101 ILE N N 102 119.952 119.952 118.754 1.198 18003
6820 1 11 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.779 -0.190 18003
6821 1 11 . 1 1 101 101 ILE C C 102 178.114 178.114 177.745 0.369 18003
6822 1 11 . 1 1 101 101 ILE CA C 102 65.376 65.376 65.020 0.356 18003
6823 1 11 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.056 0.973 18003
6824 1 11 . 1 1 101 101 ILE H H 102 8.493 8.493 8.619 -0.126 18003
6825 1 11 . 1 1 102 102 TYR N N 103 120.625 120.625 121.407 -0.782 18003
6826 1 11 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.080 0.091 18003
6827 1 11 . 1 1 102 102 TYR C C 103 179.772 179.772 177.549 2.223 18003
6828 1 11 . 1 1 102 102 TYR CA C 103 60.724 60.724 62.126 -1.401 18003
6829 1 11 . 1 1 102 102 TYR CB C 103 37.500 37.500 38.294 -0.794 18003
6830 1 11 . 1 1 102 102 TYR H H 103 8.520 8.520 8.204 0.316 18003
6831 1 11 . 1 1 103 103 HIS N N 104 117.456 117.456 118.847 -1.391 18003
6832 1 11 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.225 0.200 18003
6833 1 11 . 1 1 103 103 HIS C C 104 176.377 176.377 177.585 -1.208 18003
6834 1 11 . 1 1 103 103 HIS CA C 104 60.043 60.043 59.394 0.649 18003
6835 1 11 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.969 -0.940 18003
6836 1 11 . 1 1 103 103 HIS H H 104 8.622 8.622 8.884 -0.262 18003
6837 1 11 . 1 1 104 104 SER N N 105 113.596 113.596 114.344 -0.748 18003
6838 1 11 . 1 1 104 104 SER C C 105 176.712 176.712 176.467 0.245 18003
6839 1 11 . 1 1 104 104 SER CA C 105 61.852 61.852 61.732 0.120 18003
6840 1 11 . 1 1 104 104 SER CB C 105 63.550 63.550 63.152 0.398 18003
6841 1 11 . 1 1 104 104 SER H H 105 7.900 7.900 8.352 -0.452 18003
6842 1 11 . 1 1 105 105 GLU N N 106 119.022 119.022 119.438 -0.416 18003
6843 1 11 . 1 1 105 105 GLU HA H 106 4.013 4.013 4.076 -0.063 18003
6844 1 11 . 1 1 105 105 GLU C C 106 177.902 177.902 177.942 -0.040 18003
6845 1 11 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.284 -0.253 18003
6846 1 11 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.900 -0.621 18003
6847 1 11 . 1 1 105 105 GLU H H 106 8.181 8.181 7.778 0.403 18003
6848 1 11 . 1 1 106 106 HIS N N 107 116.482 116.482 116.171 0.311 18003
6849 1 11 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.076 0.331 18003
6850 1 11 . 1 1 106 106 HIS C C 107 175.575 175.575 175.173 0.402 18003
6851 1 11 . 1 1 106 106 HIS CA C 107 57.343 57.343 57.999 -0.656 18003
6852 1 11 . 1 1 106 106 HIS CB C 107 28.580 28.580 29.381 -0.801 18003
6853 1 11 . 1 1 106 106 HIS H H 107 7.770 7.770 7.843 -0.073 18003
6854 1 11 . 1 1 107 107 LEU N N 108 120.346 120.346 115.766 4.580 18003
6855 1 11 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.160 -0.106 18003
6856 1 11 . 1 1 107 107 LEU C C 108 177.404 177.404 176.047 1.357 18003
6857 1 11 . 1 1 107 107 LEU CA C 108 55.991 55.991 54.807 1.184 18003
6858 1 11 . 1 1 107 107 LEU CB C 108 42.030 42.030 43.775 -1.745 18003
6859 1 11 . 1 1 107 107 LEU H H 108 7.682 7.682 7.024 0.658 18003
6860 1 11 . 1 1 108 108 HIS N N 109 117.222 117.222 118.625 -1.403 18003
6861 1 11 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.251 -0.197 18003
6862 1 11 . 1 1 108 108 HIS C C 109 174.606 174.606 175.191 -0.585 18003
6863 1 11 . 1 1 108 108 HIS CA C 109 56.029 56.029 56.063 -0.034 18003
6864 1 11 . 1 1 108 108 HIS CB C 109 28.517 28.517 28.733 -0.216 18003
6865 1 11 . 1 1 108 108 HIS H H 109 8.030 8.030 7.898 0.132 18003
6866 1 11 . 1 1 109 109 LEU N N 110 121.114 121.114 124.230 -3.116 18003
6867 1 11 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.155 0.143 18003
6868 1 11 . 1 1 109 109 LEU C C 110 178.028 178.028 176.855 1.173 18003
6869 1 11 . 1 1 109 109 LEU CA C 110 55.574 55.574 55.787 -0.213 18003
6870 1 11 . 1 1 109 109 LEU CB C 110 42.076 42.076 42.373 -0.297 18003
6871 1 11 . 1 1 109 109 LEU H H 110 7.973 7.973 8.357 -0.384 18003
6872 1 11 . 1 1 110 110 GLY N N 111 108.631 108.631 106.596 2.035 18003
6873 1 11 . 1 1 110 110 GLY C C 111 174.606 174.606 173.839 0.767 18003
6874 1 11 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.681 0.899 18003
6875 1 11 . 1 1 110 110 GLY H H 111 8.255 8.255 7.635 0.620 18003
6876 1 11 . 1 1 111 111 LEU N N 112 121.022 121.022 121.662 -0.640 18003
6877 1 11 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.737 -0.378 18003
6878 1 11 . 1 1 111 111 LEU C C 112 177.701 177.701 175.092 2.609 18003
6879 1 11 . 1 1 111 111 LEU CA C 112 55.476 55.476 54.246 1.230 18003
6880 1 11 . 1 1 111 111 LEU CB C 112 41.899 41.899 44.194 -2.295 18003
6881 1 11 . 1 1 111 111 LEU H H 112 7.981 7.981 7.928 0.053 18003
6882 1 11 . 1 1 112 112 SER N N 113 115.471 115.471 115.530 -0.059 18003
6883 1 11 . 1 1 112 112 SER HA H 113 4.432 4.432 4.469 -0.037 18003
6884 1 11 . 1 1 112 112 SER C C 113 174.381 174.381 173.150 1.231 18003
6885 1 11 . 1 1 112 112 SER CA C 113 58.527 58.527 57.873 0.654 18003
6886 1 11 . 1 1 112 112 SER CB C 113 63.593 63.593 63.356 0.237 18003
6887 1 11 . 1 1 112 112 SER H H 113 8.215 8.215 8.540 -0.325 18003
6888 1 11 . 1 1 113 113 ASP N N 114 121.696 121.696 121.482 0.214 18003
6889 1 11 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.685 -0.258 18003
6890 1 11 . 1 1 113 113 ASP C C 114 175.958 175.958 176.193 -0.235 18003
6891 1 11 . 1 1 113 113 ASP CA C 114 54.213 54.213 53.643 0.570 18003
6892 1 11 . 1 1 113 113 ASP CB C 114 41.030 41.030 41.249 -0.219 18003
6893 1 11 . 1 1 113 113 ASP H H 114 8.203 8.203 7.936 0.267 18003
6894 1 11 . 1 1 114 114 ARG N N 115 120.088 120.088 119.867 0.221 18003
6895 1 11 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.279 -0.007 18003
6896 1 11 . 1 1 114 114 ARG C C 115 175.792 175.792 176.265 -0.473 18003
6897 1 11 . 1 1 114 114 ARG CA C 115 55.735 55.735 55.560 0.175 18003
6898 1 11 . 1 1 114 114 ARG CB C 115 30.586 30.586 30.706 -0.120 18003
6899 1 11 . 1 1 114 114 ARG H H 115 8.016 8.016 8.315 -0.299 18003
6900 1 11 . 1 1 115 115 HIS N N 116 120.597 120.597 121.191 -0.594 18003
6901 1 11 . 1 1 115 115 HIS CA C 116 53.697 53.697 56.079 -2.382 18003
6902 1 11 . 1 1 115 115 HIS CB C 116 29.299 29.299 30.254 -0.955 18003
6903 1 11 . 1 1 115 115 HIS H H 116 8.385 8.385 8.344 0.041 18003
6904 1 11 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.417 0.065 18003
6905 1 11 . 1 1 116 116 PRO C C 117 177.090 177.090 177.230 -0.140 18003
6906 1 11 . 1 1 116 116 PRO CA C 117 63.177 63.177 63.469 -0.292 18003
6907 1 11 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.109 -0.290 18003
6908 1 11 . 1 1 117 117 SER N N 118 116.220 116.220 115.411 0.809 18003
6909 1 11 . 1 1 117 117 SER HA H 118 4.465 4.465 4.035 0.430 18003
6910 1 11 . 1 1 117 117 SER C C 118 174.287 174.287 174.827 -0.540 18003
6911 1 11 . 1 1 117 117 SER CA C 118 58.110 58.110 59.223 -1.113 18003
6912 1 11 . 1 1 117 117 SER CB C 118 63.750 63.750 62.655 1.095 18003
6913 1 11 . 1 1 117 117 SER H H 118 8.487 8.487 8.343 0.144 18003
6914 1 11 . 1 1 118 118 ALA N N 119 126.082 126.082 124.138 1.944 18003
6915 1 11 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.112 0.327 18003
6916 1 11 . 1 1 118 118 ALA C C 119 176.879 176.879 177.297 -0.418 18003
6917 1 11 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.844 -0.395 18003
6918 1 11 . 1 1 118 118 ALA CB C 119 19.483 19.483 18.600 0.883 18003
6919 1 11 . 1 1 118 118 ALA H H 119 8.295 8.295 8.384 -0.089 18003
6920 1 12 . 1 1 2 2 HIS C C 3 175.176 175.176 176.621 -1.445 18003
6921 1 12 . 1 1 2 2 HIS CA C 3 55.900 55.900 56.412 -0.512 18003
6922 1 12 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.394 -0.365 18003
6923 1 12 . 1 1 3 3 GLY N N 4 110.613 110.613 108.485 2.128 18003
6924 1 12 . 1 1 3 3 GLY C C 4 174.068 174.068 173.972 0.096 18003
6925 1 12 . 1 1 3 3 GLY CA C 4 45.141 45.141 44.664 0.477 18003
6926 1 12 . 1 1 3 3 GLY H H 4 8.500 8.500 8.133 0.367 18003
6927 1 12 . 1 1 4 4 VAL N N 5 119.318 119.318 117.923 1.395 18003
6928 1 12 . 1 1 4 4 VAL HA H 5 4.128 4.128 4.515 -0.387 18003
6929 1 12 . 1 1 4 4 VAL C C 5 176.361 176.361 174.985 1.376 18003
6930 1 12 . 1 1 4 4 VAL CA C 5 61.987 61.987 61.435 0.552 18003
6931 1 12 . 1 1 4 4 VAL CB C 5 32.635 32.635 34.027 -1.392 18003
6932 1 12 . 1 1 4 4 VAL H H 5 8.094 8.094 7.900 0.194 18003
6933 1 12 . 1 1 5 5 GLU N N 6 124.369 124.369 126.619 -2.250 18003
6934 1 12 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.466 -0.178 18003
6935 1 12 . 1 1 5 5 GLU C C 6 177.012 177.012 176.618 0.394 18003
6936 1 12 . 1 1 5 5 GLU CA C 6 56.699 56.699 55.788 0.912 18003
6937 1 12 . 1 1 5 5 GLU CB C 6 30.029 30.029 30.433 -0.404 18003
6938 1 12 . 1 1 5 5 GLU H H 6 8.545 8.545 8.660 -0.115 18003
6939 1 12 . 1 1 6 6 GLY N N 7 109.747 109.747 111.078 -1.331 18003
6940 1 12 . 1 1 6 6 GLY C C 7 174.117 174.117 174.453 -0.336 18003
6941 1 12 . 1 1 6 6 GLY CA C 7 45.568 45.568 44.747 0.821 18003
6942 1 12 . 1 1 6 6 GLY H H 7 8.352 8.352 8.558 -0.206 18003
6943 1 12 . 1 1 7 7 ARG N N 8 120.059 120.059 122.827 -2.768 18003
6944 1 12 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.337 0.005 18003
6945 1 12 . 1 1 7 7 ARG C C 8 176.016 176.016 176.051 -0.035 18003
6946 1 12 . 1 1 7 7 ARG CA C 8 55.833 55.833 55.771 0.062 18003
6947 1 12 . 1 1 7 7 ARG CB C 8 30.444 30.444 31.525 -1.081 18003
6948 1 12 . 1 1 7 7 ARG H H 8 8.084 8.084 8.476 -0.392 18003
6949 1 12 . 1 1 8 8 ASN N N 9 119.379 119.379 120.303 -0.924 18003
6950 1 12 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.695 -0.363 18003
6951 1 12 . 1 1 8 8 ASN C C 9 174.667 174.667 175.418 -0.751 18003
6952 1 12 . 1 1 8 8 ASN CA C 9 53.441 53.441 53.042 0.399 18003
6953 1 12 . 1 1 8 8 ASN CB C 9 38.480 38.480 39.122 -0.642 18003
6954 1 12 . 1 1 8 8 ASN H H 9 8.411 8.411 8.498 -0.087 18003
6955 1 12 . 1 1 9 9 ARG N N 10 121.700 121.700 123.204 -1.504 18003
6956 1 12 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.480 0.169 18003
6957 1 12 . 1 1 9 9 ARG CA C 10 53.147 53.147 54.352 -1.206 18003
6958 1 12 . 1 1 9 9 ARG CB C 10 30.197 30.197 29.754 0.443 18003
6959 1 12 . 1 1 9 9 ARG H H 10 8.138 8.138 8.540 -0.402 18003
6960 1 12 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.476 -0.033 18003
6961 1 12 . 1 1 10 10 PRO C C 11 176.815 176.815 176.474 0.341 18003
6962 1 12 . 1 1 10 10 PRO CA C 11 63.177 63.177 62.496 0.681 18003
6963 1 12 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.592 -0.772 18003
6964 1 12 . 1 1 11 11 SER N N 12 116.291 116.291 117.073 -0.782 18003
6965 1 12 . 1 1 11 11 SER HA H 12 4.418 4.418 4.186 0.232 18003
6966 1 12 . 1 1 11 11 SER C C 12 173.702 173.702 173.894 -0.192 18003
6967 1 12 . 1 1 11 11 SER CA C 12 58.031 58.031 59.723 -1.692 18003
6968 1 12 . 1 1 11 11 SER CB C 12 64.032 64.032 62.790 1.242 18003
6969 1 12 . 1 1 11 11 SER H H 12 8.325 8.325 8.433 -0.108 18003
6970 1 12 . 1 1 12 12 ALA N N 13 126.862 126.862 129.079 -2.217 18003
6971 1 12 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.483 -0.095 18003
6972 1 12 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.735 -1.277 18003
6973 1 12 . 1 1 12 12 ALA CB C 13 18.257 18.257 19.329 -1.072 18003
6974 1 12 . 1 1 12 12 ALA H H 13 8.166 8.166 8.209 -0.043 18003
6975 1 12 . 1 1 13 13 PRO C C 14 176.368 176.368 176.101 0.267 18003
6976 1 12 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.711 0.226 18003
6977 1 12 . 1 1 13 13 PRO CB C 14 32.022 32.022 29.971 2.050 18003
6978 1 12 . 1 1 14 14 LEU N N 15 120.969 120.969 121.801 -0.832 18003
6979 1 12 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.273 -0.015 18003
6980 1 12 . 1 1 14 14 LEU C C 15 176.124 176.124 178.415 -2.291 18003
6981 1 12 . 1 1 14 14 LEU CA C 15 54.527 54.527 54.757 -0.230 18003
6982 1 12 . 1 1 14 14 LEU CB C 15 43.418 43.418 42.136 1.282 18003
6983 1 12 . 1 1 14 14 LEU H H 15 7.875 7.875 7.812 0.063 18003
6984 1 12 . 1 1 15 15 ASP N N 16 121.780 121.780 122.342 -0.562 18003
6985 1 12 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.163 0.430 18003
6986 1 12 . 1 1 15 15 ASP C C 16 176.208 176.208 178.472 -2.264 18003
6987 1 12 . 1 1 15 15 ASP CA C 16 52.468 52.468 57.696 -5.228 18003
6988 1 12 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.652 0.977 18003
6989 1 12 . 1 1 15 15 ASP H H 16 7.850 7.850 8.874 -1.024 18003
6990 1 12 . 1 1 16 16 SER N N 17 114.435 114.435 113.925 0.510 18003
6991 1 12 . 1 1 16 16 SER HA H 17 4.120 4.120 4.108 0.012 18003
6992 1 12 . 1 1 16 16 SER C C 17 177.207 177.207 176.697 0.510 18003
6993 1 12 . 1 1 16 16 SER CA C 17 62.322 62.322 61.084 1.238 18003
6994 1 12 . 1 1 16 16 SER H H 17 8.658 8.658 8.072 0.586 18003
6995 1 12 . 1 1 17 17 GLN N N 18 122.403 122.403 119.750 2.653 18003
6996 1 12 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.068 0.129 18003
6997 1 12 . 1 1 17 17 GLN C C 18 178.715 178.715 178.356 0.359 18003
6998 1 12 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.382 -0.269 18003
6999 1 12 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.261 -0.220 18003
7000 1 12 . 1 1 17 17 GLN H H 18 8.140 8.140 8.617 -0.477 18003
7001 1 12 . 1 1 18 18 ALA N N 19 124.743 124.743 121.655 3.088 18003
7002 1 12 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.051 0.125 18003
7003 1 12 . 1 1 18 18 ALA C C 19 180.616 180.616 179.339 1.277 18003
7004 1 12 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.707 -0.102 18003
7005 1 12 . 1 1 18 18 ALA CB C 19 19.028 19.028 18.133 0.895 18003
7006 1 12 . 1 1 18 18 ALA H H 19 8.455 8.455 7.617 0.838 18003
7007 1 12 . 1 1 19 19 ALA N N 20 119.089 119.089 121.071 -1.982 18003
7008 1 12 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.065 0.114 18003
7009 1 12 . 1 1 19 19 ALA C C 20 179.239 179.239 179.345 -0.106 18003
7010 1 12 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.814 0.457 18003
7011 1 12 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.311 -0.119 18003
7012 1 12 . 1 1 19 19 ALA H H 20 8.993 8.993 8.088 0.905 18003
7013 1 12 . 1 1 20 20 ALA N N 21 119.226 119.226 121.235 -2.009 18003
7014 1 12 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.924 0.137 18003
7015 1 12 . 1 1 20 20 ALA C C 21 180.230 180.230 179.924 0.306 18003
7016 1 12 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.124 0.019 18003
7017 1 12 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.070 -0.042 18003
7018 1 12 . 1 1 20 20 ALA H H 21 7.724 7.724 7.881 -0.157 18003
7019 1 12 . 1 1 21 21 GLN N N 22 119.310 119.310 118.440 0.870 18003
7020 1 12 . 1 1 21 21 GLN HA H 22 4.129 4.129 3.947 0.182 18003
7021 1 12 . 1 1 21 21 GLN C C 22 179.319 179.319 178.628 0.691 18003
7022 1 12 . 1 1 21 21 GLN CA C 22 58.762 58.762 58.923 -0.161 18003
7023 1 12 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.739 -0.710 18003
7024 1 12 . 1 1 21 21 GLN H H 22 7.638 7.638 8.279 -0.641 18003
7025 1 12 . 1 1 22 22 VAL N N 23 121.565 121.565 120.397 1.168 18003
7026 1 12 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.723 0.243 18003
7027 1 12 . 1 1 22 22 VAL C C 23 178.026 178.026 178.052 -0.026 18003
7028 1 12 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.109 0.033 18003
7029 1 12 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.295 -0.329 18003
7030 1 12 . 1 1 22 22 VAL H H 23 8.442 8.442 7.882 0.560 18003
7031 1 12 . 1 1 23 23 ALA N N 24 121.400 121.400 121.699 -0.299 18003
7032 1 12 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.925 0.171 18003
7033 1 12 . 1 1 23 23 ALA C C 24 178.758 178.758 179.739 -0.981 18003
7034 1 12 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.421 0.494 18003
7035 1 12 . 1 1 23 23 ALA CB C 24 16.650 16.650 17.921 -1.271 18003
7036 1 12 . 1 1 23 23 ALA H H 24 8.495 8.495 8.395 0.100 18003
7037 1 12 . 1 1 24 24 SER N N 25 112.138 112.138 113.278 -1.140 18003
7038 1 12 . 1 1 24 24 SER HA H 25 4.093 4.093 4.142 -0.049 18003
7039 1 12 . 1 1 24 24 SER C C 25 177.271 177.271 176.672 0.599 18003
7040 1 12 . 1 1 24 24 SER CA C 25 62.166 62.166 61.662 0.504 18003
7041 1 12 . 1 1 24 24 SER CB C 25 63.032 63.032 63.142 -0.110 18003
7042 1 12 . 1 1 24 24 SER H H 25 7.936 7.936 8.382 -0.446 18003
7043 1 12 . 1 1 25 25 THR N N 26 119.701 119.701 117.359 2.342 18003
7044 1 12 . 1 1 25 25 THR HA H 26 4.380 4.380 4.022 0.358 18003
7045 1 12 . 1 1 25 25 THR C C 26 175.456 175.456 176.515 -1.059 18003
7046 1 12 . 1 1 25 25 THR CA C 26 67.129 67.129 65.811 1.318 18003
7047 1 12 . 1 1 25 25 THR CB C 26 68.800 68.800 68.393 0.407 18003
7048 1 12 . 1 1 25 25 THR H H 26 7.775 7.775 7.809 -0.034 18003
7049 1 12 . 1 1 26 26 LEU N N 27 119.270 119.270 121.250 -1.980 18003
7050 1 12 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.019 -0.456 18003
7051 1 12 . 1 1 26 26 LEU C C 27 178.390 178.390 179.324 -0.934 18003
7052 1 12 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.414 0.255 18003
7053 1 12 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.176 0.854 18003
7054 1 12 . 1 1 26 26 LEU H H 27 8.006 8.006 8.405 -0.399 18003
7055 1 12 . 1 1 27 27 GLN N N 28 115.843 115.843 119.578 -3.735 18003
7056 1 12 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.061 -0.257 18003
7057 1 12 . 1 1 27 27 GLN C C 28 178.657 178.657 177.281 1.376 18003
7058 1 12 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.424 0.288 18003
7059 1 12 . 1 1 27 27 GLN CB C 28 28.029 28.029 29.022 -0.993 18003
7060 1 12 . 1 1 27 27 GLN H H 28 8.485 8.485 8.056 0.429 18003
7061 1 12 . 1 1 28 28 ALA N N 29 118.779 118.779 121.843 -3.064 18003
7062 1 12 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.049 -0.041 18003
7063 1 12 . 1 1 28 28 ALA C C 29 178.259 178.259 179.843 -1.584 18003
7064 1 12 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.724 -0.762 18003
7065 1 12 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.843 -0.105 18003
7066 1 12 . 1 1 28 28 ALA H H 29 7.432 7.432 7.847 -0.415 18003
7067 1 12 . 1 1 29 29 LEU N N 30 113.442 113.442 117.871 -4.429 18003
7068 1 12 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.995 0.001 18003
7069 1 12 . 1 1 29 29 LEU C C 30 175.924 175.924 177.000 -1.076 18003
7070 1 12 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.720 -1.156 18003
7071 1 12 . 1 1 29 29 LEU CB C 30 42.266 42.266 40.793 1.473 18003
7072 1 12 . 1 1 29 29 LEU H H 30 7.311 7.311 8.046 -0.735 18003
7073 1 12 . 1 1 30 30 ALA N N 31 119.563 119.563 117.579 1.984 18003
7074 1 12 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.221 -0.049 18003
7075 1 12 . 1 1 30 30 ALA C C 31 176.316 176.316 176.288 0.028 18003
7076 1 12 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.090 -1.433 18003
7077 1 12 . 1 1 30 30 ALA CB C 31 18.077 18.077 19.311 -1.234 18003
7078 1 12 . 1 1 30 30 ALA H H 31 7.223 7.223 7.185 0.038 18003
7079 1 12 . 1 1 31 31 THR N N 32 114.613 114.613 109.468 5.145 18003
7080 1 12 . 1 1 31 31 THR HA H 32 4.950 4.950 4.218 0.732 18003
7081 1 12 . 1 1 31 31 THR CA C 32 58.129 58.129 62.423 -4.294 18003
7082 1 12 . 1 1 31 31 THR CB C 32 69.098 69.098 66.988 2.110 18003
7083 1 12 . 1 1 31 31 THR H H 32 8.399 8.399 8.159 0.240 18003
7084 1 12 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.208 0.230 18003
7085 1 12 . 1 1 32 32 PRO C C 33 178.207 178.207 178.892 -0.685 18003
7086 1 12 . 1 1 32 32 PRO CA C 33 66.905 66.905 65.635 1.270 18003
7087 1 12 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.751 -0.487 18003
7088 1 12 . 1 1 33 33 SER N N 34 110.767 110.767 111.988 -1.221 18003
7089 1 12 . 1 1 33 33 SER HA H 34 4.026 4.026 4.109 -0.083 18003
7090 1 12 . 1 1 33 33 SER C C 34 176.742 176.742 176.533 0.209 18003
7091 1 12 . 1 1 33 33 SER CA C 34 61.782 61.782 61.461 0.321 18003
7092 1 12 . 1 1 33 33 SER CB C 34 62.432 62.432 62.691 -0.259 18003
7093 1 12 . 1 1 33 33 SER H H 34 8.407 8.407 8.438 -0.031 18003
7094 1 12 . 1 1 34 34 ARG N N 35 120.135 120.135 121.624 -1.489 18003
7095 1 12 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.048 0.006 18003
7096 1 12 . 1 1 34 34 ARG C C 35 178.283 178.283 178.847 -0.564 18003
7097 1 12 . 1 1 34 34 ARG CA C 35 60.532 60.532 59.244 1.288 18003
7098 1 12 . 1 1 34 34 ARG CB C 35 28.953 28.953 30.032 -1.079 18003
7099 1 12 . 1 1 34 34 ARG H H 35 7.341 7.341 7.554 -0.213 18003
7100 1 12 . 1 1 35 35 LEU N N 36 118.454 118.454 121.104 -2.650 18003
7101 1 12 . 1 1 35 35 LEU HA H 36 4.054 4.054 4.037 0.017 18003
7102 1 12 . 1 1 35 35 LEU C C 36 180.643 180.643 178.884 1.759 18003
7103 1 12 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.085 -0.276 18003
7104 1 12 . 1 1 35 35 LEU CB C 36 41.778 41.778 41.206 0.571 18003
7105 1 12 . 1 1 35 35 LEU H H 36 8.226 8.226 8.087 0.139 18003
7106 1 12 . 1 1 36 36 MET N N 37 121.073 121.073 119.632 1.441 18003
7107 1 12 . 1 1 36 36 MET HA H 37 3.928 3.928 4.003 -0.075 18003
7108 1 12 . 1 1 36 36 MET C C 37 177.671 177.671 178.668 -0.997 18003
7109 1 12 . 1 1 36 36 MET CA C 37 60.613 60.613 59.400 1.213 18003
7110 1 12 . 1 1 36 36 MET CB C 37 33.128 33.128 32.662 0.466 18003
7111 1 12 . 1 1 36 36 MET H H 37 8.447 8.447 8.251 0.196 18003
7112 1 12 . 1 1 37 37 ILE N N 38 118.239 118.239 119.545 -1.306 18003
7113 1 12 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.724 -0.284 18003
7114 1 12 . 1 1 37 37 ILE C C 38 177.092 177.092 178.310 -1.218 18003
7115 1 12 . 1 1 37 37 ILE CA C 38 65.675 65.675 63.975 1.700 18003
7116 1 12 . 1 1 37 37 ILE CB C 38 38.255 38.255 36.686 1.569 18003
7117 1 12 . 1 1 37 37 ILE H H 38 7.763 7.763 8.083 -0.320 18003
7118 1 12 . 1 1 38 38 LEU N N 39 116.073 116.073 120.551 -4.478 18003
7119 1 12 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.908 -0.082 18003
7120 1 12 . 1 1 38 38 LEU C C 39 178.941 178.941 179.088 -0.147 18003
7121 1 12 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.535 -0.504 18003
7122 1 12 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.480 0.300 18003
7123 1 12 . 1 1 38 38 LEU H H 39 8.538 8.538 8.683 -0.145 18003
7124 1 12 . 1 1 39 39 THR N N 40 106.678 106.678 115.231 -8.553 18003
7125 1 12 . 1 1 39 39 THR HA H 40 3.932 3.932 3.980 -0.048 18003
7126 1 12 . 1 1 39 39 THR C C 40 177.747 177.747 176.764 0.983 18003
7127 1 12 . 1 1 39 39 THR CA C 40 65.536 65.536 67.136 -1.600 18003
7128 1 12 . 1 1 39 39 THR CB C 40 68.360 68.360 68.307 0.053 18003
7129 1 12 . 1 1 39 39 THR H H 40 8.086 8.086 8.511 -0.425 18003
7130 1 12 . 1 1 40 40 GLN N N 41 122.344 122.344 121.190 1.154 18003
7131 1 12 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.104 -0.098 18003
7132 1 12 . 1 1 40 40 GLN C C 41 178.348 178.348 178.470 -0.122 18003
7133 1 12 . 1 1 40 40 GLN CA C 41 57.925 57.925 59.005 -1.081 18003
7134 1 12 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.232 -0.712 18003
7135 1 12 . 1 1 40 40 GLN H H 41 7.593 7.593 7.743 -0.150 18003
7136 1 12 . 1 1 41 41 LEU N N 42 116.302 116.302 119.136 -2.834 18003
7137 1 12 . 1 1 41 41 LEU C C 42 178.418 178.418 178.699 -0.281 18003
7138 1 12 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.277 -1.746 18003
7139 1 12 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.848 -0.499 18003
7140 1 12 . 1 1 41 41 LEU H H 42 7.570 7.570 8.019 -0.449 18003
7141 1 12 . 1 1 42 42 ARG N N 43 119.954 119.954 117.212 2.742 18003
7142 1 12 . 1 1 42 42 ARG HA H 43 3.915 3.915 4.087 -0.172 18003
7143 1 12 . 1 1 42 42 ARG C C 43 177.205 177.205 178.880 -1.675 18003
7144 1 12 . 1 1 42 42 ARG CA C 43 58.704 58.704 58.070 0.634 18003
7145 1 12 . 1 1 42 42 ARG CB C 43 29.443 29.443 29.988 -0.545 18003
7146 1 12 . 1 1 42 42 ARG H H 43 7.612 7.612 8.109 -0.497 18003
7147 1 12 . 1 1 43 43 ASN N N 44 114.682 114.682 117.079 -2.397 18003
7148 1 12 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.552 0.208 18003
7149 1 12 . 1 1 43 43 ASN C C 44 174.507 174.507 176.022 -1.515 18003
7150 1 12 . 1 1 43 43 ASN CA C 44 53.953 53.953 55.019 -1.066 18003
7151 1 12 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.178 -0.148 18003
7152 1 12 . 1 1 43 43 ASN H H 44 7.567 7.567 8.063 -0.496 18003
7153 1 12 . 1 1 44 44 GLY N N 45 109.113 109.113 105.601 3.512 18003
7154 1 12 . 1 1 44 44 GLY CA C 45 44.268 44.268 44.865 -0.597 18003
7155 1 12 . 1 1 44 44 GLY H H 45 7.361 7.361 7.618 -0.257 18003
7156 1 12 . 1 1 45 45 PRO C C 46 178.412 178.412 176.079 2.333 18003
7157 1 12 . 1 1 45 45 PRO CA C 46 62.580 62.580 62.686 -0.106 18003
7158 1 12 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.772 1.357 18003
7159 1 12 . 1 1 46 46 LEU N N 47 120.363 120.363 123.104 -2.741 18003
7160 1 12 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.915 0.116 18003
7161 1 12 . 1 1 46 46 LEU CA C 47 52.550 52.550 52.428 0.122 18003
7162 1 12 . 1 1 46 46 LEU CB C 47 48.210 48.210 42.150 6.060 18003
7163 1 12 . 1 1 46 46 LEU H H 47 8.252 8.252 8.284 -0.032 18003
7164 1 12 . 1 1 47 47 PRO C C 48 177.313 177.313 178.454 -1.141 18003
7165 1 12 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.288 -0.453 18003
7166 1 12 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.589 -0.206 18003
7167 1 12 . 1 1 48 48 VAL N N 49 119.384 119.384 118.204 1.180 18003
7168 1 12 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.697 -0.090 18003
7169 1 12 . 1 1 48 48 VAL C C 49 176.710 176.710 178.423 -1.713 18003
7170 1 12 . 1 1 48 48 VAL CA C 49 66.188 66.188 66.987 -0.799 18003
7171 1 12 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.508 0.073 18003
7172 1 12 . 1 1 48 48 VAL H H 49 9.074 9.074 9.041 0.033 18003
7173 1 12 . 1 1 49 49 THR N N 50 111.293 111.293 113.851 -2.558 18003
7174 1 12 . 1 1 49 49 THR HA H 50 4.181 4.181 3.963 0.218 18003
7175 1 12 . 1 1 49 49 THR C C 50 176.717 176.717 176.149 0.568 18003
7176 1 12 . 1 1 49 49 THR CA C 50 65.063 65.063 66.866 -1.803 18003
7177 1 12 . 1 1 49 49 THR CB C 50 68.032 68.032 68.000 0.032 18003
7178 1 12 . 1 1 49 49 THR H H 50 7.848 7.848 8.360 -0.512 18003
7179 1 12 . 1 1 50 50 ASP N N 51 120.138 120.138 121.312 -1.174 18003
7180 1 12 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.443 -0.238 18003
7181 1 12 . 1 1 50 50 ASP C C 51 174.723 174.723 178.029 -3.306 18003
7182 1 12 . 1 1 50 50 ASP CA C 51 56.781 56.781 56.716 0.065 18003
7183 1 12 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.724 0.387 18003
7184 1 12 . 1 1 50 50 ASP H H 51 7.108 7.108 7.921 -0.813 18003
7185 1 12 . 1 1 51 51 LEU N N 52 121.089 121.089 121.083 0.006 18003
7186 1 12 . 1 1 51 51 LEU HA H 52 3.985 3.985 4.074 -0.089 18003
7187 1 12 . 1 1 51 51 LEU C C 52 177.089 177.089 178.522 -1.433 18003
7188 1 12 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.753 0.408 18003
7189 1 12 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.034 0.746 18003
7190 1 12 . 1 1 51 51 LEU H H 52 7.943 7.943 8.231 -0.288 18003
7191 1 12 . 1 1 52 52 ALA N N 53 119.237 119.237 121.542 -2.305 18003
7192 1 12 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.888 -0.016 18003
7193 1 12 . 1 1 52 52 ALA C C 53 179.466 179.466 179.665 -0.199 18003
7194 1 12 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.480 0.183 18003
7195 1 12 . 1 1 52 52 ALA CB C 53 17.619 17.619 18.038 -0.419 18003
7196 1 12 . 1 1 52 52 ALA H H 53 8.480 8.480 8.170 0.310 18003
7197 1 12 . 1 1 53 53 GLU N N 54 115.655 115.655 119.050 -3.395 18003
7198 1 12 . 1 1 53 53 GLU HA H 54 4.054 4.054 3.998 0.056 18003
7199 1 12 . 1 1 53 53 GLU C C 54 179.073 179.073 178.196 0.877 18003
7200 1 12 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.818 0.009 18003
7201 1 12 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.382 0.018 18003
7202 1 12 . 1 1 53 53 GLU H H 54 7.705 7.705 7.790 -0.085 18003
7203 1 12 . 1 1 54 54 ALA N N 55 120.276 120.276 121.188 -0.912 18003
7204 1 12 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.104 0.033 18003
7205 1 12 . 1 1 54 54 ALA C C 55 179.771 179.771 179.309 0.462 18003
7206 1 12 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.445 0.216 18003
7207 1 12 . 1 1 54 54 ALA CB C 55 18.235 18.235 18.941 -0.706 18003
7208 1 12 . 1 1 54 54 ALA H H 55 7.928 7.928 7.802 0.126 18003
7209 1 12 . 1 1 55 55 ILE N N 56 107.195 107.195 117.026 -9.831 18003
7210 1 12 . 1 1 55 55 ILE C C 56 176.053 176.053 176.422 -0.369 18003
7211 1 12 . 1 1 55 55 ILE CA C 56 60.551 60.551 63.039 -2.488 18003
7212 1 12 . 1 1 55 55 ILE CB C 56 38.497 38.497 39.047 -0.550 18003
7213 1 12 . 1 1 55 55 ILE H H 56 7.507 7.507 8.203 -0.696 18003
7214 1 12 . 1 1 56 56 GLY N N 57 111.108 111.108 106.786 4.322 18003
7215 1 12 . 1 1 56 56 GLY C C 57 174.421 174.421 173.551 0.870 18003
7216 1 12 . 1 1 56 56 GLY CA C 57 46.960 46.960 44.719 2.241 18003
7217 1 12 . 1 1 56 56 GLY H H 57 7.757 7.757 7.822 -0.065 18003
7218 1 12 . 1 1 57 57 MET N N 58 118.089 118.089 119.628 -1.539 18003
7219 1 12 . 1 1 57 57 MET HA H 58 3.933 3.933 4.069 -0.136 18003
7220 1 12 . 1 1 57 57 MET C C 58 174.157 174.157 174.833 -0.676 18003
7221 1 12 . 1 1 57 57 MET CA C 58 54.091 54.091 56.603 -2.512 18003
7222 1 12 . 1 1 57 57 MET CB C 58 38.062 38.062 32.550 5.512 18003
7223 1 12 . 1 1 57 57 MET H H 58 7.659 7.659 8.346 -0.687 18003
7224 1 12 . 1 1 58 58 GLU N N 59 121.656 121.656 119.458 2.198 18003
7225 1 12 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.334 0.006 18003
7226 1 12 . 1 1 58 58 GLU C C 59 178.355 178.355 176.470 1.885 18003
7227 1 12 . 1 1 58 58 GLU CA C 59 56.643 56.643 56.665 -0.022 18003
7228 1 12 . 1 1 58 58 GLU CB C 59 30.029 30.029 30.454 -0.425 18003
7229 1 12 . 1 1 58 58 GLU H H 59 8.523 8.523 8.667 -0.144 18003
7230 1 12 . 1 1 59 59 GLN N N 60 123.686 123.686 119.839 3.847 18003
7231 1 12 . 1 1 59 59 GLN HA H 60 4.214 4.214 3.979 0.235 18003
7232 1 12 . 1 1 59 59 GLN C C 60 177.961 177.961 177.419 0.542 18003
7233 1 12 . 1 1 59 59 GLN CA C 60 60.616 60.616 59.040 1.576 18003
7234 1 12 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.254 0.761 18003
7235 1 12 . 1 1 59 59 GLN H H 60 9.009 9.009 8.669 0.340 18003
7236 1 12 . 1 1 60 60 SER N N 61 115.101 115.101 115.874 -0.773 18003
7237 1 12 . 1 1 60 60 SER C C 61 176.801 176.801 176.215 0.586 18003
7238 1 12 . 1 1 60 60 SER CA C 61 61.213 61.213 60.920 0.293 18003
7239 1 12 . 1 1 60 60 SER H H 61 8.964 8.964 8.290 0.674 18003
7240 1 12 . 1 1 61 61 ALA N N 62 126.069 126.069 124.095 1.974 18003
7241 1 12 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.131 0.220 18003
7242 1 12 . 1 1 61 61 ALA C C 62 180.635 180.635 179.878 0.757 18003
7243 1 12 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.873 -0.615 18003
7244 1 12 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.253 0.370 18003
7245 1 12 . 1 1 61 61 ALA H H 62 7.103 7.103 8.201 -1.098 18003
7246 1 12 . 1 1 62 62 VAL N N 63 119.252 119.252 119.123 0.129 18003
7247 1 12 . 1 1 62 62 VAL C C 63 177.842 177.842 177.791 0.051 18003
7248 1 12 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.314 0.484 18003
7249 1 12 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.260 0.004 18003
7250 1 12 . 1 1 62 62 VAL H H 63 7.971 7.971 7.797 0.174 18003
7251 1 12 . 1 1 63 63 SER N N 64 115.494 115.494 115.153 0.341 18003
7252 1 12 . 1 1 63 63 SER HA H 64 4.034 4.034 3.910 0.124 18003
7253 1 12 . 1 1 63 63 SER C C 64 176.835 176.835 176.583 0.252 18003
7254 1 12 . 1 1 63 63 SER CA C 64 62.400 62.400 61.932 0.468 18003
7255 1 12 . 1 1 63 63 SER CB C 64 62.752 62.752 63.075 -0.323 18003
7256 1 12 . 1 1 63 63 SER H H 64 8.743 8.743 8.263 0.480 18003
7257 1 12 . 1 1 64 64 HIS N N 65 120.010 120.010 121.472 -1.462 18003
7258 1 12 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.276 0.084 18003
7259 1 12 . 1 1 64 64 HIS C C 65 177.731 177.731 177.613 0.118 18003
7260 1 12 . 1 1 64 64 HIS CA C 65 59.998 59.998 59.870 0.128 18003
7261 1 12 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.843 0.091 18003
7262 1 12 . 1 1 64 64 HIS H H 65 7.804 7.804 8.396 -0.592 18003
7263 1 12 . 1 1 65 65 GLN N N 66 115.590 115.590 118.148 -2.558 18003
7264 1 12 . 1 1 65 65 GLN HA H 66 4.035 4.035 3.901 0.134 18003
7265 1 12 . 1 1 65 65 GLN C C 66 179.055 179.055 178.589 0.466 18003
7266 1 12 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.645 -1.115 18003
7267 1 12 . 1 1 65 65 GLN H H 66 7.751 7.751 8.252 -0.501 18003
7268 1 12 . 1 1 66 66 LEU N N 67 118.746 118.746 121.721 -2.975 18003
7269 1 12 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.942 0.005 18003
7270 1 12 . 1 1 66 66 LEU C C 67 178.334 178.334 178.813 -0.479 18003
7271 1 12 . 1 1 66 66 LEU CA C 67 57.846 57.846 58.155 -0.309 18003
7272 1 12 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.751 -0.648 18003
7273 1 12 . 1 1 66 66 LEU H H 67 8.648 8.648 8.762 -0.114 18003
7274 1 12 . 1 1 67 67 ARG N N 68 119.610 119.610 118.390 1.220 18003
7275 1 12 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.965 -0.022 18003
7276 1 12 . 1 1 67 67 ARG C C 68 178.807 178.807 178.886 -0.079 18003
7277 1 12 . 1 1 67 67 ARG CA C 68 59.377 59.377 58.836 0.541 18003
7278 1 12 . 1 1 67 67 ARG CB C 68 29.475 29.475 29.509 -0.034 18003
7279 1 12 . 1 1 67 67 ARG H H 68 7.607 7.607 8.217 -0.610 18003
7280 1 12 . 1 1 68 68 VAL N N 69 119.719 119.719 120.317 -0.598 18003
7281 1 12 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.650 -0.017 18003
7282 1 12 . 1 1 68 68 VAL C C 69 178.690 178.690 178.054 0.636 18003
7283 1 12 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.291 0.163 18003
7284 1 12 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.181 0.598 18003
7285 1 12 . 1 1 68 68 VAL H H 69 7.259 7.259 7.877 -0.618 18003
7286 1 12 . 1 1 69 69 LEU N N 70 117.532 117.532 119.505 -1.973 18003
7287 1 12 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.857 0.091 18003
7288 1 12 . 1 1 69 69 LEU C C 70 179.144 179.144 178.895 0.249 18003
7289 1 12 . 1 1 69 69 LEU CA C 70 57.750 57.750 58.214 -0.464 18003
7290 1 12 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.298 0.562 18003
7291 1 12 . 1 1 69 69 LEU H H 70 8.375 8.375 8.424 -0.049 18003
7292 1 12 . 1 1 70 70 ARG N N 71 122.498 122.498 119.304 3.194 18003
7293 1 12 . 1 1 70 70 ARG HA H 71 3.931 3.931 3.938 -0.007 18003
7294 1 12 . 1 1 70 70 ARG C C 71 180.499 180.499 178.777 1.722 18003
7295 1 12 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.426 -0.649 18003
7296 1 12 . 1 1 70 70 ARG CB C 71 30.155 30.155 30.061 0.094 18003
7297 1 12 . 1 1 70 70 ARG H H 71 8.822 8.822 8.544 0.278 18003
7298 1 12 . 1 1 71 71 ASN N N 72 121.816 121.816 118.317 3.499 18003
7299 1 12 . 1 1 71 71 ASN C C 72 177.170 177.170 177.528 -0.358 18003
7300 1 12 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.599 0.178 18003
7301 1 12 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.035 -0.301 18003
7302 1 12 . 1 1 71 71 ASN H H 72 8.144 8.144 7.819 0.325 18003
7303 1 12 . 1 1 72 72 LEU N N 73 117.044 117.044 118.102 -1.058 18003
7304 1 12 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.247 0.098 18003
7305 1 12 . 1 1 72 72 LEU C C 73 176.984 176.984 177.908 -0.924 18003
7306 1 12 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.339 -1.214 18003
7307 1 12 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.494 0.775 18003
7308 1 12 . 1 1 72 72 LEU H H 73 7.804 7.804 7.648 0.156 18003
7309 1 12 . 1 1 73 73 GLY N N 74 106.621 106.621 106.479 0.142 18003
7310 1 12 . 1 1 73 73 GLY C C 74 173.266 173.266 173.117 0.149 18003
7311 1 12 . 1 1 73 73 GLY CA C 74 46.022 46.022 44.934 1.088 18003
7312 1 12 . 1 1 73 73 GLY H H 74 7.851 7.851 8.333 -0.482 18003
7313 1 12 . 1 1 74 74 LEU N N 75 114.582 114.582 121.715 -7.133 18003
7314 1 12 . 1 1 74 74 LEU C C 75 177.562 177.562 175.123 2.439 18003
7315 1 12 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.484 0.547 18003
7316 1 12 . 1 1 74 74 LEU CB C 75 44.444 44.444 44.043 0.401 18003
7317 1 12 . 1 1 74 74 LEU H H 75 7.808 7.808 8.072 -0.264 18003
7318 1 12 . 1 1 75 75 VAL N N 76 110.980 110.980 114.062 -3.082 18003
7319 1 12 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.691 -0.164 18003
7320 1 12 . 1 1 75 75 VAL C C 76 173.922 173.922 173.870 0.052 18003
7321 1 12 . 1 1 75 75 VAL CA C 76 57.943 57.943 59.813 -1.870 18003
7322 1 12 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.384 0.645 18003
7323 1 12 . 1 1 75 75 VAL H H 76 7.079 7.079 7.385 -0.306 18003
7324 1 12 . 1 1 76 76 VAL N N 77 118.619 118.619 120.364 -1.745 18003
7325 1 12 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.574 0.728 18003
7326 1 12 . 1 1 76 76 VAL C C 77 174.041 174.041 174.372 -0.331 18003
7327 1 12 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.931 -0.932 18003
7328 1 12 . 1 1 76 76 VAL H H 77 9.024 9.024 9.223 -0.199 18003
7329 1 12 . 1 1 77 77 GLY N N 78 109.451 109.451 109.469 -0.018 18003
7330 1 12 . 1 1 77 77 GLY C C 78 172.225 172.225 172.518 -0.293 18003
7331 1 12 . 1 1 77 77 GLY CA C 78 44.462 44.462 44.568 -0.106 18003
7332 1 12 . 1 1 77 77 GLY H H 78 8.265 8.265 8.290 -0.025 18003
7333 1 12 . 1 1 78 78 ASP N N 79 122.826 122.826 122.580 0.246 18003
7334 1 12 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.724 0.022 18003
7335 1 12 . 1 1 78 78 ASP C C 79 174.817 174.817 175.279 -0.462 18003
7336 1 12 . 1 1 78 78 ASP CA C 79 53.111 53.111 51.961 1.150 18003
7337 1 12 . 1 1 78 78 ASP CB C 79 43.655 43.655 42.392 1.263 18003
7338 1 12 . 1 1 78 78 ASP H H 79 8.479 8.479 8.383 0.096 18003
7339 1 12 . 1 1 79 79 ARG N N 80 122.613 122.613 127.133 -4.520 18003
7340 1 12 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.197 0.215 18003
7341 1 12 . 1 1 79 79 ARG C C 80 175.546 175.546 174.701 0.845 18003
7342 1 12 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.021 0.297 18003
7343 1 12 . 1 1 79 79 ARG CB C 80 30.376 30.376 30.760 -0.384 18003
7344 1 12 . 1 1 79 79 ARG H H 80 8.580 8.580 8.456 0.124 18003
7345 1 12 . 1 1 80 80 ALA N N 81 129.263 129.263 128.637 0.626 18003
7346 1 12 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.621 -0.169 18003
7347 1 12 . 1 1 80 80 ALA C C 81 177.126 177.126 177.336 -0.210 18003
7348 1 12 . 1 1 80 80 ALA CA C 81 51.620 51.620 50.937 0.683 18003
7349 1 12 . 1 1 80 80 ALA CB C 81 19.260 19.260 22.004 -2.744 18003
7350 1 12 . 1 1 80 80 ALA H H 81 8.396 8.396 8.548 -0.152 18003
7351 1 12 . 1 1 81 81 GLY N N 82 112.739 112.739 109.284 3.455 18003
7352 1 12 . 1 1 81 81 GLY C C 82 174.856 174.856 174.244 0.612 18003
7353 1 12 . 1 1 81 81 GLY CA C 82 46.392 46.392 46.137 0.255 18003
7354 1 12 . 1 1 81 81 GLY H H 82 8.641 8.641 8.957 -0.316 18003
7355 1 12 . 1 1 82 82 ARG N N 83 124.780 124.780 116.384 8.396 18003
7356 1 12 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.496 -0.173 18003
7357 1 12 . 1 1 82 82 ARG C C 83 176.339 176.339 175.932 0.407 18003
7358 1 12 . 1 1 82 82 ARG CA C 83 56.690 56.690 56.113 0.577 18003
7359 1 12 . 1 1 82 82 ARG CB C 83 30.221 30.221 31.990 -1.769 18003
7360 1 12 . 1 1 82 82 ARG H H 83 8.728 8.728 8.512 0.216 18003
7361 1 12 . 1 1 83 83 SER N N 84 114.678 114.678 114.479 0.199 18003
7362 1 12 . 1 1 83 83 SER C C 84 172.869 172.869 171.861 1.008 18003
7363 1 12 . 1 1 83 83 SER CA C 84 56.834 56.834 57.960 -1.126 18003
7364 1 12 . 1 1 83 83 SER CB C 84 65.191 65.191 66.052 -0.861 18003
7365 1 12 . 1 1 83 83 SER H H 84 7.821 7.821 7.696 0.125 18003
7366 1 12 . 1 1 84 84 ILE N N 85 122.996 122.996 122.222 0.774 18003
7367 1 12 . 1 1 84 84 ILE C C 85 175.521 175.521 174.034 1.487 18003
7368 1 12 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.192 1.043 18003
7369 1 12 . 1 1 84 84 ILE CB C 85 38.136 38.136 40.517 -2.381 18003
7370 1 12 . 1 1 84 84 ILE H H 85 8.232 8.232 8.269 -0.037 18003
7371 1 12 . 1 1 85 85 VAL N N 86 121.845 121.845 129.644 -7.799 18003
7372 1 12 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.234 0.076 18003
7373 1 12 . 1 1 85 85 VAL C C 86 174.818 174.818 174.141 0.677 18003
7374 1 12 . 1 1 85 85 VAL CA C 86 59.738 59.738 60.635 -0.896 18003
7375 1 12 . 1 1 85 85 VAL CB C 86 34.221 34.221 34.075 0.146 18003
7376 1 12 . 1 1 85 85 VAL H H 86 8.495 8.495 8.467 0.028 18003
7377 1 12 . 1 1 86 86 TYR N N 87 125.020 125.020 126.270 -1.250 18003
7378 1 12 . 1 1 86 86 TYR HA H 87 4.319 4.319 4.639 -0.320 18003
7379 1 12 . 1 1 86 86 TYR C C 87 173.808 173.808 175.073 -1.265 18003
7380 1 12 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.556 -0.091 18003
7381 1 12 . 1 1 86 86 TYR CB C 87 41.480 41.480 40.412 1.068 18003
7382 1 12 . 1 1 86 86 TYR H H 87 8.488 8.488 8.780 -0.292 18003
7383 1 12 . 1 1 87 87 SER N N 88 110.681 110.681 115.376 -4.695 18003
7384 1 12 . 1 1 87 87 SER HA H 88 5.414 5.414 4.844 0.570 18003
7385 1 12 . 1 1 87 87 SER C C 88 174.693 174.693 173.239 1.454 18003
7386 1 12 . 1 1 87 87 SER CA C 88 56.113 56.113 56.113 -0.000 18003
7387 1 12 . 1 1 87 87 SER CB C 88 66.309 66.309 66.017 0.292 18003
7388 1 12 . 1 1 87 87 SER H H 88 8.718 8.718 9.188 -0.470 18003
7389 1 12 . 1 1 88 88 LEU N N 89 119.612 119.612 119.782 -0.170 18003
7390 1 12 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.540 0.387 18003
7391 1 12 . 1 1 88 88 LEU C C 89 179.031 179.031 177.776 1.255 18003
7392 1 12 . 1 1 88 88 LEU CA C 89 55.325 55.325 54.017 1.308 18003
7393 1 12 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.113 -0.393 18003
7394 1 12 . 1 1 88 88 LEU H H 89 9.034 9.034 8.140 0.894 18003
7395 1 12 . 1 1 89 89 TYR N N 90 120.540 120.540 121.994 -1.454 18003
7396 1 12 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.107 0.515 18003
7397 1 12 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.570 1.142 18003
7398 1 12 . 1 1 89 89 TYR H H 90 8.075 8.075 8.216 -0.141 18003
7399 1 12 . 1 1 92 92 HIS C C 93 177.850 177.850 177.691 0.159 18003
7400 1 12 . 1 1 93 93 VAL N N 94 120.211 120.211 120.287 -0.076 18003
7401 1 12 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.794 -0.293 18003
7402 1 12 . 1 1 93 93 VAL C C 94 176.785 176.785 178.162 -1.377 18003
7403 1 12 . 1 1 93 93 VAL CA C 94 66.666 66.666 66.118 0.548 18003
7404 1 12 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.210 0.427 18003
7405 1 12 . 1 1 93 93 VAL H H 94 8.164 8.164 8.229 -0.065 18003
7406 1 12 . 1 1 94 94 ALA N N 95 119.221 119.221 120.305 -1.084 18003
7407 1 12 . 1 1 94 94 ALA HA H 95 3.790 3.790 4.026 -0.236 18003
7408 1 12 . 1 1 94 94 ALA C C 95 177.979 177.979 179.728 -1.749 18003
7409 1 12 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.314 0.165 18003
7410 1 12 . 1 1 94 94 ALA CB C 95 18.110 18.110 17.961 0.149 18003
7411 1 12 . 1 1 94 94 ALA H H 95 6.942 6.942 8.355 -1.413 18003
7412 1 12 . 1 1 95 95 GLN N N 96 115.416 115.416 119.778 -4.362 18003
7413 1 12 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.034 0.001 18003
7414 1 12 . 1 1 95 95 GLN C C 96 177.993 177.993 178.332 -0.339 18003
7415 1 12 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.777 0.065 18003
7416 1 12 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.624 -0.595 18003
7417 1 12 . 1 1 95 95 GLN H H 96 7.795 7.795 7.705 0.090 18003
7418 1 12 . 1 1 96 96 LEU N N 97 120.758 120.758 119.566 1.192 18003
7419 1 12 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.126 -0.277 18003
7420 1 12 . 1 1 96 96 LEU C C 97 177.974 177.974 179.415 -1.441 18003
7421 1 12 . 1 1 96 96 LEU CA C 97 59.282 59.282 57.803 1.479 18003
7422 1 12 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.106 -0.060 18003
7423 1 12 . 1 1 96 96 LEU H H 97 8.197 8.197 8.118 0.079 18003
7424 1 12 . 1 1 97 97 LEU N N 98 117.567 117.567 121.036 -3.469 18003
7425 1 12 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.966 -0.136 18003
7426 1 12 . 1 1 97 97 LEU C C 98 178.219 178.219 178.732 -0.513 18003
7427 1 12 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.279 -0.549 18003
7428 1 12 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.536 0.326 18003
7429 1 12 . 1 1 97 97 LEU H H 98 7.660 7.660 8.450 -0.790 18003
7430 1 12 . 1 1 98 98 ASP N N 99 118.607 118.607 119.647 -1.040 18003
7431 1 12 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.342 -0.233 18003
7432 1 12 . 1 1 98 98 ASP C C 99 179.382 179.382 179.167 0.215 18003
7433 1 12 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.690 0.345 18003
7434 1 12 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.230 -0.391 18003
7435 1 12 . 1 1 98 98 ASP H H 99 8.295 8.295 8.536 -0.241 18003
7436 1 12 . 1 1 99 99 GLU N N 100 117.542 117.542 120.454 -2.912 18003
7437 1 12 . 1 1 99 99 GLU HA H 100 3.849 3.849 3.852 -0.003 18003
7438 1 12 . 1 1 99 99 GLU C C 100 179.389 179.389 178.643 0.746 18003
7439 1 12 . 1 1 99 99 GLU CA C 100 58.023 58.023 58.958 -0.935 18003
7440 1 12 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.648 -0.619 18003
7441 1 12 . 1 1 99 99 GLU H H 100 8.334 8.334 8.011 0.323 18003
7442 1 12 . 1 1 100 100 ALA N N 101 122.890 122.890 122.820 0.070 18003
7443 1 12 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.057 -0.059 18003
7444 1 12 . 1 1 100 100 ALA C C 101 180.184 180.184 179.603 0.581 18003
7445 1 12 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.383 0.137 18003
7446 1 12 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.577 -0.958 18003
7447 1 12 . 1 1 100 100 ALA H H 101 8.550 8.550 8.437 0.113 18003
7448 1 12 . 1 1 101 101 ILE N N 102 119.952 119.952 119.441 0.511 18003
7449 1 12 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.787 -0.198 18003
7450 1 12 . 1 1 101 101 ILE C C 102 178.114 178.114 176.916 1.198 18003
7451 1 12 . 1 1 101 101 ILE CA C 102 65.376 65.376 64.008 1.368 18003
7452 1 12 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.953 0.076 18003
7453 1 12 . 1 1 101 101 ILE H H 102 8.493 8.493 8.274 0.219 18003
7454 1 12 . 1 1 102 102 TYR N N 103 120.625 120.625 121.133 -0.508 18003
7455 1 12 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.058 0.113 18003
7456 1 12 . 1 1 102 102 TYR C C 103 179.772 179.772 177.696 2.076 18003
7457 1 12 . 1 1 102 102 TYR CA C 103 60.724 60.724 62.245 -1.521 18003
7458 1 12 . 1 1 102 102 TYR CB C 103 37.500 37.500 38.222 -0.722 18003
7459 1 12 . 1 1 102 102 TYR H H 103 8.520 8.520 7.928 0.592 18003
7460 1 12 . 1 1 103 103 HIS N N 104 117.456 117.456 117.642 -0.186 18003
7461 1 12 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.260 0.165 18003
7462 1 12 . 1 1 103 103 HIS C C 104 176.377 176.377 178.015 -1.638 18003
7463 1 12 . 1 1 103 103 HIS CA C 104 60.043 60.043 58.111 1.932 18003
7464 1 12 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.287 -0.258 18003
7465 1 12 . 1 1 103 103 HIS H H 104 8.622 8.622 8.725 -0.103 18003
7466 1 12 . 1 1 104 104 SER N N 105 113.596 113.596 114.452 -0.856 18003
7467 1 12 . 1 1 104 104 SER C C 105 176.712 176.712 176.083 0.629 18003
7468 1 12 . 1 1 104 104 SER CA C 105 61.852 61.852 61.426 0.426 18003
7469 1 12 . 1 1 104 104 SER CB C 105 63.550 63.550 63.390 0.160 18003
7470 1 12 . 1 1 104 104 SER H H 105 7.900 7.900 8.307 -0.407 18003
7471 1 12 . 1 1 105 105 GLU N N 106 119.022 119.022 119.710 -0.688 18003
7472 1 12 . 1 1 105 105 GLU HA H 106 4.013 4.013 4.096 -0.083 18003
7473 1 12 . 1 1 105 105 GLU C C 106 177.902 177.902 177.327 0.575 18003
7474 1 12 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.031 0.000 18003
7475 1 12 . 1 1 105 105 GLU CB C 106 29.279 29.279 30.023 -0.744 18003
7476 1 12 . 1 1 105 105 GLU H H 106 8.181 8.181 8.205 -0.024 18003
7477 1 12 . 1 1 106 106 HIS N N 107 116.482 116.482 117.719 -1.237 18003
7478 1 12 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.129 0.278 18003
7479 1 12 . 1 1 106 106 HIS C C 107 175.575 175.575 176.875 -1.300 18003
7480 1 12 . 1 1 106 106 HIS CA C 107 57.343 57.343 58.448 -1.105 18003
7481 1 12 . 1 1 106 106 HIS CB C 107 28.580 28.580 29.942 -1.362 18003
7482 1 12 . 1 1 106 106 HIS H H 107 7.770 7.770 7.632 0.138 18003
7483 1 12 . 1 1 107 107 LEU N N 108 120.346 120.346 121.132 -0.786 18003
7484 1 12 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.118 -0.064 18003
7485 1 12 . 1 1 107 107 LEU C C 108 177.404 177.404 176.427 0.977 18003
7486 1 12 . 1 1 107 107 LEU CA C 108 55.991 55.991 55.952 0.039 18003
7487 1 12 . 1 1 107 107 LEU CB C 108 42.030 42.030 39.733 2.297 18003
7488 1 12 . 1 1 107 107 LEU H H 108 7.682 7.682 7.819 -0.137 18003
7489 1 12 . 1 1 108 108 HIS N N 109 117.222 117.222 123.658 -6.436 18003
7490 1 12 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.665 -0.611 18003
7491 1 12 . 1 1 108 108 HIS C C 109 174.606 174.606 175.547 -0.941 18003
7492 1 12 . 1 1 108 108 HIS CA C 109 56.029 56.029 55.532 0.496 18003
7493 1 12 . 1 1 108 108 HIS CB C 109 28.517 28.517 31.790 -3.273 18003
7494 1 12 . 1 1 108 108 HIS H H 109 8.030 8.030 7.990 0.040 18003
7495 1 12 . 1 1 109 109 LEU N N 110 121.114 121.114 128.550 -7.436 18003
7496 1 12 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.076 0.222 18003
7497 1 12 . 1 1 109 109 LEU C C 110 178.028 178.028 177.011 1.017 18003
7498 1 12 . 1 1 109 109 LEU CA C 110 55.574 55.574 54.780 0.794 18003
7499 1 12 . 1 1 109 109 LEU CB C 110 42.076 42.076 41.735 0.341 18003
7500 1 12 . 1 1 109 109 LEU H H 110 7.973 7.973 8.251 -0.278 18003
7501 1 12 . 1 1 110 110 GLY N N 111 108.631 108.631 105.425 3.206 18003
7502 1 12 . 1 1 110 110 GLY C C 111 174.606 174.606 174.629 -0.023 18003
7503 1 12 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.758 0.822 18003
7504 1 12 . 1 1 110 110 GLY H H 111 8.255 8.255 6.746 1.509 18003
7505 1 12 . 1 1 111 111 LEU N N 112 121.022 121.022 121.214 -0.192 18003
7506 1 12 . 1 1 111 111 LEU HA H 112 4.359 4.359 3.793 0.566 18003
7507 1 12 . 1 1 111 111 LEU C C 112 177.701 177.701 176.694 1.007 18003
7508 1 12 . 1 1 111 111 LEU CA C 112 55.476 55.476 55.204 0.272 18003
7509 1 12 . 1 1 111 111 LEU CB C 112 41.899 41.899 41.050 0.848 18003
7510 1 12 . 1 1 111 111 LEU H H 112 7.981 7.981 8.653 -0.672 18003
7511 1 12 . 1 1 112 112 SER N N 113 115.471 115.471 112.740 2.731 18003
7512 1 12 . 1 1 112 112 SER HA H 113 4.432 4.432 3.982 0.450 18003
7513 1 12 . 1 1 112 112 SER C C 113 174.381 174.381 173.647 0.734 18003
7514 1 12 . 1 1 112 112 SER CA C 113 58.527 58.527 60.641 -2.114 18003
7515 1 12 . 1 1 112 112 SER CB C 113 63.593 63.593 63.014 0.579 18003
7516 1 12 . 1 1 112 112 SER H H 113 8.215 8.215 8.389 -0.174 18003
7517 1 12 . 1 1 113 113 ASP N N 114 121.696 121.696 118.569 3.127 18003
7518 1 12 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.686 -0.259 18003
7519 1 12 . 1 1 113 113 ASP C C 114 175.958 175.958 175.461 0.497 18003
7520 1 12 . 1 1 113 113 ASP CA C 114 54.213 54.213 53.322 0.891 18003
7521 1 12 . 1 1 113 113 ASP CB C 114 41.030 41.030 41.279 -0.249 18003
7522 1 12 . 1 1 113 113 ASP H H 114 8.203 8.203 8.005 0.198 18003
7523 1 12 . 1 1 114 114 ARG N N 115 120.088 120.088 117.484 2.604 18003
7524 1 12 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.070 0.202 18003
7525 1 12 . 1 1 114 114 ARG C C 115 175.792 175.792 176.541 -0.749 18003
7526 1 12 . 1 1 114 114 ARG CA C 115 55.735 55.735 57.421 -1.686 18003
7527 1 12 . 1 1 114 114 ARG CB C 115 30.586 30.586 30.293 0.293 18003
7528 1 12 . 1 1 114 114 ARG H H 115 8.016 8.016 8.331 -0.315 18003
7529 1 12 . 1 1 115 115 HIS N N 116 120.597 120.597 118.636 1.961 18003
7530 1 12 . 1 1 115 115 HIS CA C 116 53.697 53.697 53.094 0.603 18003
7531 1 12 . 1 1 115 115 HIS CB C 116 29.299 29.299 29.448 -0.149 18003
7532 1 12 . 1 1 115 115 HIS H H 116 8.385 8.385 7.725 0.660 18003
7533 1 12 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.546 -0.064 18003
7534 1 12 . 1 1 116 116 PRO C C 117 177.090 177.090 177.110 -0.020 18003
7535 1 12 . 1 1 116 116 PRO CA C 117 63.177 63.177 63.093 0.084 18003
7536 1 12 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.457 -0.637 18003
7537 1 12 . 1 1 117 117 SER N N 118 116.220 116.220 119.127 -2.907 18003
7538 1 12 . 1 1 117 117 SER HA H 118 4.465 4.465 4.307 0.158 18003
7539 1 12 . 1 1 117 117 SER C C 118 174.287 174.287 174.494 -0.207 18003
7540 1 12 . 1 1 117 117 SER CA C 118 58.110 58.110 59.835 -1.725 18003
7541 1 12 . 1 1 117 117 SER CB C 118 63.750 63.750 63.707 0.043 18003
7542 1 12 . 1 1 117 117 SER H H 118 8.487 8.487 8.627 -0.140 18003
7543 1 12 . 1 1 118 118 ALA N N 119 126.082 126.082 122.409 3.673 18003
7544 1 12 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.361 0.078 18003
7545 1 12 . 1 1 118 118 ALA C C 119 176.879 176.879 176.190 0.689 18003
7546 1 12 . 1 1 118 118 ALA CA C 119 52.449 52.449 51.775 0.674 18003
7547 1 12 . 1 1 118 118 ALA CB C 119 19.483 19.483 19.693 -0.210 18003
7548 1 12 . 1 1 118 118 ALA H H 119 8.295 8.295 7.516 0.779 18003
7549 1 13 . 1 1 2 2 HIS C C 3 175.176 175.176 174.091 1.085 18003
7550 1 13 . 1 1 2 2 HIS CA C 3 55.900 55.900 56.282 -0.382 18003
7551 1 13 . 1 1 2 2 HIS CB C 3 30.029 30.029 29.455 0.574 18003
7552 1 13 . 1 1 3 3 GLY N N 4 110.613 110.613 107.487 3.126 18003
7553 1 13 . 1 1 3 3 GLY C C 4 174.068 174.068 172.633 1.435 18003
7554 1 13 . 1 1 3 3 GLY CA C 4 45.141 45.141 45.042 0.099 18003
7555 1 13 . 1 1 3 3 GLY H H 4 8.500 8.500 8.088 0.412 18003
7556 1 13 . 1 1 4 4 VAL N N 5 119.318 119.318 117.587 1.731 18003
7557 1 13 . 1 1 4 4 VAL HA H 5 4.128 4.128 4.451 -0.323 18003
7558 1 13 . 1 1 4 4 VAL C C 5 176.361 176.361 175.752 0.609 18003
7559 1 13 . 1 1 4 4 VAL CA C 5 61.987 61.987 60.995 0.992 18003
7560 1 13 . 1 1 4 4 VAL CB C 5 32.635 32.635 33.070 -0.435 18003
7561 1 13 . 1 1 4 4 VAL H H 5 8.094 8.094 7.978 0.116 18003
7562 1 13 . 1 1 5 5 GLU N N 6 124.369 124.369 126.070 -1.701 18003
7563 1 13 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.279 0.009 18003
7564 1 13 . 1 1 5 5 GLU C C 6 177.012 177.012 176.887 0.125 18003
7565 1 13 . 1 1 5 5 GLU CA C 6 56.699 56.699 56.599 0.100 18003
7566 1 13 . 1 1 5 5 GLU CB C 6 30.029 30.029 29.967 0.062 18003
7567 1 13 . 1 1 5 5 GLU H H 6 8.545 8.545 8.946 -0.401 18003
7568 1 13 . 1 1 6 6 GLY N N 7 109.747 109.747 106.578 3.169 18003
7569 1 13 . 1 1 6 6 GLY C C 7 174.117 174.117 174.022 0.095 18003
7570 1 13 . 1 1 6 6 GLY CA C 7 45.568 45.568 44.562 1.006 18003
7571 1 13 . 1 1 6 6 GLY H H 7 8.352 8.352 7.965 0.387 18003
7572 1 13 . 1 1 7 7 ARG N N 8 120.059 120.059 121.355 -1.296 18003
7573 1 13 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.089 0.253 18003
7574 1 13 . 1 1 7 7 ARG C C 8 176.016 176.016 176.246 -0.230 18003
7575 1 13 . 1 1 7 7 ARG CA C 8 55.833 55.833 56.896 -1.063 18003
7576 1 13 . 1 1 7 7 ARG CB C 8 30.444 30.444 30.397 0.047 18003
7577 1 13 . 1 1 7 7 ARG H H 8 8.084 8.084 8.595 -0.511 18003
7578 1 13 . 1 1 8 8 ASN N N 9 119.379 119.379 117.327 2.052 18003
7579 1 13 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.512 -0.180 18003
7580 1 13 . 1 1 8 8 ASN C C 9 174.667 174.667 174.343 0.324 18003
7581 1 13 . 1 1 8 8 ASN CA C 9 53.441 53.441 53.619 -0.178 18003
7582 1 13 . 1 1 8 8 ASN CB C 9 38.480 38.480 37.303 1.177 18003
7583 1 13 . 1 1 8 8 ASN H H 9 8.411 8.411 8.407 0.004 18003
7584 1 13 . 1 1 9 9 ARG N N 10 121.700 121.700 119.949 1.751 18003
7585 1 13 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.379 0.270 18003
7586 1 13 . 1 1 9 9 ARG CA C 10 53.147 53.147 55.034 -1.887 18003
7587 1 13 . 1 1 9 9 ARG CB C 10 30.197 30.197 30.421 -0.224 18003
7588 1 13 . 1 1 9 9 ARG H H 10 8.138 8.138 7.956 0.182 18003
7589 1 13 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.539 -0.096 18003
7590 1 13 . 1 1 10 10 PRO C C 11 176.815 176.815 175.802 1.013 18003
7591 1 13 . 1 1 10 10 PRO CA C 11 63.177 63.177 62.667 0.510 18003
7592 1 13 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.633 -0.813 18003
7593 1 13 . 1 1 11 11 SER N N 12 116.291 116.291 118.478 -2.187 18003
7594 1 13 . 1 1 11 11 SER HA H 12 4.418 4.418 4.634 -0.216 18003
7595 1 13 . 1 1 11 11 SER C C 12 173.702 173.702 173.141 0.561 18003
7596 1 13 . 1 1 11 11 SER CA C 12 58.031 58.031 57.969 0.062 18003
7597 1 13 . 1 1 11 11 SER CB C 12 64.032 64.032 62.315 1.717 18003
7598 1 13 . 1 1 11 11 SER H H 12 8.325 8.325 8.459 -0.134 18003
7599 1 13 . 1 1 12 12 ALA N N 13 126.862 126.862 129.897 -3.035 18003
7600 1 13 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.614 -0.226 18003
7601 1 13 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.296 -0.838 18003
7602 1 13 . 1 1 12 12 ALA CB C 13 18.257 18.257 19.270 -1.013 18003
7603 1 13 . 1 1 12 12 ALA H H 13 8.166 8.166 8.271 -0.105 18003
7604 1 13 . 1 1 13 13 PRO C C 14 176.368 176.368 177.092 -0.724 18003
7605 1 13 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.647 0.290 18003
7606 1 13 . 1 1 13 13 PRO CB C 14 32.022 32.022 32.551 -0.529 18003
7607 1 13 . 1 1 14 14 LEU N N 15 120.969 120.969 117.982 2.987 18003
7608 1 13 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.832 -0.574 18003
7609 1 13 . 1 1 14 14 LEU C C 15 176.124 176.124 177.559 -1.435 18003
7610 1 13 . 1 1 14 14 LEU CA C 15 54.527 54.527 54.914 -0.387 18003
7611 1 13 . 1 1 14 14 LEU CB C 15 43.418 43.418 42.533 0.885 18003
7612 1 13 . 1 1 14 14 LEU H H 15 7.875 7.875 8.196 -0.321 18003
7613 1 13 . 1 1 15 15 ASP N N 16 121.780 121.780 120.764 1.016 18003
7614 1 13 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.197 0.396 18003
7615 1 13 . 1 1 15 15 ASP C C 16 176.208 176.208 178.023 -1.815 18003
7616 1 13 . 1 1 15 15 ASP CA C 16 52.468 52.468 57.248 -4.780 18003
7617 1 13 . 1 1 15 15 ASP CB C 16 41.629 41.629 39.520 2.109 18003
7618 1 13 . 1 1 15 15 ASP H H 16 7.850 7.850 8.733 -0.883 18003
7619 1 13 . 1 1 16 16 SER N N 17 114.435 114.435 115.697 -1.262 18003
7620 1 13 . 1 1 16 16 SER HA H 17 4.120 4.120 3.993 0.127 18003
7621 1 13 . 1 1 16 16 SER C C 17 177.207 177.207 176.823 0.384 18003
7622 1 13 . 1 1 16 16 SER CA C 17 62.322 62.322 61.166 1.156 18003
7623 1 13 . 1 1 16 16 SER H H 17 8.658 8.658 8.169 0.489 18003
7624 1 13 . 1 1 17 17 GLN N N 18 122.403 122.403 122.442 -0.039 18003
7625 1 13 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.068 0.129 18003
7626 1 13 . 1 1 17 17 GLN C C 18 178.715 178.715 177.916 0.799 18003
7627 1 13 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.273 -0.160 18003
7628 1 13 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.188 -0.148 18003
7629 1 13 . 1 1 17 17 GLN H H 18 8.140 8.140 8.294 -0.154 18003
7630 1 13 . 1 1 18 18 ALA N N 19 124.743 124.743 121.317 3.426 18003
7631 1 13 . 1 1 18 18 ALA HA H 19 4.176 4.176 3.998 0.178 18003
7632 1 13 . 1 1 18 18 ALA C C 19 180.616 180.616 179.364 1.252 18003
7633 1 13 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.810 -0.205 18003
7634 1 13 . 1 1 18 18 ALA CB C 19 19.028 19.028 18.098 0.930 18003
7635 1 13 . 1 1 18 18 ALA H H 19 8.455 8.455 8.117 0.338 18003
7636 1 13 . 1 1 19 19 ALA N N 20 119.089 119.089 121.247 -2.158 18003
7637 1 13 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.073 0.106 18003
7638 1 13 . 1 1 19 19 ALA C C 20 179.239 179.239 179.426 -0.187 18003
7639 1 13 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.782 0.489 18003
7640 1 13 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.355 -0.163 18003
7641 1 13 . 1 1 19 19 ALA H H 20 8.993 8.993 7.966 1.027 18003
7642 1 13 . 1 1 20 20 ALA N N 21 119.226 119.226 121.199 -1.973 18003
7643 1 13 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.966 0.094 18003
7644 1 13 . 1 1 20 20 ALA C C 21 180.230 180.230 179.718 0.512 18003
7645 1 13 . 1 1 20 20 ALA CA C 21 55.143 55.143 54.994 0.149 18003
7646 1 13 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.136 -0.108 18003
7647 1 13 . 1 1 20 20 ALA H H 21 7.724 7.724 7.942 -0.218 18003
7648 1 13 . 1 1 21 21 GLN N N 22 119.310 119.310 118.504 0.806 18003
7649 1 13 . 1 1 21 21 GLN HA H 22 4.129 4.129 3.988 0.141 18003
7650 1 13 . 1 1 21 21 GLN C C 22 179.319 179.319 178.310 1.009 18003
7651 1 13 . 1 1 21 21 GLN CA C 22 58.762 58.762 59.107 -0.345 18003
7652 1 13 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.958 -0.929 18003
7653 1 13 . 1 1 21 21 GLN H H 22 7.638 7.638 8.454 -0.816 18003
7654 1 13 . 1 1 22 22 VAL N N 23 121.565 121.565 119.736 1.829 18003
7655 1 13 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.716 0.250 18003
7656 1 13 . 1 1 22 22 VAL C C 23 178.026 178.026 178.089 -0.063 18003
7657 1 13 . 1 1 22 22 VAL CA C 23 66.142 66.142 65.800 0.342 18003
7658 1 13 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.077 -0.111 18003
7659 1 13 . 1 1 22 22 VAL H H 23 8.442 8.442 7.840 0.602 18003
7660 1 13 . 1 1 23 23 ALA N N 24 121.400 121.400 122.068 -0.668 18003
7661 1 13 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.916 0.180 18003
7662 1 13 . 1 1 23 23 ALA C C 24 178.758 178.758 179.704 -0.946 18003
7663 1 13 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.424 0.491 18003
7664 1 13 . 1 1 23 23 ALA CB C 24 16.650 16.650 17.928 -1.278 18003
7665 1 13 . 1 1 23 23 ALA H H 24 8.495 8.495 8.381 0.114 18003
7666 1 13 . 1 1 24 24 SER N N 25 112.138 112.138 113.549 -1.411 18003
7667 1 13 . 1 1 24 24 SER HA H 25 4.093 4.093 4.091 0.002 18003
7668 1 13 . 1 1 24 24 SER C C 25 177.271 177.271 176.641 0.630 18003
7669 1 13 . 1 1 24 24 SER CA C 25 62.166 62.166 61.190 0.976 18003
7670 1 13 . 1 1 24 24 SER CB C 25 63.032 63.032 63.013 0.019 18003
7671 1 13 . 1 1 24 24 SER H H 25 7.936 7.936 8.001 -0.065 18003
7672 1 13 . 1 1 25 25 THR N N 26 119.701 119.701 119.284 0.417 18003
7673 1 13 . 1 1 25 25 THR HA H 26 4.380 4.380 4.017 0.363 18003
7674 1 13 . 1 1 25 25 THR C C 26 175.456 175.456 176.594 -1.138 18003
7675 1 13 . 1 1 25 25 THR CA C 26 67.129 67.129 66.474 0.655 18003
7676 1 13 . 1 1 25 25 THR CB C 26 68.800 68.800 68.540 0.261 18003
7677 1 13 . 1 1 25 25 THR H H 26 7.775 7.775 7.633 0.142 18003
7678 1 13 . 1 1 26 26 LEU N N 27 119.270 119.270 120.811 -1.541 18003
7679 1 13 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.020 -0.457 18003
7680 1 13 . 1 1 26 26 LEU C C 27 178.390 178.390 179.133 -0.743 18003
7681 1 13 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.408 0.261 18003
7682 1 13 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.295 0.735 18003
7683 1 13 . 1 1 26 26 LEU H H 27 8.006 8.006 8.542 -0.536 18003
7684 1 13 . 1 1 27 27 GLN N N 28 115.843 115.843 119.604 -3.761 18003
7685 1 13 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.097 -0.293 18003
7686 1 13 . 1 1 27 27 GLN C C 28 178.657 178.657 177.816 0.841 18003
7687 1 13 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.556 0.157 18003
7688 1 13 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.872 -0.843 18003
7689 1 13 . 1 1 27 27 GLN H H 28 8.485 8.485 7.930 0.555 18003
7690 1 13 . 1 1 28 28 ALA N N 29 118.779 118.779 122.483 -3.704 18003
7691 1 13 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.078 -0.070 18003
7692 1 13 . 1 1 28 28 ALA C C 29 178.259 178.259 179.817 -1.558 18003
7693 1 13 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.713 -0.751 18003
7694 1 13 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.753 -0.015 18003
7695 1 13 . 1 1 28 28 ALA H H 29 7.432 7.432 7.759 -0.327 18003
7696 1 13 . 1 1 29 29 LEU N N 30 113.442 113.442 118.056 -4.614 18003
7697 1 13 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.878 0.118 18003
7698 1 13 . 1 1 29 29 LEU C C 30 175.924 175.924 177.246 -1.322 18003
7699 1 13 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.905 -1.341 18003
7700 1 13 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.508 0.758 18003
7701 1 13 . 1 1 29 29 LEU H H 30 7.311 7.311 8.021 -0.710 18003
7702 1 13 . 1 1 30 30 ALA N N 31 119.563 119.563 118.432 1.131 18003
7703 1 13 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.163 0.009 18003
7704 1 13 . 1 1 30 30 ALA C C 31 176.316 176.316 176.638 -0.322 18003
7705 1 13 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.105 -1.448 18003
7706 1 13 . 1 1 30 30 ALA CB C 31 18.077 18.077 18.808 -0.731 18003
7707 1 13 . 1 1 30 30 ALA H H 31 7.223 7.223 7.154 0.069 18003
7708 1 13 . 1 1 31 31 THR N N 32 114.613 114.613 111.510 3.103 18003
7709 1 13 . 1 1 31 31 THR HA H 32 4.950 4.950 4.163 0.787 18003
7710 1 13 . 1 1 31 31 THR CA C 32 58.129 58.129 63.180 -5.051 18003
7711 1 13 . 1 1 31 31 THR CB C 32 69.098 69.098 67.609 1.489 18003
7712 1 13 . 1 1 31 31 THR H H 32 8.399 8.399 8.121 0.278 18003
7713 1 13 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.172 0.266 18003
7714 1 13 . 1 1 32 32 PRO C C 33 178.207 178.207 179.009 -0.802 18003
7715 1 13 . 1 1 32 32 PRO CA C 33 66.905 66.905 66.008 0.897 18003
7716 1 13 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.670 -0.406 18003
7717 1 13 . 1 1 33 33 SER N N 34 110.767 110.767 113.772 -3.005 18003
7718 1 13 . 1 1 33 33 SER HA H 34 4.026 4.026 4.110 -0.084 18003
7719 1 13 . 1 1 33 33 SER C C 34 176.742 176.742 176.618 0.124 18003
7720 1 13 . 1 1 33 33 SER CA C 34 61.782 61.782 62.224 -0.442 18003
7721 1 13 . 1 1 33 33 SER CB C 34 62.432 62.432 62.751 -0.319 18003
7722 1 13 . 1 1 33 33 SER H H 34 8.407 8.407 8.330 0.077 18003
7723 1 13 . 1 1 34 34 ARG N N 35 120.135 120.135 122.490 -2.355 18003
7724 1 13 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.153 -0.099 18003
7725 1 13 . 1 1 34 34 ARG C C 35 178.283 178.283 178.429 -0.146 18003
7726 1 13 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.991 1.541 18003
7727 1 13 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.876 -0.923 18003
7728 1 13 . 1 1 34 34 ARG H H 35 7.341 7.341 7.902 -0.561 18003
7729 1 13 . 1 1 35 35 LEU N N 36 118.454 118.454 121.293 -2.839 18003
7730 1 13 . 1 1 35 35 LEU HA H 36 4.054 4.054 3.958 0.096 18003
7731 1 13 . 1 1 35 35 LEU C C 36 180.643 180.643 178.643 2.000 18003
7732 1 13 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.310 -0.501 18003
7733 1 13 . 1 1 35 35 LEU CB C 36 41.778 41.778 42.022 -0.244 18003
7734 1 13 . 1 1 35 35 LEU H H 36 8.226 8.226 8.619 -0.393 18003
7735 1 13 . 1 1 36 36 MET N N 37 121.073 121.073 118.939 2.134 18003
7736 1 13 . 1 1 36 36 MET HA H 37 3.928 3.928 4.000 -0.072 18003
7737 1 13 . 1 1 36 36 MET C C 37 177.671 177.671 178.477 -0.806 18003
7738 1 13 . 1 1 36 36 MET CA C 37 60.613 60.613 59.107 1.506 18003
7739 1 13 . 1 1 36 36 MET CB C 37 33.128 33.128 32.673 0.455 18003
7740 1 13 . 1 1 36 36 MET H H 37 8.447 8.447 8.103 0.344 18003
7741 1 13 . 1 1 37 37 ILE N N 38 118.239 118.239 119.141 -0.902 18003
7742 1 13 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.720 -0.280 18003
7743 1 13 . 1 1 37 37 ILE C C 38 177.092 177.092 178.254 -1.162 18003
7744 1 13 . 1 1 37 37 ILE CA C 38 65.675 65.675 64.748 0.927 18003
7745 1 13 . 1 1 37 37 ILE CB C 38 38.255 38.255 37.048 1.207 18003
7746 1 13 . 1 1 37 37 ILE H H 38 7.763 7.763 7.918 -0.155 18003
7747 1 13 . 1 1 38 38 LEU N N 39 116.073 116.073 120.510 -4.437 18003
7748 1 13 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.894 -0.068 18003
7749 1 13 . 1 1 38 38 LEU C C 39 178.941 178.941 179.111 -0.170 18003
7750 1 13 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.507 -0.476 18003
7751 1 13 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.690 0.090 18003
7752 1 13 . 1 1 38 38 LEU H H 39 8.538 8.538 8.448 0.090 18003
7753 1 13 . 1 1 39 39 THR N N 40 106.678 106.678 115.165 -8.487 18003
7754 1 13 . 1 1 39 39 THR HA H 40 3.932 3.932 3.861 0.071 18003
7755 1 13 . 1 1 39 39 THR C C 40 177.747 177.747 176.473 1.274 18003
7756 1 13 . 1 1 39 39 THR CA C 40 65.536 65.536 66.571 -1.035 18003
7757 1 13 . 1 1 39 39 THR CB C 40 68.360 68.360 68.637 -0.277 18003
7758 1 13 . 1 1 39 39 THR H H 40 8.086 8.086 8.404 -0.318 18003
7759 1 13 . 1 1 40 40 GLN N N 41 122.344 122.344 119.841 2.503 18003
7760 1 13 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.087 -0.081 18003
7761 1 13 . 1 1 40 40 GLN C C 41 178.348 178.348 178.826 -0.478 18003
7762 1 13 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.719 -0.795 18003
7763 1 13 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.758 -1.238 18003
7764 1 13 . 1 1 40 40 GLN H H 41 7.593 7.593 7.591 0.002 18003
7765 1 13 . 1 1 41 41 LEU N N 42 116.302 116.302 119.568 -3.266 18003
7766 1 13 . 1 1 41 41 LEU C C 42 178.418 178.418 178.385 0.033 18003
7767 1 13 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.071 -1.540 18003
7768 1 13 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.702 -0.353 18003
7769 1 13 . 1 1 41 41 LEU H H 42 7.570 7.570 7.845 -0.275 18003
7770 1 13 . 1 1 42 42 ARG N N 43 119.954 119.954 116.876 3.078 18003
7771 1 13 . 1 1 42 42 ARG HA H 43 3.915 3.915 3.936 -0.021 18003
7772 1 13 . 1 1 42 42 ARG C C 43 177.205 177.205 177.705 -0.500 18003
7773 1 13 . 1 1 42 42 ARG CA C 43 58.704 58.704 58.528 0.176 18003
7774 1 13 . 1 1 42 42 ARG CB C 43 29.443 29.443 29.798 -0.355 18003
7775 1 13 . 1 1 42 42 ARG H H 43 7.612 7.612 8.035 -0.423 18003
7776 1 13 . 1 1 43 43 ASN N N 44 114.682 114.682 115.745 -1.063 18003
7777 1 13 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.751 0.009 18003
7778 1 13 . 1 1 43 43 ASN C C 44 174.507 174.507 176.109 -1.602 18003
7779 1 13 . 1 1 43 43 ASN CA C 44 53.953 53.953 55.081 -1.128 18003
7780 1 13 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.330 -0.300 18003
7781 1 13 . 1 1 43 43 ASN H H 44 7.567 7.567 7.732 -0.165 18003
7782 1 13 . 1 1 44 44 GLY N N 45 109.113 109.113 106.163 2.950 18003
7783 1 13 . 1 1 44 44 GLY CA C 45 44.268 44.268 45.127 -0.859 18003
7784 1 13 . 1 1 44 44 GLY H H 45 7.361 7.361 8.363 -1.002 18003
7785 1 13 . 1 1 45 45 PRO C C 46 178.412 178.412 175.697 2.715 18003
7786 1 13 . 1 1 45 45 PRO CA C 46 62.580 62.580 63.458 -0.878 18003
7787 1 13 . 1 1 45 45 PRO CB C 46 33.129 33.129 30.244 2.885 18003
7788 1 13 . 1 1 46 46 LEU N N 47 120.363 120.363 120.710 -0.347 18003
7789 1 13 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.693 0.338 18003
7790 1 13 . 1 1 46 46 LEU CA C 47 52.550 52.550 52.045 0.505 18003
7791 1 13 . 1 1 46 46 LEU CB C 47 48.210 48.210 41.829 6.381 18003
7792 1 13 . 1 1 46 46 LEU H H 47 8.252 8.252 7.857 0.395 18003
7793 1 13 . 1 1 47 47 PRO C C 48 177.313 177.313 177.748 -0.435 18003
7794 1 13 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.664 -0.830 18003
7795 1 13 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.767 -0.384 18003
7796 1 13 . 1 1 48 48 VAL N N 49 119.384 119.384 121.248 -1.864 18003
7797 1 13 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.694 -0.087 18003
7798 1 13 . 1 1 48 48 VAL C C 49 176.710 176.710 178.298 -1.588 18003
7799 1 13 . 1 1 48 48 VAL CA C 49 66.188 66.188 67.193 -1.005 18003
7800 1 13 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.278 0.303 18003
7801 1 13 . 1 1 48 48 VAL H H 49 9.074 9.074 8.567 0.507 18003
7802 1 13 . 1 1 49 49 THR N N 50 111.293 111.293 115.150 -3.857 18003
7803 1 13 . 1 1 49 49 THR HA H 50 4.181 4.181 4.059 0.122 18003
7804 1 13 . 1 1 49 49 THR C C 50 176.717 176.717 176.163 0.554 18003
7805 1 13 . 1 1 49 49 THR CA C 50 65.063 65.063 66.630 -1.567 18003
7806 1 13 . 1 1 49 49 THR CB C 50 68.032 68.032 68.524 -0.492 18003
7807 1 13 . 1 1 49 49 THR H H 50 7.848 7.848 8.185 -0.337 18003
7808 1 13 . 1 1 50 50 ASP N N 51 120.138 120.138 122.352 -2.214 18003
7809 1 13 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.434 -0.229 18003
7810 1 13 . 1 1 50 50 ASP C C 51 174.723 174.723 178.362 -3.639 18003
7811 1 13 . 1 1 50 50 ASP CA C 51 56.781 56.781 58.198 -1.417 18003
7812 1 13 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.573 0.538 18003
7813 1 13 . 1 1 50 50 ASP H H 51 7.108 7.108 8.172 -1.064 18003
7814 1 13 . 1 1 51 51 LEU N N 52 121.089 121.089 121.328 -0.239 18003
7815 1 13 . 1 1 51 51 LEU HA H 52 3.985 3.985 4.056 -0.071 18003
7816 1 13 . 1 1 51 51 LEU C C 52 177.089 177.089 178.429 -1.340 18003
7817 1 13 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.627 0.534 18003
7818 1 13 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.086 0.694 18003
7819 1 13 . 1 1 51 51 LEU H H 52 7.943 7.943 8.445 -0.502 18003
7820 1 13 . 1 1 52 52 ALA N N 53 119.237 119.237 121.626 -2.389 18003
7821 1 13 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.875 -0.003 18003
7822 1 13 . 1 1 52 52 ALA C C 53 179.466 179.466 179.776 -0.310 18003
7823 1 13 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.353 0.310 18003
7824 1 13 . 1 1 52 52 ALA CB C 53 17.619 17.619 18.171 -0.552 18003
7825 1 13 . 1 1 52 52 ALA H H 53 8.480 8.480 8.212 0.268 18003
7826 1 13 . 1 1 53 53 GLU N N 54 115.655 115.655 118.490 -2.835 18003
7827 1 13 . 1 1 53 53 GLU HA H 54 4.054 4.054 3.912 0.142 18003
7828 1 13 . 1 1 53 53 GLU C C 54 179.073 179.073 178.082 0.991 18003
7829 1 13 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.783 0.044 18003
7830 1 13 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.498 -0.098 18003
7831 1 13 . 1 1 53 53 GLU H H 54 7.705 7.705 7.849 -0.144 18003
7832 1 13 . 1 1 54 54 ALA N N 55 120.276 120.276 120.998 -0.722 18003
7833 1 13 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.109 0.028 18003
7834 1 13 . 1 1 54 54 ALA C C 55 179.771 179.771 179.091 0.680 18003
7835 1 13 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.430 0.231 18003
7836 1 13 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.022 -0.787 18003
7837 1 13 . 1 1 54 54 ALA H H 55 7.928 7.928 7.620 0.308 18003
7838 1 13 . 1 1 55 55 ILE N N 56 107.195 107.195 117.619 -10.424 18003
7839 1 13 . 1 1 55 55 ILE C C 56 176.053 176.053 177.223 -1.170 18003
7840 1 13 . 1 1 55 55 ILE CA C 56 60.551 60.551 63.132 -2.580 18003
7841 1 13 . 1 1 55 55 ILE CB C 56 38.497 38.497 38.910 -0.413 18003
7842 1 13 . 1 1 55 55 ILE H H 56 7.507 7.507 7.852 -0.345 18003
7843 1 13 . 1 1 56 56 GLY N N 57 111.108 111.108 107.479 3.629 18003
7844 1 13 . 1 1 56 56 GLY C C 57 174.421 174.421 173.857 0.564 18003
7845 1 13 . 1 1 56 56 GLY CA C 57 46.960 46.960 44.688 2.272 18003
7846 1 13 . 1 1 56 56 GLY H H 57 7.757 7.757 8.217 -0.460 18003
7847 1 13 . 1 1 57 57 MET N N 58 118.089 118.089 120.045 -1.956 18003
7848 1 13 . 1 1 57 57 MET HA H 58 3.933 3.933 4.157 -0.224 18003
7849 1 13 . 1 1 57 57 MET C C 58 174.157 174.157 174.780 -0.623 18003
7850 1 13 . 1 1 57 57 MET CA C 58 54.091 54.091 56.236 -2.144 18003
7851 1 13 . 1 1 57 57 MET CB C 58 38.062 38.062 32.182 5.880 18003
7852 1 13 . 1 1 57 57 MET H H 58 7.659 7.659 7.845 -0.186 18003
7853 1 13 . 1 1 58 58 GLU N N 59 121.656 121.656 123.884 -2.228 18003
7854 1 13 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.481 -0.141 18003
7855 1 13 . 1 1 58 58 GLU C C 59 178.355 178.355 175.945 2.410 18003
7856 1 13 . 1 1 58 58 GLU CA C 59 56.643 56.643 56.846 -0.203 18003
7857 1 13 . 1 1 58 58 GLU CB C 59 30.029 30.029 29.827 0.202 18003
7858 1 13 . 1 1 58 58 GLU H H 59 8.523 8.523 8.472 0.051 18003
7859 1 13 . 1 1 59 59 GLN N N 60 123.686 123.686 119.226 4.460 18003
7860 1 13 . 1 1 59 59 GLN HA H 60 4.214 4.214 4.012 0.202 18003
7861 1 13 . 1 1 59 59 GLN C C 60 177.961 177.961 177.261 0.700 18003
7862 1 13 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.829 1.787 18003
7863 1 13 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.742 0.273 18003
7864 1 13 . 1 1 59 59 GLN H H 60 9.009 9.009 8.601 0.408 18003
7865 1 13 . 1 1 60 60 SER N N 61 115.101 115.101 115.140 -0.039 18003
7866 1 13 . 1 1 60 60 SER C C 61 176.801 176.801 175.995 0.806 18003
7867 1 13 . 1 1 60 60 SER CA C 61 61.213 61.213 61.003 0.210 18003
7868 1 13 . 1 1 60 60 SER H H 61 8.964 8.964 8.577 0.387 18003
7869 1 13 . 1 1 61 61 ALA N N 62 126.069 126.069 124.889 1.180 18003
7870 1 13 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.217 0.134 18003
7871 1 13 . 1 1 61 61 ALA C C 62 180.635 180.635 179.654 0.981 18003
7872 1 13 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.767 -0.509 18003
7873 1 13 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.376 0.247 18003
7874 1 13 . 1 1 61 61 ALA H H 62 7.103 7.103 7.797 -0.694 18003
7875 1 13 . 1 1 62 62 VAL N N 63 119.252 119.252 119.584 -0.332 18003
7876 1 13 . 1 1 62 62 VAL C C 63 177.842 177.842 178.192 -0.350 18003
7877 1 13 . 1 1 62 62 VAL CA C 63 66.798 66.798 65.647 1.151 18003
7878 1 13 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.425 -0.161 18003
7879 1 13 . 1 1 62 62 VAL H H 63 7.971 7.971 7.476 0.495 18003
7880 1 13 . 1 1 63 63 SER N N 64 115.494 115.494 115.773 -0.279 18003
7881 1 13 . 1 1 63 63 SER HA H 64 4.034 4.034 3.982 0.052 18003
7882 1 13 . 1 1 63 63 SER C C 64 176.835 176.835 176.879 -0.044 18003
7883 1 13 . 1 1 63 63 SER CA C 64 62.400 62.400 62.234 0.166 18003
7884 1 13 . 1 1 63 63 SER CB C 64 62.752 62.752 62.791 -0.039 18003
7885 1 13 . 1 1 63 63 SER H H 64 8.743 8.743 8.040 0.703 18003
7886 1 13 . 1 1 64 64 HIS N N 65 120.010 120.010 120.071 -0.061 18003
7887 1 13 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.371 -0.011 18003
7888 1 13 . 1 1 64 64 HIS C C 65 177.731 177.731 177.841 -0.110 18003
7889 1 13 . 1 1 64 64 HIS CA C 65 59.998 59.998 59.264 0.734 18003
7890 1 13 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.560 0.374 18003
7891 1 13 . 1 1 64 64 HIS H H 65 7.804 7.804 7.884 -0.080 18003
7892 1 13 . 1 1 65 65 GLN N N 66 115.590 115.590 119.711 -4.121 18003
7893 1 13 . 1 1 65 65 GLN HA H 66 4.035 4.035 4.056 -0.021 18003
7894 1 13 . 1 1 65 65 GLN C C 66 179.055 179.055 178.735 0.320 18003
7895 1 13 . 1 1 65 65 GLN CA C 66 57.530 57.530 59.084 -1.554 18003
7896 1 13 . 1 1 65 65 GLN H H 66 7.751 7.751 8.349 -0.598 18003
7897 1 13 . 1 1 66 66 LEU N N 67 118.746 118.746 119.627 -0.881 18003
7898 1 13 . 1 1 66 66 LEU HA H 67 3.947 3.947 4.035 -0.088 18003
7899 1 13 . 1 1 66 66 LEU C C 67 178.334 178.334 179.209 -0.875 18003
7900 1 13 . 1 1 66 66 LEU CA C 67 57.846 57.846 57.563 0.283 18003
7901 1 13 . 1 1 66 66 LEU CB C 67 41.103 41.103 40.879 0.224 18003
7902 1 13 . 1 1 66 66 LEU H H 67 8.648 8.648 8.649 -0.001 18003
7903 1 13 . 1 1 67 67 ARG N N 68 119.610 119.610 120.144 -0.534 18003
7904 1 13 . 1 1 67 67 ARG HA H 68 3.943 3.943 4.052 -0.109 18003
7905 1 13 . 1 1 67 67 ARG C C 68 178.807 178.807 178.856 -0.049 18003
7906 1 13 . 1 1 67 67 ARG CA C 68 59.377 59.377 58.801 0.576 18003
7907 1 13 . 1 1 67 67 ARG CB C 68 29.475 29.475 29.892 -0.416 18003
7908 1 13 . 1 1 67 67 ARG H H 68 7.607 7.607 7.941 -0.334 18003
7909 1 13 . 1 1 68 68 VAL N N 69 119.719 119.719 117.735 1.984 18003
7910 1 13 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.790 -0.157 18003
7911 1 13 . 1 1 68 68 VAL C C 69 178.690 178.690 177.578 1.112 18003
7912 1 13 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.249 0.205 18003
7913 1 13 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.694 0.085 18003
7914 1 13 . 1 1 68 68 VAL H H 69 7.259 7.259 7.927 -0.668 18003
7915 1 13 . 1 1 69 69 LEU N N 70 117.532 117.532 120.651 -3.119 18003
7916 1 13 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.897 0.051 18003
7917 1 13 . 1 1 69 69 LEU C C 70 179.144 179.144 179.306 -0.162 18003
7918 1 13 . 1 1 69 69 LEU CA C 70 57.750 57.750 58.123 -0.373 18003
7919 1 13 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.341 0.519 18003
7920 1 13 . 1 1 69 69 LEU H H 70 8.375 8.375 8.386 -0.011 18003
7921 1 13 . 1 1 70 70 ARG N N 71 122.498 122.498 118.726 3.772 18003
7922 1 13 . 1 1 70 70 ARG HA H 71 3.931 3.931 4.066 -0.135 18003
7923 1 13 . 1 1 70 70 ARG C C 71 180.499 180.499 178.677 1.822 18003
7924 1 13 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.331 -0.554 18003
7925 1 13 . 1 1 70 70 ARG CB C 71 30.155 30.155 30.180 -0.025 18003
7926 1 13 . 1 1 70 70 ARG H H 71 8.822 8.822 8.511 0.311 18003
7927 1 13 . 1 1 71 71 ASN N N 72 121.816 121.816 118.133 3.683 18003
7928 1 13 . 1 1 71 71 ASN C C 72 177.170 177.170 177.999 -0.829 18003
7929 1 13 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.566 0.210 18003
7930 1 13 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.143 -0.409 18003
7931 1 13 . 1 1 71 71 ASN H H 72 8.144 8.144 7.850 0.294 18003
7932 1 13 . 1 1 72 72 LEU N N 73 117.044 117.044 118.433 -1.389 18003
7933 1 13 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.211 0.134 18003
7934 1 13 . 1 1 72 72 LEU C C 73 176.984 176.984 177.937 -0.953 18003
7935 1 13 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.072 -0.947 18003
7936 1 13 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.217 1.052 18003
7937 1 13 . 1 1 72 72 LEU H H 73 7.804 7.804 8.304 -0.500 18003
7938 1 13 . 1 1 73 73 GLY N N 74 106.621 106.621 106.632 -0.011 18003
7939 1 13 . 1 1 73 73 GLY C C 74 173.266 173.266 173.249 0.017 18003
7940 1 13 . 1 1 73 73 GLY CA C 74 46.022 46.022 45.076 0.946 18003
7941 1 13 . 1 1 73 73 GLY H H 74 7.851 7.851 8.154 -0.303 18003
7942 1 13 . 1 1 74 74 LEU N N 75 114.582 114.582 123.594 -9.012 18003
7943 1 13 . 1 1 74 74 LEU C C 75 177.562 177.562 175.109 2.453 18003
7944 1 13 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.760 0.272 18003
7945 1 13 . 1 1 74 74 LEU CB C 75 44.444 44.444 44.329 0.115 18003
7946 1 13 . 1 1 74 74 LEU H H 75 7.808 7.808 8.308 -0.500 18003
7947 1 13 . 1 1 75 75 VAL N N 76 110.980 110.980 114.299 -3.319 18003
7948 1 13 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.611 -0.084 18003
7949 1 13 . 1 1 75 75 VAL C C 76 173.922 173.922 173.839 0.083 18003
7950 1 13 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.721 -2.777 18003
7951 1 13 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.549 0.480 18003
7952 1 13 . 1 1 75 75 VAL H H 76 7.079 7.079 7.481 -0.402 18003
7953 1 13 . 1 1 76 76 VAL N N 77 118.619 118.619 119.944 -1.325 18003
7954 1 13 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.538 0.764 18003
7955 1 13 . 1 1 76 76 VAL C C 77 174.041 174.041 174.300 -0.259 18003
7956 1 13 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.866 -0.867 18003
7957 1 13 . 1 1 76 76 VAL H H 77 9.024 9.024 9.176 -0.152 18003
7958 1 13 . 1 1 77 77 GLY N N 78 109.451 109.451 109.984 -0.533 18003
7959 1 13 . 1 1 77 77 GLY C C 78 172.225 172.225 172.438 -0.213 18003
7960 1 13 . 1 1 77 77 GLY CA C 78 44.462 44.462 44.827 -0.365 18003
7961 1 13 . 1 1 77 77 GLY H H 78 8.265 8.265 8.270 -0.005 18003
7962 1 13 . 1 1 78 78 ASP N N 79 122.826 122.826 120.716 2.110 18003
7963 1 13 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.696 0.050 18003
7964 1 13 . 1 1 78 78 ASP C C 79 174.817 174.817 174.840 -0.023 18003
7965 1 13 . 1 1 78 78 ASP CA C 79 53.111 53.111 52.786 0.325 18003
7966 1 13 . 1 1 78 78 ASP CB C 79 43.655 43.655 42.355 1.300 18003
7967 1 13 . 1 1 78 78 ASP H H 79 8.479 8.479 8.279 0.200 18003
7968 1 13 . 1 1 79 79 ARG N N 80 122.613 122.613 125.390 -2.777 18003
7969 1 13 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.219 0.193 18003
7970 1 13 . 1 1 79 79 ARG C C 80 175.546 175.546 175.224 0.322 18003
7971 1 13 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.059 0.259 18003
7972 1 13 . 1 1 79 79 ARG CB C 80 30.376 30.376 31.208 -0.832 18003
7973 1 13 . 1 1 79 79 ARG H H 80 8.580 8.580 8.596 -0.016 18003
7974 1 13 . 1 1 80 80 ALA N N 81 129.263 129.263 130.782 -1.519 18003
7975 1 13 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.652 -0.200 18003
7976 1 13 . 1 1 80 80 ALA C C 81 177.126 177.126 176.772 0.354 18003
7977 1 13 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.149 0.471 18003
7978 1 13 . 1 1 80 80 ALA CB C 81 19.260 19.260 19.960 -0.700 18003
7979 1 13 . 1 1 80 80 ALA H H 81 8.396 8.396 8.523 -0.127 18003
7980 1 13 . 1 1 81 81 GLY N N 82 112.739 112.739 114.224 -1.485 18003
7981 1 13 . 1 1 81 81 GLY C C 82 174.856 174.856 175.164 -0.308 18003
7982 1 13 . 1 1 81 81 GLY CA C 82 46.392 46.392 46.818 -0.426 18003
7983 1 13 . 1 1 81 81 GLY H H 82 8.641 8.641 8.718 -0.077 18003
7984 1 13 . 1 1 82 82 ARG N N 83 124.780 124.780 124.100 0.680 18003
7985 1 13 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.508 -0.185 18003
7986 1 13 . 1 1 82 82 ARG C C 83 176.339 176.339 176.354 -0.015 18003
7987 1 13 . 1 1 82 82 ARG CA C 83 56.690 56.690 55.444 1.246 18003
7988 1 13 . 1 1 82 82 ARG CB C 83 30.221 30.221 30.568 -0.347 18003
7989 1 13 . 1 1 82 82 ARG H H 83 8.728 8.728 8.502 0.226 18003
7990 1 13 . 1 1 83 83 SER N N 84 114.678 114.678 115.063 -0.385 18003
7991 1 13 . 1 1 83 83 SER C C 84 172.869 172.869 173.023 -0.154 18003
7992 1 13 . 1 1 83 83 SER CA C 84 56.834 56.834 57.159 -0.325 18003
7993 1 13 . 1 1 83 83 SER CB C 84 65.191 65.191 65.582 -0.391 18003
7994 1 13 . 1 1 83 83 SER H H 84 7.821 7.821 8.014 -0.193 18003
7995 1 13 . 1 1 84 84 ILE N N 85 122.996 122.996 119.420 3.576 18003
7996 1 13 . 1 1 84 84 ILE C C 85 175.521 175.521 173.635 1.886 18003
7997 1 13 . 1 1 84 84 ILE CA C 85 60.235 60.235 61.315 -1.080 18003
7998 1 13 . 1 1 84 84 ILE CB C 85 38.136 38.136 41.490 -3.354 18003
7999 1 13 . 1 1 84 84 ILE H H 85 8.232 8.232 8.087 0.145 18003
8000 1 13 . 1 1 85 85 VAL N N 86 121.845 121.845 124.112 -2.267 18003
8001 1 13 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.268 0.042 18003
8002 1 13 . 1 1 85 85 VAL C C 86 174.818 174.818 173.788 1.030 18003
8003 1 13 . 1 1 85 85 VAL CA C 86 59.738 59.738 61.277 -1.539 18003
8004 1 13 . 1 1 85 85 VAL CB C 86 34.221 34.221 34.598 -0.377 18003
8005 1 13 . 1 1 85 85 VAL H H 86 8.495 8.495 8.354 0.141 18003
8006 1 13 . 1 1 86 86 TYR N N 87 125.020 125.020 128.277 -3.257 18003
8007 1 13 . 1 1 86 86 TYR HA H 87 4.319 4.319 5.054 -0.735 18003
8008 1 13 . 1 1 86 86 TYR C C 87 173.808 173.808 175.338 -1.530 18003
8009 1 13 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.238 0.227 18003
8010 1 13 . 1 1 86 86 TYR CB C 87 41.480 41.480 40.344 1.136 18003
8011 1 13 . 1 1 86 86 TYR H H 87 8.488 8.488 8.633 -0.145 18003
8012 1 13 . 1 1 87 87 SER N N 88 110.681 110.681 116.624 -5.943 18003
8013 1 13 . 1 1 87 87 SER HA H 88 5.414 5.414 4.934 0.480 18003
8014 1 13 . 1 1 87 87 SER C C 88 174.693 174.693 173.083 1.610 18003
8015 1 13 . 1 1 87 87 SER CA C 88 56.113 56.113 56.933 -0.820 18003
8016 1 13 . 1 1 87 87 SER CB C 88 66.309 66.309 67.368 -1.059 18003
8017 1 13 . 1 1 87 87 SER H H 88 8.718 8.718 9.313 -0.595 18003
8018 1 13 . 1 1 88 88 LEU N N 89 119.612 119.612 121.848 -2.236 18003
8019 1 13 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.164 0.763 18003
8020 1 13 . 1 1 88 88 LEU C C 89 179.031 179.031 177.553 1.478 18003
8021 1 13 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.924 -0.599 18003
8022 1 13 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.221 -0.501 18003
8023 1 13 . 1 1 88 88 LEU H H 89 9.034 9.034 8.649 0.385 18003
8024 1 13 . 1 1 89 89 TYR N N 90 120.540 120.540 123.162 -2.622 18003
8025 1 13 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.174 0.448 18003
8026 1 13 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.938 0.774 18003
8027 1 13 . 1 1 89 89 TYR H H 90 8.075 8.075 8.190 -0.115 18003
8028 1 13 . 1 1 92 92 HIS C C 93 177.850 177.850 177.450 0.400 18003
8029 1 13 . 1 1 93 93 VAL N N 94 120.211 120.211 116.292 3.919 18003
8030 1 13 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.768 -0.267 18003
8031 1 13 . 1 1 93 93 VAL C C 94 176.785 176.785 177.820 -1.035 18003
8032 1 13 . 1 1 93 93 VAL CA C 94 66.666 66.666 65.939 0.727 18003
8033 1 13 . 1 1 93 93 VAL CB C 94 31.637 31.637 30.566 1.071 18003
8034 1 13 . 1 1 93 93 VAL H H 94 8.164 8.164 8.296 -0.132 18003
8035 1 13 . 1 1 94 94 ALA N N 95 119.221 119.221 121.562 -2.341 18003
8036 1 13 . 1 1 94 94 ALA HA H 95 3.790 3.790 4.013 -0.223 18003
8037 1 13 . 1 1 94 94 ALA C C 95 177.979 177.979 179.871 -1.892 18003
8038 1 13 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.099 0.380 18003
8039 1 13 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.223 -0.113 18003
8040 1 13 . 1 1 94 94 ALA H H 95 6.942 6.942 7.543 -0.601 18003
8041 1 13 . 1 1 95 95 GLN N N 96 115.416 115.416 118.445 -3.029 18003
8042 1 13 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.053 -0.018 18003
8043 1 13 . 1 1 95 95 GLN C C 96 177.993 177.993 178.648 -0.655 18003
8044 1 13 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.425 0.417 18003
8045 1 13 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.221 -0.192 18003
8046 1 13 . 1 1 95 95 GLN H H 96 7.795 7.795 8.000 -0.205 18003
8047 1 13 . 1 1 96 96 LEU N N 97 120.758 120.758 120.425 0.333 18003
8048 1 13 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.071 -0.222 18003
8049 1 13 . 1 1 96 96 LEU C C 97 177.974 177.974 179.454 -1.480 18003
8050 1 13 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.373 0.909 18003
8051 1 13 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.343 -0.296 18003
8052 1 13 . 1 1 96 96 LEU H H 97 8.197 8.197 7.962 0.235 18003
8053 1 13 . 1 1 97 97 LEU N N 98 117.567 117.567 120.236 -2.669 18003
8054 1 13 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.970 -0.140 18003
8055 1 13 . 1 1 97 97 LEU C C 98 178.219 178.219 178.461 -0.242 18003
8056 1 13 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.310 -0.580 18003
8057 1 13 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.479 0.383 18003
8058 1 13 . 1 1 97 97 LEU H H 98 7.660 7.660 8.190 -0.530 18003
8059 1 13 . 1 1 98 98 ASP N N 99 118.607 118.607 119.964 -1.357 18003
8060 1 13 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.354 -0.245 18003
8061 1 13 . 1 1 98 98 ASP C C 99 179.382 179.382 178.898 0.484 18003
8062 1 13 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.717 0.318 18003
8063 1 13 . 1 1 98 98 ASP CB C 99 39.839 39.839 39.971 -0.133 18003
8064 1 13 . 1 1 98 98 ASP H H 99 8.295 8.295 8.418 -0.123 18003
8065 1 13 . 1 1 99 99 GLU N N 100 117.542 117.542 120.069 -2.527 18003
8066 1 13 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.061 -0.212 18003
8067 1 13 . 1 1 99 99 GLU C C 100 179.389 179.389 178.930 0.459 18003
8068 1 13 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.279 -1.256 18003
8069 1 13 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.185 -0.156 18003
8070 1 13 . 1 1 99 99 GLU H H 100 8.334 8.334 8.022 0.312 18003
8071 1 13 . 1 1 100 100 ALA N N 101 122.890 122.890 123.031 -0.141 18003
8072 1 13 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.054 -0.056 18003
8073 1 13 . 1 1 100 100 ALA C C 101 180.184 180.184 179.702 0.482 18003
8074 1 13 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.470 0.050 18003
8075 1 13 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.379 -0.760 18003
8076 1 13 . 1 1 100 100 ALA H H 101 8.550 8.550 8.141 0.409 18003
8077 1 13 . 1 1 101 101 ILE N N 102 119.952 119.952 119.170 0.782 18003
8078 1 13 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.753 -0.164 18003
8079 1 13 . 1 1 101 101 ILE C C 102 178.114 178.114 178.357 -0.243 18003
8080 1 13 . 1 1 101 101 ILE CA C 102 65.376 65.376 65.321 0.055 18003
8081 1 13 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.169 0.860 18003
8082 1 13 . 1 1 101 101 ILE H H 102 8.493 8.493 8.547 -0.054 18003
8083 1 13 . 1 1 102 102 TYR N N 103 120.625 120.625 119.709 0.916 18003
8084 1 13 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.288 -0.117 18003
8085 1 13 . 1 1 102 102 TYR C C 103 179.772 179.772 178.942 0.830 18003
8086 1 13 . 1 1 102 102 TYR CA C 103 60.724 60.724 61.088 -0.364 18003
8087 1 13 . 1 1 102 102 TYR CB C 103 37.500 37.500 37.474 0.026 18003
8088 1 13 . 1 1 102 102 TYR H H 103 8.520 8.520 8.523 -0.003 18003
8089 1 13 . 1 1 103 103 HIS N N 104 117.456 117.456 119.121 -1.665 18003
8090 1 13 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.211 0.214 18003
8091 1 13 . 1 1 103 103 HIS C C 104 176.377 176.377 177.751 -1.374 18003
8092 1 13 . 1 1 103 103 HIS CA C 104 60.043 60.043 59.511 0.532 18003
8093 1 13 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.958 -0.929 18003
8094 1 13 . 1 1 103 103 HIS H H 104 8.622 8.622 8.766 -0.144 18003
8095 1 13 . 1 1 104 104 SER N N 105 113.596 113.596 114.311 -0.715 18003
8096 1 13 . 1 1 104 104 SER C C 105 176.712 176.712 176.364 0.348 18003
8097 1 13 . 1 1 104 104 SER CA C 105 61.852 61.852 61.125 0.727 18003
8098 1 13 . 1 1 104 104 SER CB C 105 63.550 63.550 63.408 0.141 18003
8099 1 13 . 1 1 104 104 SER H H 105 7.900 7.900 8.231 -0.331 18003
8100 1 13 . 1 1 105 105 GLU N N 106 119.022 119.022 121.381 -2.359 18003
8101 1 13 . 1 1 105 105 GLU HA H 106 4.013 4.013 3.947 0.066 18003
8102 1 13 . 1 1 105 105 GLU C C 106 177.902 177.902 177.859 0.043 18003
8103 1 13 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.801 -0.770 18003
8104 1 13 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.657 -0.379 18003
8105 1 13 . 1 1 105 105 GLU H H 106 8.181 8.181 8.225 -0.044 18003
8106 1 13 . 1 1 106 106 HIS N N 107 116.482 116.482 117.875 -1.393 18003
8107 1 13 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.141 0.266 18003
8108 1 13 . 1 1 106 106 HIS C C 107 175.575 175.575 175.936 -0.361 18003
8109 1 13 . 1 1 106 106 HIS CA C 107 57.343 57.343 58.634 -1.291 18003
8110 1 13 . 1 1 106 106 HIS CB C 107 28.580 28.580 30.296 -1.716 18003
8111 1 13 . 1 1 106 106 HIS H H 107 7.770 7.770 7.877 -0.107 18003
8112 1 13 . 1 1 107 107 LEU N N 108 120.346 120.346 120.123 0.223 18003
8113 1 13 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.227 -0.173 18003
8114 1 13 . 1 1 107 107 LEU C C 108 177.404 177.404 175.689 1.715 18003
8115 1 13 . 1 1 107 107 LEU CA C 108 55.991 55.991 53.581 2.410 18003
8116 1 13 . 1 1 107 107 LEU CB C 108 42.030 42.030 41.191 0.839 18003
8117 1 13 . 1 1 107 107 LEU H H 108 7.682 7.682 7.509 0.173 18003
8118 1 13 . 1 1 108 108 HIS N N 109 117.222 117.222 124.084 -6.862 18003
8119 1 13 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.360 -0.306 18003
8120 1 13 . 1 1 108 108 HIS C C 109 174.606 174.606 176.903 -2.297 18003
8121 1 13 . 1 1 108 108 HIS CA C 109 56.029 56.029 57.239 -1.210 18003
8122 1 13 . 1 1 108 108 HIS CB C 109 28.517 28.517 29.936 -1.419 18003
8123 1 13 . 1 1 108 108 HIS H H 109 8.030 8.030 7.716 0.314 18003
8124 1 13 . 1 1 109 109 LEU N N 110 121.114 121.114 119.961 1.153 18003
8125 1 13 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.121 0.177 18003
8126 1 13 . 1 1 109 109 LEU C C 110 178.028 178.028 177.647 0.381 18003
8127 1 13 . 1 1 109 109 LEU CA C 110 55.574 55.574 56.020 -0.446 18003
8128 1 13 . 1 1 109 109 LEU CB C 110 42.076 42.076 41.891 0.185 18003
8129 1 13 . 1 1 109 109 LEU H H 110 7.973 7.973 8.336 -0.363 18003
8130 1 13 . 1 1 110 110 GLY N N 111 108.631 108.631 105.309 3.322 18003
8131 1 13 . 1 1 110 110 GLY C C 111 174.606 174.606 175.089 -0.483 18003
8132 1 13 . 1 1 110 110 GLY CA C 111 45.580 45.580 45.118 0.462 18003
8133 1 13 . 1 1 110 110 GLY H H 111 8.255 8.255 8.203 0.052 18003
8134 1 13 . 1 1 111 111 LEU N N 112 121.022 121.022 120.966 0.056 18003
8135 1 13 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.789 -0.430 18003
8136 1 13 . 1 1 111 111 LEU C C 112 177.701 177.701 175.560 2.141 18003
8137 1 13 . 1 1 111 111 LEU CA C 112 55.476 55.476 54.588 0.888 18003
8138 1 13 . 1 1 111 111 LEU CB C 112 41.899 41.899 41.289 0.610 18003
8139 1 13 . 1 1 111 111 LEU H H 112 7.981 7.981 7.765 0.216 18003
8140 1 13 . 1 1 112 112 SER N N 113 115.471 115.471 121.068 -5.597 18003
8141 1 13 . 1 1 112 112 SER HA H 113 4.432 4.432 4.474 -0.042 18003
8142 1 13 . 1 1 112 112 SER C C 113 174.381 174.381 172.838 1.543 18003
8143 1 13 . 1 1 112 112 SER CA C 113 58.527 58.527 58.635 -0.108 18003
8144 1 13 . 1 1 112 112 SER CB C 113 63.593 63.593 64.684 -1.091 18003
8145 1 13 . 1 1 112 112 SER H H 113 8.215 8.215 8.325 -0.110 18003
8146 1 13 . 1 1 113 113 ASP N N 114 121.696 121.696 121.058 0.638 18003
8147 1 13 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.252 0.175 18003
8148 1 13 . 1 1 113 113 ASP C C 114 175.958 175.958 175.088 0.870 18003
8149 1 13 . 1 1 113 113 ASP CA C 114 54.213 54.213 55.017 -0.804 18003
8150 1 13 . 1 1 113 113 ASP CB C 114 41.030 41.030 40.492 0.538 18003
8151 1 13 . 1 1 113 113 ASP H H 114 8.203 8.203 8.670 -0.467 18003
8152 1 13 . 1 1 114 114 ARG N N 115 120.088 120.088 119.089 0.999 18003
8153 1 13 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.069 0.203 18003
8154 1 13 . 1 1 114 114 ARG C C 115 175.792 175.792 175.095 0.697 18003
8155 1 13 . 1 1 114 114 ARG CA C 115 55.735 55.735 56.944 -1.209 18003
8156 1 13 . 1 1 114 114 ARG CB C 115 30.586 30.586 30.736 -0.150 18003
8157 1 13 . 1 1 114 114 ARG H H 115 8.016 8.016 7.812 0.204 18003
8158 1 13 . 1 1 115 115 HIS N N 116 120.597 120.597 123.353 -2.756 18003
8159 1 13 . 1 1 115 115 HIS CA C 116 53.697 53.697 54.052 -0.355 18003
8160 1 13 . 1 1 115 115 HIS CB C 116 29.299 29.299 31.052 -1.753 18003
8161 1 13 . 1 1 115 115 HIS H H 116 8.385 8.385 7.899 0.486 18003
8162 1 13 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.228 0.254 18003
8163 1 13 . 1 1 116 116 PRO C C 117 177.090 177.090 177.539 -0.449 18003
8164 1 13 . 1 1 116 116 PRO CA C 117 63.177 63.177 65.192 -2.014 18003
8165 1 13 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.023 -0.203 18003
8166 1 13 . 1 1 117 117 SER N N 118 116.220 116.220 113.630 2.590 18003
8167 1 13 . 1 1 117 117 SER HA H 118 4.465 4.465 4.330 0.135 18003
8168 1 13 . 1 1 117 117 SER C C 118 174.287 174.287 175.080 -0.793 18003
8169 1 13 . 1 1 117 117 SER CA C 118 58.110 58.110 59.194 -1.084 18003
8170 1 13 . 1 1 117 117 SER CB C 118 63.750 63.750 63.014 0.736 18003
8171 1 13 . 1 1 117 117 SER H H 118 8.487 8.487 8.214 0.273 18003
8172 1 13 . 1 1 118 118 ALA N N 119 126.082 126.082 123.169 2.913 18003
8173 1 13 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.066 0.373 18003
8174 1 13 . 1 1 118 118 ALA C C 119 176.879 176.879 177.417 -0.538 18003
8175 1 13 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.508 -0.059 18003
8176 1 13 . 1 1 118 118 ALA CB C 119 19.483 19.483 17.559 1.923 18003
8177 1 13 . 1 1 118 118 ALA H H 119 8.295 8.295 7.710 0.585 18003
8178 1 14 . 1 1 2 2 HIS C C 3 175.176 175.176 175.095 0.081 18003
8179 1 14 . 1 1 2 2 HIS CA C 3 55.900 55.900 55.827 0.073 18003
8180 1 14 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.493 -0.464 18003
8181 1 14 . 1 1 3 3 GLY N N 4 110.613 110.613 108.878 1.735 18003
8182 1 14 . 1 1 3 3 GLY C C 4 174.068 174.068 175.165 -1.097 18003
8183 1 14 . 1 1 3 3 GLY CA C 4 45.141 45.141 44.491 0.650 18003
8184 1 14 . 1 1 3 3 GLY H H 4 8.500 8.500 7.866 0.634 18003
8185 1 14 . 1 1 4 4 VAL N N 5 119.318 119.318 120.777 -1.459 18003
8186 1 14 . 1 1 4 4 VAL HA H 5 4.128 4.128 3.929 0.199 18003
8187 1 14 . 1 1 4 4 VAL C C 5 176.361 176.361 176.482 -0.121 18003
8188 1 14 . 1 1 4 4 VAL CA C 5 61.987 61.987 64.003 -2.016 18003
8189 1 14 . 1 1 4 4 VAL CB C 5 32.635 32.635 32.140 0.495 18003
8190 1 14 . 1 1 4 4 VAL H H 5 8.094 8.094 8.248 -0.154 18003
8191 1 14 . 1 1 5 5 GLU N N 6 124.369 124.369 119.926 4.443 18003
8192 1 14 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.444 -0.156 18003
8193 1 14 . 1 1 5 5 GLU C C 6 177.012 177.012 175.519 1.493 18003
8194 1 14 . 1 1 5 5 GLU CA C 6 56.699 56.699 55.956 0.743 18003
8195 1 14 . 1 1 5 5 GLU CB C 6 30.029 30.029 31.199 -1.170 18003
8196 1 14 . 1 1 5 5 GLU H H 6 8.545 8.545 7.996 0.549 18003
8197 1 14 . 1 1 6 6 GLY N N 7 109.747 109.747 109.759 -0.012 18003
8198 1 14 . 1 1 6 6 GLY C C 7 174.117 174.117 173.032 1.085 18003
8199 1 14 . 1 1 6 6 GLY CA C 7 45.568 45.568 44.952 0.616 18003
8200 1 14 . 1 1 6 6 GLY H H 7 8.352 8.352 8.450 -0.098 18003
8201 1 14 . 1 1 7 7 ARG N N 8 120.059 120.059 119.294 0.765 18003
8202 1 14 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.808 -0.466 18003
8203 1 14 . 1 1 7 7 ARG C C 8 176.016 176.016 173.932 2.084 18003
8204 1 14 . 1 1 7 7 ARG CA C 8 55.833 55.833 55.265 0.568 18003
8205 1 14 . 1 1 7 7 ARG CB C 8 30.444 30.444 32.516 -2.072 18003
8206 1 14 . 1 1 7 7 ARG H H 8 8.084 8.084 8.570 -0.486 18003
8207 1 14 . 1 1 8 8 ASN N N 9 119.379 119.379 117.991 1.388 18003
8208 1 14 . 1 1 8 8 ASN HA H 9 4.332 4.332 5.039 -0.707 18003
8209 1 14 . 1 1 8 8 ASN C C 9 174.667 174.667 173.644 1.023 18003
8210 1 14 . 1 1 8 8 ASN CA C 9 53.441 53.441 51.801 1.640 18003
8211 1 14 . 1 1 8 8 ASN CB C 9 38.480 38.480 40.529 -2.049 18003
8212 1 14 . 1 1 8 8 ASN H H 9 8.411 8.411 8.683 -0.272 18003
8213 1 14 . 1 1 9 9 ARG N N 10 121.700 121.700 119.219 2.481 18003
8214 1 14 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.793 -0.144 18003
8215 1 14 . 1 1 9 9 ARG CA C 10 53.147 53.147 54.548 -1.401 18003
8216 1 14 . 1 1 9 9 ARG CB C 10 30.197 30.197 29.671 0.526 18003
8217 1 14 . 1 1 9 9 ARG H H 10 8.138 8.138 8.692 -0.554 18003
8218 1 14 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.556 -0.113 18003
8219 1 14 . 1 1 10 10 PRO C C 11 176.815 176.815 176.326 0.489 18003
8220 1 14 . 1 1 10 10 PRO CA C 11 63.177 63.177 63.449 -0.272 18003
8221 1 14 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.312 -0.492 18003
8222 1 14 . 1 1 11 11 SER N N 12 116.291 116.291 116.448 -0.157 18003
8223 1 14 . 1 1 11 11 SER HA H 12 4.418 4.418 4.100 0.318 18003
8224 1 14 . 1 1 11 11 SER C C 12 173.702 173.702 172.887 0.815 18003
8225 1 14 . 1 1 11 11 SER CA C 12 58.031 58.031 59.629 -1.598 18003
8226 1 14 . 1 1 11 11 SER CB C 12 64.032 64.032 62.682 1.350 18003
8227 1 14 . 1 1 11 11 SER H H 12 8.325 8.325 8.670 -0.345 18003
8228 1 14 . 1 1 12 12 ALA N N 13 126.862 126.862 125.914 0.948 18003
8229 1 14 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.569 -0.181 18003
8230 1 14 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.482 -1.024 18003
8231 1 14 . 1 1 12 12 ALA CB C 13 18.257 18.257 19.785 -1.528 18003
8232 1 14 . 1 1 12 12 ALA H H 13 8.166 8.166 8.116 0.050 18003
8233 1 14 . 1 1 13 13 PRO C C 14 176.368 176.368 175.720 0.648 18003
8234 1 14 . 1 1 13 13 PRO CA C 14 62.937 62.937 63.455 -0.518 18003
8235 1 14 . 1 1 13 13 PRO CB C 14 32.022 32.022 32.220 -0.198 18003
8236 1 14 . 1 1 14 14 LEU N N 15 120.969 120.969 124.838 -3.869 18003
8237 1 14 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.533 -0.275 18003
8238 1 14 . 1 1 14 14 LEU C C 15 176.124 176.124 177.995 -1.871 18003
8239 1 14 . 1 1 14 14 LEU CA C 15 54.527 54.527 54.719 -0.192 18003
8240 1 14 . 1 1 14 14 LEU CB C 15 43.418 43.418 42.631 0.787 18003
8241 1 14 . 1 1 14 14 LEU H H 15 7.875 7.875 8.089 -0.214 18003
8242 1 14 . 1 1 15 15 ASP N N 16 121.780 121.780 118.676 3.104 18003
8243 1 14 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.740 -0.147 18003
8244 1 14 . 1 1 15 15 ASP C C 16 176.208 176.208 178.276 -2.068 18003
8245 1 14 . 1 1 15 15 ASP CA C 16 52.468 52.468 56.876 -4.407 18003
8246 1 14 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.512 1.117 18003
8247 1 14 . 1 1 15 15 ASP H H 16 7.850 7.850 8.525 -0.675 18003
8248 1 14 . 1 1 16 16 SER N N 17 114.435 114.435 115.595 -1.160 18003
8249 1 14 . 1 1 16 16 SER HA H 17 4.120 4.120 4.188 -0.068 18003
8250 1 14 . 1 1 16 16 SER C C 17 177.207 177.207 176.583 0.624 18003
8251 1 14 . 1 1 16 16 SER CA C 17 62.322 62.322 61.012 1.310 18003
8252 1 14 . 1 1 16 16 SER H H 17 8.658 8.658 8.249 0.409 18003
8253 1 14 . 1 1 17 17 GLN N N 18 122.403 122.403 120.563 1.840 18003
8254 1 14 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.080 0.117 18003
8255 1 14 . 1 1 17 17 GLN C C 18 178.715 178.715 178.120 0.595 18003
8256 1 14 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.766 -0.653 18003
8257 1 14 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.376 -0.336 18003
8258 1 14 . 1 1 17 17 GLN H H 18 8.140 8.140 8.554 -0.414 18003
8259 1 14 . 1 1 18 18 ALA N N 19 124.743 124.743 122.394 2.349 18003
8260 1 14 . 1 1 18 18 ALA HA H 19 4.176 4.176 3.997 0.179 18003
8261 1 14 . 1 1 18 18 ALA C C 19 180.616 180.616 179.352 1.264 18003
8262 1 14 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.917 -0.312 18003
8263 1 14 . 1 1 18 18 ALA CB C 19 19.028 19.028 18.074 0.954 18003
8264 1 14 . 1 1 18 18 ALA H H 19 8.455 8.455 7.897 0.558 18003
8265 1 14 . 1 1 19 19 ALA N N 20 119.089 119.089 120.886 -1.797 18003
8266 1 14 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.008 0.171 18003
8267 1 14 . 1 1 19 19 ALA C C 20 179.239 179.239 179.428 -0.189 18003
8268 1 14 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.930 0.341 18003
8269 1 14 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.295 -0.103 18003
8270 1 14 . 1 1 19 19 ALA H H 20 8.993 8.993 7.996 0.997 18003
8271 1 14 . 1 1 20 20 ALA N N 21 119.226 119.226 121.089 -1.863 18003
8272 1 14 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.937 0.123 18003
8273 1 14 . 1 1 20 20 ALA C C 21 180.230 180.230 179.770 0.460 18003
8274 1 14 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.064 0.079 18003
8275 1 14 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.101 -0.073 18003
8276 1 14 . 1 1 20 20 ALA H H 21 7.724 7.724 7.971 -0.247 18003
8277 1 14 . 1 1 21 21 GLN N N 22 119.310 119.310 119.036 0.274 18003
8278 1 14 . 1 1 21 21 GLN HA H 22 4.129 4.129 4.024 0.105 18003
8279 1 14 . 1 1 21 21 GLN C C 22 179.319 179.319 178.443 0.876 18003
8280 1 14 . 1 1 21 21 GLN CA C 22 58.762 58.762 59.017 -0.255 18003
8281 1 14 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.833 -0.804 18003
8282 1 14 . 1 1 21 21 GLN H H 22 7.638 7.638 8.423 -0.785 18003
8283 1 14 . 1 1 22 22 VAL N N 23 121.565 121.565 120.657 0.908 18003
8284 1 14 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.672 0.294 18003
8285 1 14 . 1 1 22 22 VAL C C 23 178.026 178.026 178.126 -0.100 18003
8286 1 14 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.033 0.109 18003
8287 1 14 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.706 -0.740 18003
8288 1 14 . 1 1 22 22 VAL H H 23 8.442 8.442 8.337 0.105 18003
8289 1 14 . 1 1 23 23 ALA N N 24 121.400 121.400 121.770 -0.370 18003
8290 1 14 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.931 0.165 18003
8291 1 14 . 1 1 23 23 ALA C C 24 178.758 178.758 179.577 -0.819 18003
8292 1 14 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.434 0.481 18003
8293 1 14 . 1 1 23 23 ALA CB C 24 16.650 16.650 17.979 -1.329 18003
8294 1 14 . 1 1 23 23 ALA H H 24 8.495 8.495 8.606 -0.111 18003
8295 1 14 . 1 1 24 24 SER N N 25 112.138 112.138 113.309 -1.171 18003
8296 1 14 . 1 1 24 24 SER HA H 25 4.093 4.093 4.154 -0.061 18003
8297 1 14 . 1 1 24 24 SER C C 25 177.271 177.271 176.568 0.703 18003
8298 1 14 . 1 1 24 24 SER CA C 25 62.166 62.166 61.490 0.675 18003
8299 1 14 . 1 1 24 24 SER CB C 25 63.032 63.032 62.888 0.144 18003
8300 1 14 . 1 1 24 24 SER H H 25 7.936 7.936 8.082 -0.146 18003
8301 1 14 . 1 1 25 25 THR N N 26 119.701 119.701 116.587 3.114 18003
8302 1 14 . 1 1 25 25 THR HA H 26 4.380 4.380 4.024 0.356 18003
8303 1 14 . 1 1 25 25 THR C C 26 175.456 175.456 176.704 -1.248 18003
8304 1 14 . 1 1 25 25 THR CA C 26 67.129 67.129 66.169 0.960 18003
8305 1 14 . 1 1 25 25 THR CB C 26 68.800 68.800 68.493 0.307 18003
8306 1 14 . 1 1 25 25 THR H H 26 7.775 7.775 7.728 0.047 18003
8307 1 14 . 1 1 26 26 LEU N N 27 119.270 119.270 121.869 -2.599 18003
8308 1 14 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.019 -0.456 18003
8309 1 14 . 1 1 26 26 LEU C C 27 178.390 178.390 179.333 -0.943 18003
8310 1 14 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.290 0.379 18003
8311 1 14 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.237 0.793 18003
8312 1 14 . 1 1 26 26 LEU H H 27 8.006 8.006 8.331 -0.325 18003
8313 1 14 . 1 1 27 27 GLN N N 28 115.843 115.843 119.724 -3.881 18003
8314 1 14 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.032 -0.228 18003
8315 1 14 . 1 1 27 27 GLN C C 28 178.657 178.657 177.208 1.449 18003
8316 1 14 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.665 0.047 18003
8317 1 14 . 1 1 27 27 GLN CB C 28 28.029 28.029 29.009 -0.980 18003
8318 1 14 . 1 1 27 27 GLN H H 28 8.485 8.485 8.136 0.349 18003
8319 1 14 . 1 1 28 28 ALA N N 29 118.779 118.779 121.683 -2.904 18003
8320 1 14 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.030 -0.022 18003
8321 1 14 . 1 1 28 28 ALA C C 29 178.259 178.259 179.418 -1.159 18003
8322 1 14 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.694 -0.731 18003
8323 1 14 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.824 -0.086 18003
8324 1 14 . 1 1 28 28 ALA H H 29 7.432 7.432 7.622 -0.190 18003
8325 1 14 . 1 1 29 29 LEU N N 30 113.442 113.442 117.097 -3.655 18003
8326 1 14 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.903 0.093 18003
8327 1 14 . 1 1 29 29 LEU C C 30 175.924 175.924 177.631 -1.707 18003
8328 1 14 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.655 -1.091 18003
8329 1 14 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.626 0.640 18003
8330 1 14 . 1 1 29 29 LEU H H 30 7.311 7.311 7.884 -0.573 18003
8331 1 14 . 1 1 30 30 ALA N N 31 119.563 119.563 118.478 1.085 18003
8332 1 14 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.156 0.016 18003
8333 1 14 . 1 1 30 30 ALA C C 31 176.316 176.316 176.494 -0.178 18003
8334 1 14 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.192 -1.536 18003
8335 1 14 . 1 1 30 30 ALA CB C 31 18.077 18.077 19.147 -1.070 18003
8336 1 14 . 1 1 30 30 ALA H H 31 7.223 7.223 7.127 0.096 18003
8337 1 14 . 1 1 31 31 THR N N 32 114.613 114.613 108.509 6.104 18003
8338 1 14 . 1 1 31 31 THR HA H 32 4.950 4.950 4.049 0.901 18003
8339 1 14 . 1 1 31 31 THR CA C 32 58.129 58.129 61.475 -3.346 18003
8340 1 14 . 1 1 31 31 THR CB C 32 69.098 69.098 67.704 1.395 18003
8341 1 14 . 1 1 31 31 THR H H 32 8.399 8.399 8.278 0.121 18003
8342 1 14 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.113 0.325 18003
8343 1 14 . 1 1 32 32 PRO C C 33 178.207 178.207 178.925 -0.718 18003
8344 1 14 . 1 1 32 32 PRO CA C 33 66.905 66.905 66.026 0.879 18003
8345 1 14 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.416 -0.152 18003
8346 1 14 . 1 1 33 33 SER N N 34 110.767 110.767 113.157 -2.390 18003
8347 1 14 . 1 1 33 33 SER HA H 34 4.026 4.026 4.140 -0.114 18003
8348 1 14 . 1 1 33 33 SER C C 34 176.742 176.742 176.771 -0.029 18003
8349 1 14 . 1 1 33 33 SER CA C 34 61.782 61.782 62.001 -0.219 18003
8350 1 14 . 1 1 33 33 SER CB C 34 62.432 62.432 62.010 0.422 18003
8351 1 14 . 1 1 33 33 SER H H 34 8.407 8.407 8.425 -0.018 18003
8352 1 14 . 1 1 34 34 ARG N N 35 120.135 120.135 121.239 -1.104 18003
8353 1 14 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.130 -0.076 18003
8354 1 14 . 1 1 34 34 ARG C C 35 178.283 178.283 178.866 -0.583 18003
8355 1 14 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.554 1.978 18003
8356 1 14 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.579 -0.627 18003
8357 1 14 . 1 1 34 34 ARG H H 35 7.341 7.341 8.270 -0.929 18003
8358 1 14 . 1 1 35 35 LEU N N 36 118.454 118.454 122.411 -3.957 18003
8359 1 14 . 1 1 35 35 LEU HA H 36 4.054 4.054 4.013 0.041 18003
8360 1 14 . 1 1 35 35 LEU C C 36 180.643 180.643 178.899 1.744 18003
8361 1 14 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.090 -0.281 18003
8362 1 14 . 1 1 35 35 LEU CB C 36 41.778 41.778 42.057 -0.279 18003
8363 1 14 . 1 1 35 35 LEU H H 36 8.226 8.226 8.792 -0.566 18003
8364 1 14 . 1 1 36 36 MET N N 37 121.073 121.073 119.393 1.680 18003
8365 1 14 . 1 1 36 36 MET HA H 37 3.928 3.928 3.978 -0.050 18003
8366 1 14 . 1 1 36 36 MET C C 37 177.671 177.671 178.372 -0.701 18003
8367 1 14 . 1 1 36 36 MET CA C 37 60.613 60.613 59.309 1.304 18003
8368 1 14 . 1 1 36 36 MET CB C 37 33.128 33.128 32.670 0.457 18003
8369 1 14 . 1 1 36 36 MET H H 37 8.447 8.447 8.510 -0.063 18003
8370 1 14 . 1 1 37 37 ILE N N 38 118.239 118.239 118.598 -0.359 18003
8371 1 14 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.794 -0.354 18003
8372 1 14 . 1 1 37 37 ILE C C 38 177.092 177.092 178.053 -0.961 18003
8373 1 14 . 1 1 37 37 ILE CA C 38 65.675 65.675 63.496 2.179 18003
8374 1 14 . 1 1 37 37 ILE CB C 38 38.255 38.255 36.313 1.942 18003
8375 1 14 . 1 1 37 37 ILE H H 38 7.763 7.763 8.041 -0.278 18003
8376 1 14 . 1 1 38 38 LEU N N 39 116.073 116.073 121.564 -5.491 18003
8377 1 14 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.984 -0.158 18003
8378 1 14 . 1 1 38 38 LEU C C 39 178.941 178.941 178.969 -0.028 18003
8379 1 14 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.681 -0.650 18003
8380 1 14 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.778 0.002 18003
8381 1 14 . 1 1 38 38 LEU H H 39 8.538 8.538 8.483 0.055 18003
8382 1 14 . 1 1 39 39 THR N N 40 106.678 106.678 115.229 -8.551 18003
8383 1 14 . 1 1 39 39 THR HA H 40 3.932 3.932 3.865 0.067 18003
8384 1 14 . 1 1 39 39 THR C C 40 177.747 177.747 176.856 0.891 18003
8385 1 14 . 1 1 39 39 THR CA C 40 65.536 65.536 66.835 -1.299 18003
8386 1 14 . 1 1 39 39 THR CB C 40 68.360 68.360 68.276 0.084 18003
8387 1 14 . 1 1 39 39 THR H H 40 8.086 8.086 8.598 -0.512 18003
8388 1 14 . 1 1 40 40 GLN N N 41 122.344 122.344 121.964 0.380 18003
8389 1 14 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.078 -0.072 18003
8390 1 14 . 1 1 40 40 GLN C C 41 178.348 178.348 179.141 -0.793 18003
8391 1 14 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.597 -0.672 18003
8392 1 14 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.187 -0.667 18003
8393 1 14 . 1 1 40 40 GLN H H 41 7.593 7.593 7.751 -0.158 18003
8394 1 14 . 1 1 41 41 LEU N N 42 116.302 116.302 120.918 -4.616 18003
8395 1 14 . 1 1 41 41 LEU C C 42 178.418 178.418 179.238 -0.820 18003
8396 1 14 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.554 -2.023 18003
8397 1 14 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.745 -0.396 18003
8398 1 14 . 1 1 41 41 LEU H H 42 7.570 7.570 7.949 -0.379 18003
8399 1 14 . 1 1 42 42 ARG N N 43 119.954 119.954 118.234 1.720 18003
8400 1 14 . 1 1 42 42 ARG HA H 43 3.915 3.915 3.901 0.014 18003
8401 1 14 . 1 1 42 42 ARG C C 43 177.205 177.205 178.072 -0.867 18003
8402 1 14 . 1 1 42 42 ARG CA C 43 58.704 58.704 59.204 -0.500 18003
8403 1 14 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.061 -0.618 18003
8404 1 14 . 1 1 42 42 ARG H H 43 7.612 7.612 8.206 -0.594 18003
8405 1 14 . 1 1 43 43 ASN N N 44 114.682 114.682 115.968 -1.286 18003
8406 1 14 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.533 0.227 18003
8407 1 14 . 1 1 43 43 ASN C C 44 174.507 174.507 175.695 -1.188 18003
8408 1 14 . 1 1 43 43 ASN CA C 44 53.953 53.953 54.641 -0.688 18003
8409 1 14 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.263 -0.233 18003
8410 1 14 . 1 1 43 43 ASN H H 44 7.567 7.567 7.704 -0.137 18003
8411 1 14 . 1 1 44 44 GLY N N 45 109.113 109.113 105.641 3.472 18003
8412 1 14 . 1 1 44 44 GLY CA C 45 44.268 44.268 44.624 -0.356 18003
8413 1 14 . 1 1 44 44 GLY H H 45 7.361 7.361 7.902 -0.541 18003
8414 1 14 . 1 1 45 45 PRO C C 46 178.412 178.412 176.054 2.358 18003
8415 1 14 . 1 1 45 45 PRO CA C 46 62.580 62.580 62.578 0.002 18003
8416 1 14 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.800 1.329 18003
8417 1 14 . 1 1 46 46 LEU N N 47 120.363 120.363 123.439 -3.076 18003
8418 1 14 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.793 0.238 18003
8419 1 14 . 1 1 46 46 LEU CA C 47 52.550 52.550 51.873 0.677 18003
8420 1 14 . 1 1 46 46 LEU CB C 47 48.210 48.210 42.603 5.607 18003
8421 1 14 . 1 1 46 46 LEU H H 47 8.252 8.252 7.915 0.337 18003
8422 1 14 . 1 1 47 47 PRO C C 48 177.313 177.313 178.410 -1.097 18003
8423 1 14 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.540 -0.705 18003
8424 1 14 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.365 0.018 18003
8425 1 14 . 1 1 48 48 VAL N N 49 119.384 119.384 117.045 2.339 18003
8426 1 14 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.756 -0.149 18003
8427 1 14 . 1 1 48 48 VAL C C 49 176.710 176.710 178.106 -1.396 18003
8428 1 14 . 1 1 48 48 VAL CA C 49 66.188 66.188 66.538 -0.350 18003
8429 1 14 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.295 0.286 18003
8430 1 14 . 1 1 48 48 VAL H H 49 9.074 9.074 8.725 0.349 18003
8431 1 14 . 1 1 49 49 THR N N 50 111.293 111.293 116.112 -4.819 18003
8432 1 14 . 1 1 49 49 THR HA H 50 4.181 4.181 4.108 0.073 18003
8433 1 14 . 1 1 49 49 THR C C 50 176.717 176.717 176.449 0.268 18003
8434 1 14 . 1 1 49 49 THR CA C 50 65.063 65.063 66.961 -1.898 18003
8435 1 14 . 1 1 49 49 THR CB C 50 68.032 68.032 67.674 0.358 18003
8436 1 14 . 1 1 49 49 THR H H 50 7.848 7.848 8.211 -0.363 18003
8437 1 14 . 1 1 50 50 ASP N N 51 120.138 120.138 121.713 -1.575 18003
8438 1 14 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.618 -0.413 18003
8439 1 14 . 1 1 50 50 ASP C C 51 174.723 174.723 178.522 -3.799 18003
8440 1 14 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.300 -0.519 18003
8441 1 14 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.273 0.838 18003
8442 1 14 . 1 1 50 50 ASP H H 51 7.108 7.108 8.272 -1.164 18003
8443 1 14 . 1 1 51 51 LEU N N 52 121.089 121.089 120.884 0.205 18003
8444 1 14 . 1 1 51 51 LEU HA H 52 3.985 3.985 4.004 -0.019 18003
8445 1 14 . 1 1 51 51 LEU C C 52 177.089 177.089 178.352 -1.263 18003
8446 1 14 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.824 0.337 18003
8447 1 14 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.857 -0.077 18003
8448 1 14 . 1 1 51 51 LEU H H 52 7.943 7.943 8.011 -0.068 18003
8449 1 14 . 1 1 52 52 ALA N N 53 119.237 119.237 121.387 -2.150 18003
8450 1 14 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.915 -0.043 18003
8451 1 14 . 1 1 52 52 ALA C C 53 179.466 179.466 179.433 0.033 18003
8452 1 14 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.112 0.551 18003
8453 1 14 . 1 1 52 52 ALA CB C 53 17.619 17.619 18.083 -0.464 18003
8454 1 14 . 1 1 52 52 ALA H H 53 8.480 8.480 8.304 0.176 18003
8455 1 14 . 1 1 53 53 GLU N N 54 115.655 115.655 118.689 -3.034 18003
8456 1 14 . 1 1 53 53 GLU HA H 54 4.054 4.054 4.005 0.049 18003
8457 1 14 . 1 1 53 53 GLU C C 54 179.073 179.073 178.516 0.557 18003
8458 1 14 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.810 0.017 18003
8459 1 14 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.581 -0.181 18003
8460 1 14 . 1 1 53 53 GLU H H 54 7.705 7.705 7.770 -0.065 18003
8461 1 14 . 1 1 54 54 ALA N N 55 120.276 120.276 120.813 -0.537 18003
8462 1 14 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.152 -0.015 18003
8463 1 14 . 1 1 54 54 ALA C C 55 179.771 179.771 178.420 1.351 18003
8464 1 14 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.412 0.249 18003
8465 1 14 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.241 -1.006 18003
8466 1 14 . 1 1 54 54 ALA H H 55 7.928 7.928 7.695 0.233 18003
8467 1 14 . 1 1 55 55 ILE N N 56 107.195 107.195 116.709 -9.514 18003
8468 1 14 . 1 1 55 55 ILE C C 56 176.053 176.053 176.646 -0.593 18003
8469 1 14 . 1 1 55 55 ILE CA C 56 60.551 60.551 62.661 -2.110 18003
8470 1 14 . 1 1 55 55 ILE CB C 56 38.497 38.497 39.322 -0.825 18003
8471 1 14 . 1 1 55 55 ILE H H 56 7.507 7.507 7.916 -0.409 18003
8472 1 14 . 1 1 56 56 GLY N N 57 111.108 111.108 106.784 4.324 18003
8473 1 14 . 1 1 56 56 GLY C C 57 174.421 174.421 173.587 0.834 18003
8474 1 14 . 1 1 56 56 GLY CA C 57 46.960 46.960 44.868 2.092 18003
8475 1 14 . 1 1 56 56 GLY H H 57 7.757 7.757 7.667 0.090 18003
8476 1 14 . 1 1 57 57 MET N N 58 118.089 118.089 118.858 -0.769 18003
8477 1 14 . 1 1 57 57 MET HA H 58 3.933 3.933 4.014 -0.081 18003
8478 1 14 . 1 1 57 57 MET C C 58 174.157 174.157 175.283 -1.126 18003
8479 1 14 . 1 1 57 57 MET CA C 58 54.091 54.091 56.722 -2.631 18003
8480 1 14 . 1 1 57 57 MET CB C 58 38.062 38.062 32.436 5.626 18003
8481 1 14 . 1 1 57 57 MET H H 58 7.659 7.659 7.894 -0.235 18003
8482 1 14 . 1 1 58 58 GLU N N 59 121.656 121.656 121.475 0.181 18003
8483 1 14 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.515 -0.175 18003
8484 1 14 . 1 1 58 58 GLU C C 59 178.355 178.355 176.331 2.024 18003
8485 1 14 . 1 1 58 58 GLU CA C 59 56.643 56.643 56.941 -0.298 18003
8486 1 14 . 1 1 58 58 GLU CB C 59 30.029 30.029 29.996 0.033 18003
8487 1 14 . 1 1 58 58 GLU H H 59 8.523 8.523 8.540 -0.017 18003
8488 1 14 . 1 1 59 59 GLN N N 60 123.686 123.686 119.485 4.201 18003
8489 1 14 . 1 1 59 59 GLN HA H 60 4.214 4.214 4.070 0.144 18003
8490 1 14 . 1 1 59 59 GLN C C 60 177.961 177.961 176.991 0.970 18003
8491 1 14 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.499 2.117 18003
8492 1 14 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.247 0.768 18003
8493 1 14 . 1 1 59 59 GLN H H 60 9.009 9.009 8.521 0.488 18003
8494 1 14 . 1 1 60 60 SER N N 61 115.101 115.101 115.063 0.038 18003
8495 1 14 . 1 1 60 60 SER C C 61 176.801 176.801 176.202 0.599 18003
8496 1 14 . 1 1 60 60 SER CA C 61 61.213 61.213 60.921 0.292 18003
8497 1 14 . 1 1 60 60 SER H H 61 8.964 8.964 8.316 0.647 18003
8498 1 14 . 1 1 61 61 ALA N N 62 126.069 126.069 124.488 1.581 18003
8499 1 14 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.202 0.149 18003
8500 1 14 . 1 1 61 61 ALA C C 62 180.635 180.635 179.852 0.783 18003
8501 1 14 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.722 -0.464 18003
8502 1 14 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.217 0.406 18003
8503 1 14 . 1 1 61 61 ALA H H 62 7.103 7.103 7.602 -0.499 18003
8504 1 14 . 1 1 62 62 VAL N N 63 119.252 119.252 119.156 0.096 18003
8505 1 14 . 1 1 62 62 VAL C C 63 177.842 177.842 178.011 -0.169 18003
8506 1 14 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.101 0.697 18003
8507 1 14 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.861 -0.597 18003
8508 1 14 . 1 1 62 62 VAL H H 63 7.971 7.971 7.503 0.468 18003
8509 1 14 . 1 1 63 63 SER N N 64 115.494 115.494 115.914 -0.420 18003
8510 1 14 . 1 1 63 63 SER HA H 64 4.034 4.034 3.878 0.156 18003
8511 1 14 . 1 1 63 63 SER C C 64 176.835 176.835 176.903 -0.068 18003
8512 1 14 . 1 1 63 63 SER CA C 64 62.400 62.400 61.915 0.485 18003
8513 1 14 . 1 1 63 63 SER CB C 64 62.752 62.752 62.249 0.503 18003
8514 1 14 . 1 1 63 63 SER H H 64 8.743 8.743 8.072 0.671 18003
8515 1 14 . 1 1 64 64 HIS N N 65 120.010 120.010 121.234 -1.224 18003
8516 1 14 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.362 -0.002 18003
8517 1 14 . 1 1 64 64 HIS C C 65 177.731 177.731 177.842 -0.111 18003
8518 1 14 . 1 1 64 64 HIS CA C 65 59.998 59.998 59.465 0.533 18003
8519 1 14 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.363 0.571 18003
8520 1 14 . 1 1 64 64 HIS H H 65 7.804 7.804 7.980 -0.176 18003
8521 1 14 . 1 1 65 65 GLN N N 66 115.590 115.590 119.107 -3.517 18003
8522 1 14 . 1 1 65 65 GLN HA H 66 4.035 4.035 4.023 0.012 18003
8523 1 14 . 1 1 65 65 GLN C C 66 179.055 179.055 178.643 0.412 18003
8524 1 14 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.768 -1.238 18003
8525 1 14 . 1 1 65 65 GLN H H 66 7.751 7.751 7.924 -0.173 18003
8526 1 14 . 1 1 66 66 LEU N N 67 118.746 118.746 120.941 -2.195 18003
8527 1 14 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.937 0.010 18003
8528 1 14 . 1 1 66 66 LEU C C 67 178.334 178.334 178.435 -0.101 18003
8529 1 14 . 1 1 66 66 LEU CA C 67 57.846 57.846 57.945 -0.099 18003
8530 1 14 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.633 -0.530 18003
8531 1 14 . 1 1 66 66 LEU H H 67 8.648 8.648 8.322 0.326 18003
8532 1 14 . 1 1 67 67 ARG N N 68 119.610 119.610 119.204 0.406 18003
8533 1 14 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.932 0.011 18003
8534 1 14 . 1 1 67 67 ARG C C 68 178.807 178.807 178.891 -0.084 18003
8535 1 14 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.627 -0.250 18003
8536 1 14 . 1 1 67 67 ARG CB C 68 29.475 29.475 30.040 -0.565 18003
8537 1 14 . 1 1 67 67 ARG H H 68 7.607 7.607 7.780 -0.173 18003
8538 1 14 . 1 1 68 68 VAL N N 69 119.719 119.719 120.173 -0.454 18003
8539 1 14 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.802 -0.169 18003
8540 1 14 . 1 1 68 68 VAL C C 69 178.690 178.690 177.356 1.334 18003
8541 1 14 . 1 1 68 68 VAL CA C 69 66.454 66.454 65.319 1.135 18003
8542 1 14 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.481 0.298 18003
8543 1 14 . 1 1 68 68 VAL H H 69 7.259 7.259 7.837 -0.578 18003
8544 1 14 . 1 1 69 69 LEU N N 70 117.532 117.532 119.922 -2.390 18003
8545 1 14 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.877 0.071 18003
8546 1 14 . 1 1 69 69 LEU C C 70 179.144 179.144 178.931 0.213 18003
8547 1 14 . 1 1 69 69 LEU CA C 70 57.750 57.750 58.136 -0.386 18003
8548 1 14 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.179 0.681 18003
8549 1 14 . 1 1 69 69 LEU H H 70 8.375 8.375 8.265 0.110 18003
8550 1 14 . 1 1 70 70 ARG N N 71 122.498 122.498 117.896 4.602 18003
8551 1 14 . 1 1 70 70 ARG HA H 71 3.931 3.931 4.093 -0.162 18003
8552 1 14 . 1 1 70 70 ARG C C 71 180.499 180.499 178.813 1.686 18003
8553 1 14 . 1 1 70 70 ARG CA C 71 58.777 58.777 58.801 -0.024 18003
8554 1 14 . 1 1 70 70 ARG CB C 71 30.155 30.155 29.510 0.645 18003
8555 1 14 . 1 1 70 70 ARG H H 71 8.822 8.822 8.361 0.461 18003
8556 1 14 . 1 1 71 71 ASN N N 72 121.816 121.816 117.858 3.958 18003
8557 1 14 . 1 1 71 71 ASN C C 72 177.170 177.170 177.838 -0.668 18003
8558 1 14 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.638 0.139 18003
8559 1 14 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.475 -0.741 18003
8560 1 14 . 1 1 71 71 ASN H H 72 8.144 8.144 7.856 0.288 18003
8561 1 14 . 1 1 72 72 LEU N N 73 117.044 117.044 118.161 -1.117 18003
8562 1 14 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.187 0.158 18003
8563 1 14 . 1 1 72 72 LEU C C 73 176.984 176.984 178.116 -1.132 18003
8564 1 14 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.218 -1.093 18003
8565 1 14 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.487 0.782 18003
8566 1 14 . 1 1 72 72 LEU H H 73 7.804 7.804 7.755 0.049 18003
8567 1 14 . 1 1 73 73 GLY N N 74 106.621 106.621 104.600 2.021 18003
8568 1 14 . 1 1 73 73 GLY C C 74 173.266 173.266 174.669 -1.403 18003
8569 1 14 . 1 1 73 73 GLY CA C 74 46.022 46.022 45.189 0.833 18003
8570 1 14 . 1 1 73 73 GLY H H 74 7.851 7.851 8.370 -0.519 18003
8571 1 14 . 1 1 74 74 LEU N N 75 114.582 114.582 119.308 -4.726 18003
8572 1 14 . 1 1 74 74 LEU C C 75 177.562 177.562 176.249 1.313 18003
8573 1 14 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.145 0.886 18003
8574 1 14 . 1 1 74 74 LEU CB C 75 44.444 44.444 42.925 1.519 18003
8575 1 14 . 1 1 74 74 LEU H H 75 7.808 7.808 7.834 -0.026 18003
8576 1 14 . 1 1 75 75 VAL N N 76 110.980 110.980 112.027 -1.047 18003
8577 1 14 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.763 -0.236 18003
8578 1 14 . 1 1 75 75 VAL C C 76 173.922 173.922 174.184 -0.262 18003
8579 1 14 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.280 -2.337 18003
8580 1 14 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.411 0.618 18003
8581 1 14 . 1 1 75 75 VAL H H 76 7.079 7.079 7.360 -0.281 18003
8582 1 14 . 1 1 76 76 VAL N N 77 118.619 118.619 119.932 -1.313 18003
8583 1 14 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.454 0.848 18003
8584 1 14 . 1 1 76 76 VAL C C 77 174.041 174.041 174.545 -0.504 18003
8585 1 14 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.560 -0.562 18003
8586 1 14 . 1 1 76 76 VAL H H 77 9.024 9.024 9.123 -0.099 18003
8587 1 14 . 1 1 77 77 GLY N N 78 109.451 109.451 109.539 -0.088 18003
8588 1 14 . 1 1 77 77 GLY C C 78 172.225 172.225 172.770 -0.545 18003
8589 1 14 . 1 1 77 77 GLY CA C 78 44.462 44.462 44.051 0.411 18003
8590 1 14 . 1 1 77 77 GLY H H 78 8.265 8.265 8.350 -0.085 18003
8591 1 14 . 1 1 78 78 ASP N N 79 122.826 122.826 119.992 2.834 18003
8592 1 14 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.814 -0.068 18003
8593 1 14 . 1 1 78 78 ASP C C 79 174.817 174.817 175.469 -0.652 18003
8594 1 14 . 1 1 78 78 ASP CA C 79 53.111 53.111 53.100 0.011 18003
8595 1 14 . 1 1 78 78 ASP CB C 79 43.655 43.655 43.706 -0.052 18003
8596 1 14 . 1 1 78 78 ASP H H 79 8.479 8.479 8.386 0.093 18003
8597 1 14 . 1 1 79 79 ARG N N 80 122.613 122.613 123.356 -0.743 18003
8598 1 14 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.700 -0.288 18003
8599 1 14 . 1 1 79 79 ARG C C 80 175.546 175.546 175.741 -0.195 18003
8600 1 14 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.528 -0.210 18003
8601 1 14 . 1 1 79 79 ARG CB C 80 30.376 30.376 31.579 -1.204 18003
8602 1 14 . 1 1 79 79 ARG H H 80 8.580 8.580 8.579 0.001 18003
8603 1 14 . 1 1 80 80 ALA N N 81 129.263 129.263 122.721 6.542 18003
8604 1 14 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.479 -0.027 18003
8605 1 14 . 1 1 80 80 ALA C C 81 177.126 177.126 177.066 0.060 18003
8606 1 14 . 1 1 80 80 ALA CA C 81 51.620 51.620 52.139 -0.520 18003
8607 1 14 . 1 1 80 80 ALA CB C 81 19.260 19.260 20.433 -1.173 18003
8608 1 14 . 1 1 80 80 ALA H H 81 8.396 8.396 8.527 -0.131 18003
8609 1 14 . 1 1 81 81 GLY N N 82 112.739 112.739 113.162 -0.423 18003
8610 1 14 . 1 1 81 81 GLY C C 82 174.856 174.856 174.640 0.216 18003
8611 1 14 . 1 1 81 81 GLY CA C 82 46.392 46.392 46.869 -0.477 18003
8612 1 14 . 1 1 81 81 GLY H H 82 8.641 8.641 8.544 0.097 18003
8613 1 14 . 1 1 82 82 ARG N N 83 124.780 124.780 124.462 0.318 18003
8614 1 14 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.607 -0.284 18003
8615 1 14 . 1 1 82 82 ARG C C 83 176.339 176.339 174.608 1.731 18003
8616 1 14 . 1 1 82 82 ARG CA C 83 56.690 56.690 55.235 1.455 18003
8617 1 14 . 1 1 82 82 ARG CB C 83 30.221 30.221 30.991 -0.770 18003
8618 1 14 . 1 1 82 82 ARG H H 83 8.728 8.728 8.137 0.591 18003
8619 1 14 . 1 1 83 83 SER N N 84 114.678 114.678 114.763 -0.085 18003
8620 1 14 . 1 1 83 83 SER C C 84 172.869 172.869 171.935 0.934 18003
8621 1 14 . 1 1 83 83 SER CA C 84 56.834 56.834 57.630 -0.796 18003
8622 1 14 . 1 1 83 83 SER CB C 84 65.191 65.191 65.954 -0.763 18003
8623 1 14 . 1 1 83 83 SER H H 84 7.821 7.821 8.283 -0.462 18003
8624 1 14 . 1 1 84 84 ILE N N 85 122.996 122.996 116.037 6.959 18003
8625 1 14 . 1 1 84 84 ILE C C 85 175.521 175.521 173.639 1.882 18003
8626 1 14 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.565 0.670 18003
8627 1 14 . 1 1 84 84 ILE CB C 85 38.136 38.136 41.473 -3.337 18003
8628 1 14 . 1 1 84 84 ILE H H 85 8.232 8.232 8.080 0.152 18003
8629 1 14 . 1 1 85 85 VAL N N 86 121.845 121.845 120.338 1.507 18003
8630 1 14 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.133 0.177 18003
8631 1 14 . 1 1 85 85 VAL C C 86 174.818 174.818 174.198 0.620 18003
8632 1 14 . 1 1 85 85 VAL CA C 86 59.738 59.738 59.619 0.119 18003
8633 1 14 . 1 1 85 85 VAL CB C 86 34.221 34.221 36.079 -1.858 18003
8634 1 14 . 1 1 85 85 VAL H H 86 8.495 8.495 8.341 0.154 18003
8635 1 14 . 1 1 86 86 TYR N N 87 125.020 125.020 121.765 3.255 18003
8636 1 14 . 1 1 86 86 TYR HA H 87 4.319 4.319 4.973 -0.654 18003
8637 1 14 . 1 1 86 86 TYR C C 87 173.808 173.808 176.056 -2.248 18003
8638 1 14 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.168 0.297 18003
8639 1 14 . 1 1 86 86 TYR CB C 87 41.480 41.480 40.233 1.247 18003
8640 1 14 . 1 1 86 86 TYR H H 87 8.488 8.488 8.458 0.030 18003
8641 1 14 . 1 1 87 87 SER N N 88 110.681 110.681 114.151 -3.470 18003
8642 1 14 . 1 1 87 87 SER HA H 88 5.414 5.414 4.961 0.453 18003
8643 1 14 . 1 1 87 87 SER C C 88 174.693 174.693 173.106 1.587 18003
8644 1 14 . 1 1 87 87 SER CA C 88 56.113 56.113 56.256 -0.143 18003
8645 1 14 . 1 1 87 87 SER CB C 88 66.309 66.309 65.884 0.425 18003
8646 1 14 . 1 1 87 87 SER H H 88 8.718 8.718 9.247 -0.529 18003
8647 1 14 . 1 1 88 88 LEU N N 89 119.612 119.612 121.938 -2.326 18003
8648 1 14 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.210 0.717 18003
8649 1 14 . 1 1 88 88 LEU C C 89 179.031 179.031 177.964 1.067 18003
8650 1 14 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.647 -0.322 18003
8651 1 14 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.483 -0.763 18003
8652 1 14 . 1 1 88 88 LEU H H 89 9.034 9.034 8.524 0.510 18003
8653 1 14 . 1 1 89 89 TYR N N 90 120.540 120.540 123.818 -3.278 18003
8654 1 14 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.170 0.452 18003
8655 1 14 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.986 0.726 18003
8656 1 14 . 1 1 89 89 TYR H H 90 8.075 8.075 8.504 -0.429 18003
8657 1 14 . 1 1 92 92 HIS C C 93 177.850 177.850 177.361 0.489 18003
8658 1 14 . 1 1 93 93 VAL N N 94 120.211 120.211 118.369 1.842 18003
8659 1 14 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.685 -0.184 18003
8660 1 14 . 1 1 93 93 VAL C C 94 176.785 176.785 176.783 0.002 18003
8661 1 14 . 1 1 93 93 VAL CA C 94 66.666 66.666 65.884 0.782 18003
8662 1 14 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.669 -0.032 18003
8663 1 14 . 1 1 93 93 VAL H H 94 8.164 8.164 7.872 0.292 18003
8664 1 14 . 1 1 94 94 ALA N N 95 119.221 119.221 120.948 -1.727 18003
8665 1 14 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.914 -0.124 18003
8666 1 14 . 1 1 94 94 ALA C C 95 177.979 177.979 179.130 -1.151 18003
8667 1 14 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.088 0.391 18003
8668 1 14 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.113 -0.003 18003
8669 1 14 . 1 1 94 94 ALA H H 95 6.942 6.942 7.961 -1.019 18003
8670 1 14 . 1 1 95 95 GLN N N 96 115.416 115.416 119.969 -4.553 18003
8671 1 14 . 1 1 95 95 GLN HA H 96 4.035 4.035 3.991 0.044 18003
8672 1 14 . 1 1 95 95 GLN C C 96 177.993 177.993 178.272 -0.279 18003
8673 1 14 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.660 0.182 18003
8674 1 14 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.791 -0.762 18003
8675 1 14 . 1 1 95 95 GLN H H 96 7.795 7.795 8.219 -0.424 18003
8676 1 14 . 1 1 96 96 LEU N N 97 120.758 120.758 121.295 -0.537 18003
8677 1 14 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.004 -0.155 18003
8678 1 14 . 1 1 96 96 LEU C C 97 177.974 177.974 178.588 -0.614 18003
8679 1 14 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.114 1.168 18003
8680 1 14 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.914 -0.869 18003
8681 1 14 . 1 1 96 96 LEU H H 97 8.197 8.197 7.890 0.307 18003
8682 1 14 . 1 1 97 97 LEU N N 98 117.567 117.567 119.338 -1.771 18003
8683 1 14 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.824 0.006 18003
8684 1 14 . 1 1 97 97 LEU C C 98 178.219 178.219 178.878 -0.659 18003
8685 1 14 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.296 -0.566 18003
8686 1 14 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.153 0.709 18003
8687 1 14 . 1 1 97 97 LEU H H 98 7.660 7.660 8.116 -0.456 18003
8688 1 14 . 1 1 98 98 ASP N N 99 118.607 118.607 119.810 -1.203 18003
8689 1 14 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.297 -0.188 18003
8690 1 14 . 1 1 98 98 ASP C C 99 179.382 179.382 178.962 0.420 18003
8691 1 14 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.473 0.562 18003
8692 1 14 . 1 1 98 98 ASP CB C 99 39.839 39.839 39.846 -0.007 18003
8693 1 14 . 1 1 98 98 ASP H H 99 8.295 8.295 8.165 0.130 18003
8694 1 14 . 1 1 99 99 GLU N N 100 117.542 117.542 119.449 -1.907 18003
8695 1 14 . 1 1 99 99 GLU HA H 100 3.849 3.849 3.731 0.118 18003
8696 1 14 . 1 1 99 99 GLU C C 100 179.389 179.389 178.627 0.762 18003
8697 1 14 . 1 1 99 99 GLU CA C 100 58.023 58.023 58.816 -0.793 18003
8698 1 14 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.261 -0.232 18003
8699 1 14 . 1 1 99 99 GLU H H 100 8.334 8.334 7.902 0.432 18003
8700 1 14 . 1 1 100 100 ALA N N 101 122.890 122.890 123.741 -0.851 18003
8701 1 14 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.157 -0.159 18003
8702 1 14 . 1 1 100 100 ALA C C 101 180.184 180.184 179.873 0.311 18003
8703 1 14 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.145 0.374 18003
8704 1 14 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.505 -0.886 18003
8705 1 14 . 1 1 100 100 ALA H H 101 8.550 8.550 8.257 0.293 18003
8706 1 14 . 1 1 101 101 ILE N N 102 119.952 119.952 118.820 1.132 18003
8707 1 14 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.699 -0.110 18003
8708 1 14 . 1 1 101 101 ILE C C 102 178.114 178.114 178.104 0.010 18003
8709 1 14 . 1 1 101 101 ILE CA C 102 65.376 65.376 65.072 0.304 18003
8710 1 14 . 1 1 101 101 ILE CB C 102 38.029 38.029 36.977 1.052 18003
8711 1 14 . 1 1 101 101 ILE H H 102 8.493 8.493 8.479 0.014 18003
8712 1 14 . 1 1 102 102 TYR N N 103 120.625 120.625 119.271 1.354 18003
8713 1 14 . 1 1 102 102 TYR HA H 103 4.171 4.171 3.766 0.405 18003
8714 1 14 . 1 1 102 102 TYR C C 103 179.772 179.772 178.413 1.359 18003
8715 1 14 . 1 1 102 102 TYR CA C 103 60.724 60.724 60.876 -0.152 18003
8716 1 14 . 1 1 102 102 TYR CB C 103 37.500 37.500 36.863 0.637 18003
8717 1 14 . 1 1 102 102 TYR H H 103 8.520 8.520 8.281 0.239 18003
8718 1 14 . 1 1 103 103 HIS N N 104 117.456 117.456 118.692 -1.236 18003
8719 1 14 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.364 0.061 18003
8720 1 14 . 1 1 103 103 HIS C C 104 176.377 176.377 178.218 -1.841 18003
8721 1 14 . 1 1 103 103 HIS CA C 104 60.043 60.043 58.804 1.239 18003
8722 1 14 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.875 -0.847 18003
8723 1 14 . 1 1 103 103 HIS H H 104 8.622 8.622 8.310 0.312 18003
8724 1 14 . 1 1 104 104 SER N N 105 113.596 113.596 115.142 -1.546 18003
8725 1 14 . 1 1 104 104 SER C C 105 176.712 176.712 175.588 1.124 18003
8726 1 14 . 1 1 104 104 SER CA C 105 61.852 61.852 61.719 0.133 18003
8727 1 14 . 1 1 104 104 SER CB C 105 63.550 63.550 63.302 0.248 18003
8728 1 14 . 1 1 104 104 SER H H 105 7.900 7.900 8.378 -0.478 18003
8729 1 14 . 1 1 105 105 GLU N N 106 119.022 119.022 119.578 -0.556 18003
8730 1 14 . 1 1 105 105 GLU HA H 106 4.013 4.013 4.040 -0.027 18003
8731 1 14 . 1 1 105 105 GLU C C 106 177.902 177.902 179.160 -1.258 18003
8732 1 14 . 1 1 105 105 GLU CA C 106 58.031 58.031 59.234 -1.203 18003
8733 1 14 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.883 -0.604 18003
8734 1 14 . 1 1 105 105 GLU H H 106 8.181 8.181 7.695 0.486 18003
8735 1 14 . 1 1 106 106 HIS N N 107 116.482 116.482 117.689 -1.207 18003
8736 1 14 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.347 0.060 18003
8737 1 14 . 1 1 106 106 HIS C C 107 175.575 175.575 176.210 -0.635 18003
8738 1 14 . 1 1 106 106 HIS CA C 107 57.343 57.343 57.754 -0.411 18003
8739 1 14 . 1 1 106 106 HIS CB C 107 28.580 28.580 30.512 -1.932 18003
8740 1 14 . 1 1 106 106 HIS H H 107 7.770 7.770 8.116 -0.346 18003
8741 1 14 . 1 1 107 107 LEU N N 108 120.346 120.346 119.695 0.651 18003
8742 1 14 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.606 -0.552 18003
8743 1 14 . 1 1 107 107 LEU C C 108 177.404 177.404 174.430 2.974 18003
8744 1 14 . 1 1 107 107 LEU CA C 108 55.991 55.991 54.252 1.739 18003
8745 1 14 . 1 1 107 107 LEU CB C 108 42.030 42.030 43.513 -1.483 18003
8746 1 14 . 1 1 107 107 LEU H H 108 7.682 7.682 8.020 -0.338 18003
8747 1 14 . 1 1 108 108 HIS N N 109 117.222 117.222 123.175 -5.953 18003
8748 1 14 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.831 -0.777 18003
8749 1 14 . 1 1 108 108 HIS C C 109 174.606 174.606 174.470 0.136 18003
8750 1 14 . 1 1 108 108 HIS CA C 109 56.029 56.029 54.348 1.681 18003
8751 1 14 . 1 1 108 108 HIS CB C 109 28.517 28.517 29.988 -1.471 18003
8752 1 14 . 1 1 108 108 HIS H H 109 8.030 8.030 8.157 -0.127 18003
8753 1 14 . 1 1 109 109 LEU N N 110 121.114 121.114 125.163 -4.049 18003
8754 1 14 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.126 0.172 18003
8755 1 14 . 1 1 109 109 LEU C C 110 178.028 178.028 177.877 0.151 18003
8756 1 14 . 1 1 109 109 LEU CA C 110 55.574 55.574 55.641 -0.067 18003
8757 1 14 . 1 1 109 109 LEU CB C 110 42.076 42.076 42.191 -0.115 18003
8758 1 14 . 1 1 109 109 LEU H H 110 7.973 7.973 8.715 -0.742 18003
8759 1 14 . 1 1 110 110 GLY N N 111 108.631 108.631 107.483 1.148 18003
8760 1 14 . 1 1 110 110 GLY C C 111 174.606 174.606 174.628 -0.022 18003
8761 1 14 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.725 0.855 18003
8762 1 14 . 1 1 110 110 GLY H H 111 8.255 8.255 8.187 0.068 18003
8763 1 14 . 1 1 111 111 LEU N N 112 121.022 121.022 120.925 0.097 18003
8764 1 14 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.669 -0.310 18003
8765 1 14 . 1 1 111 111 LEU C C 112 177.701 177.701 176.587 1.114 18003
8766 1 14 . 1 1 111 111 LEU CA C 112 55.476 55.476 54.169 1.307 18003
8767 1 14 . 1 1 111 111 LEU CB C 112 41.899 41.899 43.444 -1.545 18003
8768 1 14 . 1 1 111 111 LEU H H 112 7.981 7.981 7.872 0.109 18003
8769 1 14 . 1 1 112 112 SER N N 113 115.471 115.471 119.121 -3.650 18003
8770 1 14 . 1 1 112 112 SER HA H 113 4.432 4.432 4.488 -0.056 18003
8771 1 14 . 1 1 112 112 SER C C 113 174.381 174.381 174.967 -0.586 18003
8772 1 14 . 1 1 112 112 SER CA C 113 58.527 58.527 58.033 0.494 18003
8773 1 14 . 1 1 112 112 SER CB C 113 63.593 63.593 64.270 -0.677 18003
8774 1 14 . 1 1 112 112 SER H H 113 8.215 8.215 8.505 -0.290 18003
8775 1 14 . 1 1 113 113 ASP N N 114 121.696 121.696 123.110 -1.414 18003
8776 1 14 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.742 -0.315 18003
8777 1 14 . 1 1 113 113 ASP C C 114 175.958 175.958 176.060 -0.102 18003
8778 1 14 . 1 1 113 113 ASP CA C 114 54.213 54.213 54.729 -0.516 18003
8779 1 14 . 1 1 113 113 ASP CB C 114 41.030 41.030 40.558 0.472 18003
8780 1 14 . 1 1 113 113 ASP H H 114 8.203 8.203 8.638 -0.435 18003
8781 1 14 . 1 1 114 114 ARG N N 115 120.088 120.088 117.633 2.455 18003
8782 1 14 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.668 -0.396 18003
8783 1 14 . 1 1 114 114 ARG C C 115 175.792 175.792 174.314 1.478 18003
8784 1 14 . 1 1 114 114 ARG CA C 115 55.735 55.735 55.593 0.142 18003
8785 1 14 . 1 1 114 114 ARG CB C 115 30.586 30.586 32.726 -2.140 18003
8786 1 14 . 1 1 114 114 ARG H H 115 8.016 8.016 7.642 0.374 18003
8787 1 14 . 1 1 115 115 HIS N N 116 120.597 120.597 118.948 1.649 18003
8788 1 14 . 1 1 115 115 HIS CA C 116 53.697 53.697 56.601 -2.904 18003
8789 1 14 . 1 1 115 115 HIS CB C 116 29.299 29.299 29.964 -0.665 18003
8790 1 14 . 1 1 115 115 HIS H H 116 8.385 8.385 8.467 -0.082 18003
8791 1 14 . 1 1 116 116 PRO HA H 117 4.482 4.482 3.855 0.627 18003
8792 1 14 . 1 1 116 116 PRO C C 117 177.090 177.090 176.832 0.258 18003
8793 1 14 . 1 1 116 116 PRO CA C 117 63.177 63.177 63.453 -0.276 18003
8794 1 14 . 1 1 116 116 PRO CB C 117 31.820 31.820 31.328 0.492 18003
8795 1 14 . 1 1 117 117 SER N N 118 116.220 116.220 114.252 1.968 18003
8796 1 14 . 1 1 117 117 SER HA H 118 4.465 4.465 4.293 0.172 18003
8797 1 14 . 1 1 117 117 SER C C 118 174.287 174.287 174.013 0.274 18003
8798 1 14 . 1 1 117 117 SER CA C 118 58.110 58.110 58.236 -0.126 18003
8799 1 14 . 1 1 117 117 SER CB C 118 63.750 63.750 63.986 -0.236 18003
8800 1 14 . 1 1 117 117 SER H H 118 8.487 8.487 7.725 0.762 18003
8801 1 14 . 1 1 118 118 ALA N N 119 126.082 126.082 127.224 -1.142 18003
8802 1 14 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.550 -0.111 18003
8803 1 14 . 1 1 118 118 ALA C C 119 176.879 176.879 176.043 0.836 18003
8804 1 14 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.259 0.190 18003
8805 1 14 . 1 1 118 118 ALA CB C 119 19.483 19.483 19.746 -0.263 18003
8806 1 14 . 1 1 118 118 ALA H H 119 8.295 8.295 8.415 -0.120 18003
8807 1 15 . 1 1 2 2 HIS C C 3 175.176 175.176 176.213 -1.037 18003
8808 1 15 . 1 1 2 2 HIS CA C 3 55.900 55.900 56.306 -0.406 18003
8809 1 15 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.080 -0.051 18003
8810 1 15 . 1 1 3 3 GLY N N 4 110.613 110.613 107.826 2.787 18003
8811 1 15 . 1 1 3 3 GLY C C 4 174.068 174.068 173.502 0.566 18003
8812 1 15 . 1 1 3 3 GLY CA C 4 45.141 45.141 44.267 0.874 18003
8813 1 15 . 1 1 3 3 GLY H H 4 8.500 8.500 8.111 0.389 18003
8814 1 15 . 1 1 4 4 VAL N N 5 119.318 119.318 117.600 1.718 18003
8815 1 15 . 1 1 4 4 VAL HA H 5 4.128 4.128 3.843 0.285 18003
8816 1 15 . 1 1 4 4 VAL C C 5 176.361 176.361 174.254 2.107 18003
8817 1 15 . 1 1 4 4 VAL CA C 5 61.987 61.987 63.251 -1.264 18003
8818 1 15 . 1 1 4 4 VAL CB C 5 32.635 32.635 31.945 0.690 18003
8819 1 15 . 1 1 4 4 VAL H H 5 8.094 8.094 8.176 -0.082 18003
8820 1 15 . 1 1 5 5 GLU N N 6 124.369 124.369 125.595 -1.226 18003
8821 1 15 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.519 -0.231 18003
8822 1 15 . 1 1 5 5 GLU C C 6 177.012 177.012 176.786 0.226 18003
8823 1 15 . 1 1 5 5 GLU CA C 6 56.699 56.699 55.658 1.041 18003
8824 1 15 . 1 1 5 5 GLU CB C 6 30.029 30.029 30.766 -0.737 18003
8825 1 15 . 1 1 5 5 GLU H H 6 8.545 8.545 8.391 0.154 18003
8826 1 15 . 1 1 6 6 GLY N N 7 109.747 109.747 114.231 -4.484 18003
8827 1 15 . 1 1 6 6 GLY C C 7 174.117 174.117 175.277 -1.160 18003
8828 1 15 . 1 1 6 6 GLY CA C 7 45.568 45.568 45.076 0.492 18003
8829 1 15 . 1 1 6 6 GLY H H 7 8.352 8.352 8.645 -0.293 18003
8830 1 15 . 1 1 7 7 ARG N N 8 120.059 120.059 120.522 -0.463 18003
8831 1 15 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.101 0.241 18003
8832 1 15 . 1 1 7 7 ARG C C 8 176.016 176.016 175.326 0.690 18003
8833 1 15 . 1 1 7 7 ARG CA C 8 55.833 55.833 57.664 -1.831 18003
8834 1 15 . 1 1 7 7 ARG CB C 8 30.444 30.444 30.633 -0.189 18003
8835 1 15 . 1 1 7 7 ARG H H 8 8.084 8.084 8.422 -0.338 18003
8836 1 15 . 1 1 8 8 ASN N N 9 119.379 119.379 116.368 3.011 18003
8837 1 15 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.744 -0.412 18003
8838 1 15 . 1 1 8 8 ASN C C 9 174.667 174.667 173.961 0.706 18003
8839 1 15 . 1 1 8 8 ASN CA C 9 53.441 53.441 53.024 0.417 18003
8840 1 15 . 1 1 8 8 ASN CB C 9 38.480 38.480 39.731 -1.251 18003
8841 1 15 . 1 1 8 8 ASN H H 9 8.411 8.411 7.861 0.550 18003
8842 1 15 . 1 1 9 9 ARG N N 10 121.700 121.700 121.008 0.692 18003
8843 1 15 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.582 0.067 18003
8844 1 15 . 1 1 9 9 ARG CA C 10 53.147 53.147 55.699 -2.552 18003
8845 1 15 . 1 1 9 9 ARG CB C 10 30.197 30.197 30.770 -0.573 18003
8846 1 15 . 1 1 9 9 ARG H H 10 8.138 8.138 8.562 -0.424 18003
8847 1 15 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.630 -0.187 18003
8848 1 15 . 1 1 10 10 PRO C C 11 176.815 176.815 175.867 0.948 18003
8849 1 15 . 1 1 10 10 PRO CA C 11 63.177 63.177 62.879 0.298 18003
8850 1 15 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.462 -0.642 18003
8851 1 15 . 1 1 11 11 SER N N 12 116.291 116.291 117.559 -1.268 18003
8852 1 15 . 1 1 11 11 SER HA H 12 4.418 4.418 4.576 -0.158 18003
8853 1 15 . 1 1 11 11 SER C C 12 173.702 173.702 173.466 0.236 18003
8854 1 15 . 1 1 11 11 SER CA C 12 58.031 58.031 57.830 0.201 18003
8855 1 15 . 1 1 11 11 SER CB C 12 64.032 64.032 63.685 0.347 18003
8856 1 15 . 1 1 11 11 SER H H 12 8.325 8.325 8.355 -0.030 18003
8857 1 15 . 1 1 12 12 ALA N N 13 126.862 126.862 125.563 1.299 18003
8858 1 15 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.457 -0.069 18003
8859 1 15 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.044 -0.586 18003
8860 1 15 . 1 1 12 12 ALA CB C 13 18.257 18.257 19.452 -1.195 18003
8861 1 15 . 1 1 12 12 ALA H H 13 8.166 8.166 8.210 -0.044 18003
8862 1 15 . 1 1 13 13 PRO C C 14 176.368 176.368 175.928 0.440 18003
8863 1 15 . 1 1 13 13 PRO CA C 14 62.937 62.937 63.077 -0.140 18003
8864 1 15 . 1 1 13 13 PRO CB C 14 32.022 32.022 31.194 0.828 18003
8865 1 15 . 1 1 14 14 LEU N N 15 120.969 120.969 126.289 -5.320 18003
8866 1 15 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.436 -0.178 18003
8867 1 15 . 1 1 14 14 LEU C C 15 176.124 176.124 177.116 -0.992 18003
8868 1 15 . 1 1 14 14 LEU CA C 15 54.527 54.527 54.618 -0.091 18003
8869 1 15 . 1 1 14 14 LEU CB C 15 43.418 43.418 42.334 1.084 18003
8870 1 15 . 1 1 14 14 LEU H H 15 7.875 7.875 8.244 -0.369 18003
8871 1 15 . 1 1 15 15 ASP N N 16 121.780 121.780 124.488 -2.708 18003
8872 1 15 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.631 -0.038 18003
8873 1 15 . 1 1 15 15 ASP C C 16 176.208 176.208 177.802 -1.594 18003
8874 1 15 . 1 1 15 15 ASP CA C 16 52.468 52.468 56.483 -4.015 18003
8875 1 15 . 1 1 15 15 ASP CB C 16 41.629 41.629 41.030 0.599 18003
8876 1 15 . 1 1 15 15 ASP H H 16 7.850 7.850 8.893 -1.043 18003
8877 1 15 . 1 1 16 16 SER N N 17 114.435 114.435 115.406 -0.971 18003
8878 1 15 . 1 1 16 16 SER HA H 17 4.120 4.120 4.126 -0.006 18003
8879 1 15 . 1 1 16 16 SER C C 17 177.207 177.207 176.445 0.762 18003
8880 1 15 . 1 1 16 16 SER CA C 17 62.322 62.322 61.326 0.996 18003
8881 1 15 . 1 1 16 16 SER H H 17 8.658 8.658 8.549 0.109 18003
8882 1 15 . 1 1 17 17 GLN N N 18 122.403 122.403 118.652 3.751 18003
8883 1 15 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.121 0.076 18003
8884 1 15 . 1 1 17 17 GLN C C 18 178.715 178.715 178.111 0.604 18003
8885 1 15 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.654 -0.541 18003
8886 1 15 . 1 1 17 17 GLN CB C 18 28.040 28.040 27.953 0.087 18003
8887 1 15 . 1 1 17 17 GLN H H 18 8.140 8.140 8.705 -0.565 18003
8888 1 15 . 1 1 18 18 ALA N N 19 124.743 124.743 122.510 2.233 18003
8889 1 15 . 1 1 18 18 ALA HA H 19 4.176 4.176 3.964 0.212 18003
8890 1 15 . 1 1 18 18 ALA C C 19 180.616 180.616 179.520 1.096 18003
8891 1 15 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.920 -0.315 18003
8892 1 15 . 1 1 18 18 ALA CB C 19 19.028 19.028 17.893 1.135 18003
8893 1 15 . 1 1 18 18 ALA H H 19 8.455 8.455 7.653 0.802 18003
8894 1 15 . 1 1 19 19 ALA N N 20 119.089 119.089 120.560 -1.471 18003
8895 1 15 . 1 1 19 19 ALA HA H 20 4.179 4.179 3.958 0.221 18003
8896 1 15 . 1 1 19 19 ALA C C 20 179.239 179.239 179.433 -0.194 18003
8897 1 15 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.901 0.370 18003
8898 1 15 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.265 -0.073 18003
8899 1 15 . 1 1 19 19 ALA H H 20 8.993 8.993 7.875 1.118 18003
8900 1 15 . 1 1 20 20 ALA N N 21 119.226 119.226 120.938 -1.712 18003
8901 1 15 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.882 0.178 18003
8902 1 15 . 1 1 20 20 ALA C C 21 180.230 180.230 179.977 0.253 18003
8903 1 15 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.175 -0.032 18003
8904 1 15 . 1 1 20 20 ALA CB C 21 18.028 18.028 17.980 0.049 18003
8905 1 15 . 1 1 20 20 ALA H H 21 7.724 7.724 7.864 -0.140 18003
8906 1 15 . 1 1 21 21 GLN N N 22 119.310 119.310 117.909 1.401 18003
8907 1 15 . 1 1 21 21 GLN HA H 22 4.129 4.129 4.017 0.112 18003
8908 1 15 . 1 1 21 21 GLN C C 22 179.319 179.319 178.739 0.580 18003
8909 1 15 . 1 1 21 21 GLN CA C 22 58.762 58.762 58.784 -0.022 18003
8910 1 15 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.349 -0.320 18003
8911 1 15 . 1 1 21 21 GLN H H 22 7.638 7.638 8.511 -0.873 18003
8912 1 15 . 1 1 22 22 VAL N N 23 121.565 121.565 119.864 1.701 18003
8913 1 15 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.635 0.331 18003
8914 1 15 . 1 1 22 22 VAL C C 23 178.026 178.026 177.820 0.206 18003
8915 1 15 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.100 0.042 18003
8916 1 15 . 1 1 22 22 VAL CB C 23 30.966 30.966 30.976 -0.010 18003
8917 1 15 . 1 1 22 22 VAL H H 23 8.442 8.442 8.176 0.266 18003
8918 1 15 . 1 1 23 23 ALA N N 24 121.400 121.400 122.687 -1.287 18003
8919 1 15 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.925 0.171 18003
8920 1 15 . 1 1 23 23 ALA C C 24 178.758 178.758 179.586 -0.828 18003
8921 1 15 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.376 0.539 18003
8922 1 15 . 1 1 23 23 ALA CB C 24 16.650 16.650 18.233 -1.583 18003
8923 1 15 . 1 1 23 23 ALA H H 24 8.495 8.495 8.557 -0.062 18003
8924 1 15 . 1 1 24 24 SER N N 25 112.138 112.138 114.565 -2.427 18003
8925 1 15 . 1 1 24 24 SER HA H 25 4.093 4.093 4.016 0.077 18003
8926 1 15 . 1 1 24 24 SER C C 25 177.271 177.271 176.737 0.534 18003
8927 1 15 . 1 1 24 24 SER CA C 25 62.166 62.166 62.747 -0.581 18003
8928 1 15 . 1 1 24 24 SER CB C 25 63.032 63.032 62.947 0.085 18003
8929 1 15 . 1 1 24 24 SER H H 25 7.936 7.936 8.473 -0.537 18003
8930 1 15 . 1 1 25 25 THR N N 26 119.701 119.701 117.682 2.019 18003
8931 1 15 . 1 1 25 25 THR HA H 26 4.380 4.380 4.012 0.368 18003
8932 1 15 . 1 1 25 25 THR C C 26 175.456 175.456 176.373 -0.917 18003
8933 1 15 . 1 1 25 25 THR CA C 26 67.129 67.129 66.085 1.044 18003
8934 1 15 . 1 1 25 25 THR CB C 26 68.800 68.800 68.775 0.025 18003
8935 1 15 . 1 1 25 25 THR H H 26 7.775 7.775 7.687 0.088 18003
8936 1 15 . 1 1 26 26 LEU N N 27 119.270 119.270 120.967 -1.697 18003
8937 1 15 . 1 1 26 26 LEU HA H 27 3.563 3.563 3.955 -0.392 18003
8938 1 15 . 1 1 26 26 LEU C C 27 178.390 178.390 179.196 -0.806 18003
8939 1 15 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.341 0.328 18003
8940 1 15 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.619 0.411 18003
8941 1 15 . 1 1 26 26 LEU H H 27 8.006 8.006 8.175 -0.169 18003
8942 1 15 . 1 1 27 27 GLN N N 28 115.843 115.843 119.386 -3.543 18003
8943 1 15 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.065 -0.261 18003
8944 1 15 . 1 1 27 27 GLN C C 28 178.657 178.657 178.027 0.630 18003
8945 1 15 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.463 0.249 18003
8946 1 15 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.447 -0.418 18003
8947 1 15 . 1 1 27 27 GLN H H 28 8.485 8.485 8.092 0.393 18003
8948 1 15 . 1 1 28 28 ALA N N 29 118.779 118.779 122.930 -4.151 18003
8949 1 15 . 1 1 28 28 ALA HA H 29 4.008 4.008 3.981 0.027 18003
8950 1 15 . 1 1 28 28 ALA C C 29 178.259 178.259 180.015 -1.756 18003
8951 1 15 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.972 -1.010 18003
8952 1 15 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.596 0.142 18003
8953 1 15 . 1 1 28 28 ALA H H 29 7.432 7.432 7.793 -0.361 18003
8954 1 15 . 1 1 29 29 LEU N N 30 113.442 113.442 117.774 -4.332 18003
8955 1 15 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.916 0.080 18003
8956 1 15 . 1 1 29 29 LEU C C 30 175.924 175.924 177.093 -1.169 18003
8957 1 15 . 1 1 29 29 LEU CA C 30 55.564 55.564 57.562 -1.998 18003
8958 1 15 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.239 1.027 18003
8959 1 15 . 1 1 29 29 LEU H H 30 7.311 7.311 8.028 -0.717 18003
8960 1 15 . 1 1 30 30 ALA N N 31 119.563 119.563 118.498 1.065 18003
8961 1 15 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.175 -0.003 18003
8962 1 15 . 1 1 30 30 ALA C C 31 176.316 176.316 176.332 -0.016 18003
8963 1 15 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.198 -1.542 18003
8964 1 15 . 1 1 30 30 ALA CB C 31 18.077 18.077 19.163 -1.086 18003
8965 1 15 . 1 1 30 30 ALA H H 31 7.223 7.223 7.189 0.034 18003
8966 1 15 . 1 1 31 31 THR N N 32 114.613 114.613 107.933 6.680 18003
8967 1 15 . 1 1 31 31 THR HA H 32 4.950 4.950 4.076 0.874 18003
8968 1 15 . 1 1 31 31 THR CA C 32 58.129 58.129 61.434 -3.305 18003
8969 1 15 . 1 1 31 31 THR CB C 32 69.098 69.098 67.892 1.206 18003
8970 1 15 . 1 1 31 31 THR H H 32 8.399 8.399 8.193 0.206 18003
8971 1 15 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.150 0.288 18003
8972 1 15 . 1 1 32 32 PRO C C 33 178.207 178.207 178.686 -0.479 18003
8973 1 15 . 1 1 32 32 PRO CA C 33 66.905 66.905 66.021 0.884 18003
8974 1 15 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.262 0.002 18003
8975 1 15 . 1 1 33 33 SER N N 34 110.767 110.767 113.942 -3.175 18003
8976 1 15 . 1 1 33 33 SER HA H 34 4.026 4.026 4.228 -0.202 18003
8977 1 15 . 1 1 33 33 SER C C 34 176.742 176.742 176.708 0.034 18003
8978 1 15 . 1 1 33 33 SER CA C 34 61.782 61.782 61.769 0.013 18003
8979 1 15 . 1 1 33 33 SER CB C 34 62.432 62.432 62.384 0.048 18003
8980 1 15 . 1 1 33 33 SER H H 34 8.407 8.407 8.298 0.109 18003
8981 1 15 . 1 1 34 34 ARG N N 35 120.135 120.135 121.660 -1.525 18003
8982 1 15 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.127 -0.073 18003
8983 1 15 . 1 1 34 34 ARG C C 35 178.283 178.283 178.795 -0.512 18003
8984 1 15 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.808 1.724 18003
8985 1 15 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.554 -0.601 18003
8986 1 15 . 1 1 34 34 ARG H H 35 7.341 7.341 8.210 -0.869 18003
8987 1 15 . 1 1 35 35 LEU N N 36 118.454 118.454 121.517 -3.063 18003
8988 1 15 . 1 1 35 35 LEU HA H 36 4.054 4.054 3.945 0.109 18003
8989 1 15 . 1 1 35 35 LEU C C 36 180.643 180.643 179.182 1.461 18003
8990 1 15 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.608 -0.799 18003
8991 1 15 . 1 1 35 35 LEU CB C 36 41.778 41.778 41.963 -0.185 18003
8992 1 15 . 1 1 35 35 LEU H H 36 8.226 8.226 8.365 -0.139 18003
8993 1 15 . 1 1 36 36 MET N N 37 121.073 121.073 119.221 1.852 18003
8994 1 15 . 1 1 36 36 MET HA H 37 3.928 3.928 4.071 -0.143 18003
8995 1 15 . 1 1 36 36 MET C C 37 177.671 177.671 178.424 -0.753 18003
8996 1 15 . 1 1 36 36 MET CA C 37 60.613 60.613 58.345 2.268 18003
8997 1 15 . 1 1 36 36 MET CB C 37 33.128 33.128 32.255 0.873 18003
8998 1 15 . 1 1 36 36 MET H H 37 8.447 8.447 8.188 0.259 18003
8999 1 15 . 1 1 37 37 ILE N N 38 118.239 118.239 119.271 -1.032 18003
9000 1 15 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.618 -0.178 18003
9001 1 15 . 1 1 37 37 ILE C C 38 177.092 177.092 178.024 -0.932 18003
9002 1 15 . 1 1 37 37 ILE CA C 38 65.675 65.675 65.370 0.305 18003
9003 1 15 . 1 1 37 37 ILE CB C 38 38.255 38.255 37.752 0.503 18003
9004 1 15 . 1 1 37 37 ILE H H 38 7.763 7.763 7.881 -0.118 18003
9005 1 15 . 1 1 38 38 LEU N N 39 116.073 116.073 119.999 -3.926 18003
9006 1 15 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.890 -0.064 18003
9007 1 15 . 1 1 38 38 LEU C C 39 178.941 178.941 179.194 -0.253 18003
9008 1 15 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.290 -0.259 18003
9009 1 15 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.344 0.436 18003
9010 1 15 . 1 1 38 38 LEU H H 39 8.538 8.538 8.568 -0.030 18003
9011 1 15 . 1 1 39 39 THR N N 40 106.678 106.678 115.401 -8.723 18003
9012 1 15 . 1 1 39 39 THR HA H 40 3.932 3.932 3.907 0.025 18003
9013 1 15 . 1 1 39 39 THR C C 40 177.747 177.747 176.612 1.135 18003
9014 1 15 . 1 1 39 39 THR CA C 40 65.536 65.536 66.922 -1.386 18003
9015 1 15 . 1 1 39 39 THR CB C 40 68.360 68.360 68.344 0.016 18003
9016 1 15 . 1 1 39 39 THR H H 40 8.086 8.086 8.519 -0.433 18003
9017 1 15 . 1 1 40 40 GLN N N 41 122.344 122.344 121.525 0.819 18003
9018 1 15 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.068 -0.062 18003
9019 1 15 . 1 1 40 40 GLN C C 41 178.348 178.348 178.343 0.005 18003
9020 1 15 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.829 -0.904 18003
9021 1 15 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.013 -0.493 18003
9022 1 15 . 1 1 40 40 GLN H H 41 7.593 7.593 7.690 -0.097 18003
9023 1 15 . 1 1 41 41 LEU N N 42 116.302 116.302 120.359 -4.057 18003
9024 1 15 . 1 1 41 41 LEU C C 42 178.418 178.418 179.694 -1.276 18003
9025 1 15 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.142 -1.611 18003
9026 1 15 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.761 -0.412 18003
9027 1 15 . 1 1 41 41 LEU H H 42 7.570 7.570 7.608 -0.038 18003
9028 1 15 . 1 1 42 42 ARG N N 43 119.954 119.954 118.492 1.462 18003
9029 1 15 . 1 1 42 42 ARG HA H 43 3.915 3.915 3.888 0.027 18003
9030 1 15 . 1 1 42 42 ARG C C 43 177.205 177.205 178.133 -0.928 18003
9031 1 15 . 1 1 42 42 ARG CA C 43 58.704 58.704 59.467 -0.763 18003
9032 1 15 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.040 -0.597 18003
9033 1 15 . 1 1 42 42 ARG H H 43 7.612 7.612 8.096 -0.484 18003
9034 1 15 . 1 1 43 43 ASN N N 44 114.682 114.682 116.662 -1.980 18003
9035 1 15 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.571 0.189 18003
9036 1 15 . 1 1 43 43 ASN C C 44 174.507 174.507 175.322 -0.815 18003
9037 1 15 . 1 1 43 43 ASN CA C 44 53.953 53.953 54.387 -0.434 18003
9038 1 15 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.292 -0.262 18003
9039 1 15 . 1 1 43 43 ASN H H 44 7.567 7.567 7.718 -0.151 18003
9040 1 15 . 1 1 44 44 GLY N N 45 109.113 109.113 106.379 2.734 18003
9041 1 15 . 1 1 44 44 GLY CA C 45 44.268 44.268 44.471 -0.203 18003
9042 1 15 . 1 1 44 44 GLY H H 45 7.361 7.361 7.653 -0.292 18003
9043 1 15 . 1 1 45 45 PRO C C 46 178.412 178.412 176.268 2.144 18003
9044 1 15 . 1 1 45 45 PRO CA C 46 62.580 62.580 62.856 -0.276 18003
9045 1 15 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.989 1.140 18003
9046 1 15 . 1 1 46 46 LEU N N 47 120.363 120.363 120.462 -0.099 18003
9047 1 15 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.721 0.310 18003
9048 1 15 . 1 1 46 46 LEU CA C 47 52.550 52.550 52.334 0.216 18003
9049 1 15 . 1 1 46 46 LEU CB C 47 48.210 48.210 41.337 6.873 18003
9050 1 15 . 1 1 46 46 LEU H H 47 8.252 8.252 8.157 0.095 18003
9051 1 15 . 1 1 47 47 PRO C C 48 177.313 177.313 178.401 -1.088 18003
9052 1 15 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.201 -0.366 18003
9053 1 15 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.446 -0.063 18003
9054 1 15 . 1 1 48 48 VAL N N 49 119.384 119.384 123.684 -4.300 18003
9055 1 15 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.721 -0.114 18003
9056 1 15 . 1 1 48 48 VAL C C 49 176.710 176.710 178.069 -1.359 18003
9057 1 15 . 1 1 48 48 VAL CA C 49 66.188 66.188 66.970 -0.782 18003
9058 1 15 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.586 -0.005 18003
9059 1 15 . 1 1 48 48 VAL H H 49 9.074 9.074 8.875 0.199 18003
9060 1 15 . 1 1 49 49 THR N N 50 111.293 111.293 115.936 -4.643 18003
9061 1 15 . 1 1 49 49 THR HA H 50 4.181 4.181 3.961 0.220 18003
9062 1 15 . 1 1 49 49 THR C C 50 176.717 176.717 175.786 0.931 18003
9063 1 15 . 1 1 49 49 THR CA C 50 65.063 65.063 67.708 -2.645 18003
9064 1 15 . 1 1 49 49 THR CB C 50 68.032 68.032 68.375 -0.343 18003
9065 1 15 . 1 1 49 49 THR H H 50 7.848 7.848 8.196 -0.348 18003
9066 1 15 . 1 1 50 50 ASP N N 51 120.138 120.138 121.167 -1.029 18003
9067 1 15 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.454 -0.249 18003
9068 1 15 . 1 1 50 50 ASP C C 51 174.723 174.723 178.428 -3.705 18003
9069 1 15 . 1 1 50 50 ASP CA C 51 56.781 56.781 56.778 0.003 18003
9070 1 15 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.415 0.696 18003
9071 1 15 . 1 1 50 50 ASP H H 51 7.108 7.108 8.269 -1.161 18003
9072 1 15 . 1 1 51 51 LEU N N 52 121.089 121.089 120.647 0.442 18003
9073 1 15 . 1 1 51 51 LEU HA H 52 3.985 3.985 4.037 -0.052 18003
9074 1 15 . 1 1 51 51 LEU C C 52 177.089 177.089 178.589 -1.500 18003
9075 1 15 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.938 0.223 18003
9076 1 15 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.151 0.629 18003
9077 1 15 . 1 1 51 51 LEU H H 52 7.943 7.943 8.023 -0.080 18003
9078 1 15 . 1 1 52 52 ALA N N 53 119.237 119.237 121.188 -1.951 18003
9079 1 15 . 1 1 52 52 ALA HA H 53 3.872 3.872 4.008 -0.136 18003
9080 1 15 . 1 1 52 52 ALA C C 53 179.466 179.466 179.756 -0.290 18003
9081 1 15 . 1 1 52 52 ALA CA C 53 55.663 55.663 54.972 0.691 18003
9082 1 15 . 1 1 52 52 ALA CB C 53 17.619 17.619 18.326 -0.707 18003
9083 1 15 . 1 1 52 52 ALA H H 53 8.480 8.480 8.389 0.091 18003
9084 1 15 . 1 1 53 53 GLU N N 54 115.655 115.655 116.305 -0.650 18003
9085 1 15 . 1 1 53 53 GLU HA H 54 4.054 4.054 4.127 -0.073 18003
9086 1 15 . 1 1 53 53 GLU C C 54 179.073 179.073 177.997 1.076 18003
9087 1 15 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.382 0.445 18003
9088 1 15 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.563 -0.163 18003
9089 1 15 . 1 1 53 53 GLU H H 54 7.705 7.705 7.993 -0.288 18003
9090 1 15 . 1 1 54 54 ALA N N 55 120.276 120.276 120.904 -0.628 18003
9091 1 15 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.166 -0.029 18003
9092 1 15 . 1 1 54 54 ALA C C 55 179.771 179.771 178.106 1.665 18003
9093 1 15 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.447 0.214 18003
9094 1 15 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.560 -1.325 18003
9095 1 15 . 1 1 54 54 ALA H H 55 7.928 7.928 7.726 0.202 18003
9096 1 15 . 1 1 55 55 ILE N N 56 107.195 107.195 113.580 -6.385 18003
9097 1 15 . 1 1 55 55 ILE C C 56 176.053 176.053 176.940 -0.887 18003
9098 1 15 . 1 1 55 55 ILE CA C 56 60.551 60.551 61.566 -1.015 18003
9099 1 15 . 1 1 55 55 ILE CB C 56 38.497 38.497 38.915 -0.418 18003
9100 1 15 . 1 1 55 55 ILE H H 56 7.507 7.507 7.542 -0.035 18003
9101 1 15 . 1 1 56 56 GLY N N 57 111.108 111.108 112.037 -0.929 18003
9102 1 15 . 1 1 56 56 GLY C C 57 174.421 174.421 175.387 -0.966 18003
9103 1 15 . 1 1 56 56 GLY CA C 57 46.960 46.960 46.410 0.549 18003
9104 1 15 . 1 1 56 56 GLY H H 57 7.757 7.757 7.867 -0.110 18003
9105 1 15 . 1 1 57 57 MET N N 58 118.089 118.089 117.117 0.972 18003
9106 1 15 . 1 1 57 57 MET HA H 58 3.933 3.933 4.060 -0.127 18003
9107 1 15 . 1 1 57 57 MET C C 58 174.157 174.157 174.511 -0.354 18003
9108 1 15 . 1 1 57 57 MET CA C 58 54.091 54.091 56.544 -2.453 18003
9109 1 15 . 1 1 57 57 MET CB C 58 38.062 38.062 31.645 6.417 18003
9110 1 15 . 1 1 57 57 MET H H 58 7.659 7.659 7.315 0.344 18003
9111 1 15 . 1 1 58 58 GLU N N 59 121.656 121.656 117.016 4.640 18003
9112 1 15 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.528 -0.188 18003
9113 1 15 . 1 1 58 58 GLU C C 59 178.355 178.355 176.006 2.349 18003
9114 1 15 . 1 1 58 58 GLU CA C 59 56.643 56.643 55.772 0.871 18003
9115 1 15 . 1 1 58 58 GLU CB C 59 30.029 30.029 29.970 0.059 18003
9116 1 15 . 1 1 58 58 GLU H H 59 8.523 8.523 8.073 0.450 18003
9117 1 15 . 1 1 59 59 GLN N N 60 123.686 123.686 120.466 3.220 18003
9118 1 15 . 1 1 59 59 GLN HA H 60 4.214 4.214 3.915 0.299 18003
9119 1 15 . 1 1 59 59 GLN C C 60 177.961 177.961 177.453 0.508 18003
9120 1 15 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.985 1.631 18003
9121 1 15 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.340 0.675 18003
9122 1 15 . 1 1 59 59 GLN H H 60 9.009 9.009 8.786 0.223 18003
9123 1 15 . 1 1 60 60 SER N N 61 115.101 115.101 115.688 -0.587 18003
9124 1 15 . 1 1 60 60 SER C C 61 176.801 176.801 175.697 1.104 18003
9125 1 15 . 1 1 60 60 SER CA C 61 61.213 61.213 61.216 -0.003 18003
9126 1 15 . 1 1 60 60 SER H H 61 8.964 8.964 8.237 0.727 18003
9127 1 15 . 1 1 61 61 ALA N N 62 126.069 126.069 124.209 1.860 18003
9128 1 15 . 1 1 61 61 ALA HA H 62 4.351 4.351 3.912 0.439 18003
9129 1 15 . 1 1 61 61 ALA C C 62 180.635 180.635 179.232 1.403 18003
9130 1 15 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.735 -0.477 18003
9131 1 15 . 1 1 61 61 ALA CB C 62 18.623 18.623 17.976 0.647 18003
9132 1 15 . 1 1 61 61 ALA H H 62 7.103 7.103 7.798 -0.695 18003
9133 1 15 . 1 1 62 62 VAL N N 63 119.252 119.252 119.150 0.102 18003
9134 1 15 . 1 1 62 62 VAL C C 63 177.842 177.842 177.914 -0.072 18003
9135 1 15 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.210 0.588 18003
9136 1 15 . 1 1 62 62 VAL CB C 63 31.264 31.264 30.978 0.286 18003
9137 1 15 . 1 1 62 62 VAL H H 63 7.971 7.971 7.815 0.156 18003
9138 1 15 . 1 1 63 63 SER N N 64 115.494 115.494 115.638 -0.144 18003
9139 1 15 . 1 1 63 63 SER HA H 64 4.034 4.034 3.958 0.076 18003
9140 1 15 . 1 1 63 63 SER C C 64 176.835 176.835 176.800 0.035 18003
9141 1 15 . 1 1 63 63 SER CA C 64 62.400 62.400 61.803 0.597 18003
9142 1 15 . 1 1 63 63 SER CB C 64 62.752 62.752 63.111 -0.359 18003
9143 1 15 . 1 1 63 63 SER H H 64 8.743 8.743 8.227 0.516 18003
9144 1 15 . 1 1 64 64 HIS N N 65 120.010 120.010 120.238 -0.228 18003
9145 1 15 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.283 0.077 18003
9146 1 15 . 1 1 64 64 HIS C C 65 177.731 177.731 177.990 -0.259 18003
9147 1 15 . 1 1 64 64 HIS CA C 65 59.998 59.998 58.646 1.352 18003
9148 1 15 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.221 0.713 18003
9149 1 15 . 1 1 64 64 HIS H H 65 7.804 7.804 8.237 -0.433 18003
9150 1 15 . 1 1 65 65 GLN N N 66 115.590 115.590 119.237 -3.647 18003
9151 1 15 . 1 1 65 65 GLN HA H 66 4.035 4.035 4.018 0.017 18003
9152 1 15 . 1 1 65 65 GLN C C 66 179.055 179.055 178.534 0.521 18003
9153 1 15 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.812 -1.282 18003
9154 1 15 . 1 1 65 65 GLN H H 66 7.751 7.751 8.012 -0.261 18003
9155 1 15 . 1 1 66 66 LEU N N 67 118.746 118.746 121.406 -2.660 18003
9156 1 15 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.921 0.026 18003
9157 1 15 . 1 1 66 66 LEU C C 67 178.334 178.334 178.468 -0.134 18003
9158 1 15 . 1 1 66 66 LEU CA C 67 57.846 57.846 58.259 -0.413 18003
9159 1 15 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.718 -0.615 18003
9160 1 15 . 1 1 66 66 LEU H H 67 8.648 8.648 8.563 0.085 18003
9161 1 15 . 1 1 67 67 ARG N N 68 119.610 119.610 119.061 0.549 18003
9162 1 15 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.935 0.008 18003
9163 1 15 . 1 1 67 67 ARG C C 68 178.807 178.807 178.939 -0.132 18003
9164 1 15 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.843 -0.466 18003
9165 1 15 . 1 1 67 67 ARG CB C 68 29.475 29.475 30.082 -0.607 18003
9166 1 15 . 1 1 67 67 ARG H H 68 7.607 7.607 8.105 -0.498 18003
9167 1 15 . 1 1 68 68 VAL N N 69 119.719 119.719 120.682 -0.963 18003
9168 1 15 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.799 -0.166 18003
9169 1 15 . 1 1 68 68 VAL C C 69 178.690 178.690 178.220 0.470 18003
9170 1 15 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.395 0.059 18003
9171 1 15 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.907 -0.129 18003
9172 1 15 . 1 1 68 68 VAL H H 69 7.259 7.259 7.732 -0.473 18003
9173 1 15 . 1 1 69 69 LEU N N 70 117.532 117.532 119.024 -1.492 18003
9174 1 15 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.918 0.030 18003
9175 1 15 . 1 1 69 69 LEU C C 70 179.144 179.144 178.912 0.232 18003
9176 1 15 . 1 1 69 69 LEU CA C 70 57.750 57.750 57.979 -0.229 18003
9177 1 15 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.391 0.470 18003
9178 1 15 . 1 1 69 69 LEU H H 70 8.375 8.375 8.345 0.030 18003
9179 1 15 . 1 1 70 70 ARG N N 71 122.498 122.498 119.679 2.819 18003
9180 1 15 . 1 1 70 70 ARG HA H 71 3.931 3.931 4.001 -0.070 18003
9181 1 15 . 1 1 70 70 ARG C C 71 180.499 180.499 178.631 1.868 18003
9182 1 15 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.477 -0.700 18003
9183 1 15 . 1 1 70 70 ARG CB C 71 30.155 30.155 30.102 0.053 18003
9184 1 15 . 1 1 70 70 ARG H H 71 8.822 8.822 8.602 0.220 18003
9185 1 15 . 1 1 71 71 ASN N N 72 121.816 121.816 118.183 3.633 18003
9186 1 15 . 1 1 71 71 ASN C C 72 177.170 177.170 177.418 -0.248 18003
9187 1 15 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.703 0.074 18003
9188 1 15 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.224 -0.490 18003
9189 1 15 . 1 1 71 71 ASN H H 72 8.144 8.144 7.877 0.267 18003
9190 1 15 . 1 1 72 72 LEU N N 73 117.044 117.044 118.672 -1.628 18003
9191 1 15 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.191 0.154 18003
9192 1 15 . 1 1 72 72 LEU C C 73 176.984 176.984 178.241 -1.257 18003
9193 1 15 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.588 -1.463 18003
9194 1 15 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.178 1.091 18003
9195 1 15 . 1 1 72 72 LEU H H 73 7.804 7.804 7.712 0.092 18003
9196 1 15 . 1 1 73 73 GLY N N 74 106.621 106.621 104.173 2.448 18003
9197 1 15 . 1 1 73 73 GLY C C 74 173.266 173.266 174.938 -1.672 18003
9198 1 15 . 1 1 73 73 GLY CA C 74 46.022 46.022 44.944 1.078 18003
9199 1 15 . 1 1 73 73 GLY H H 74 7.851 7.851 8.187 -0.336 18003
9200 1 15 . 1 1 74 74 LEU N N 75 114.582 114.582 119.529 -4.947 18003
9201 1 15 . 1 1 74 74 LEU C C 75 177.562 177.562 176.568 0.994 18003
9202 1 15 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.871 0.160 18003
9203 1 15 . 1 1 74 74 LEU CB C 75 44.444 44.444 42.722 1.722 18003
9204 1 15 . 1 1 74 74 LEU H H 75 7.808 7.808 8.161 -0.353 18003
9205 1 15 . 1 1 75 75 VAL N N 76 110.980 110.980 112.160 -1.180 18003
9206 1 15 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.662 -0.135 18003
9207 1 15 . 1 1 75 75 VAL C C 76 173.922 173.922 174.378 -0.456 18003
9208 1 15 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.456 -2.514 18003
9209 1 15 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.828 0.201 18003
9210 1 15 . 1 1 75 75 VAL H H 76 7.079 7.079 7.375 -0.296 18003
9211 1 15 . 1 1 76 76 VAL N N 77 118.619 118.619 121.614 -2.995 18003
9212 1 15 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.432 0.870 18003
9213 1 15 . 1 1 76 76 VAL C C 77 174.041 174.041 174.743 -0.702 18003
9214 1 15 . 1 1 76 76 VAL CA C 77 59.999 59.999 61.232 -1.233 18003
9215 1 15 . 1 1 76 76 VAL H H 77 9.024 9.024 9.239 -0.215 18003
9216 1 15 . 1 1 77 77 GLY N N 78 109.451 109.451 111.444 -1.993 18003
9217 1 15 . 1 1 77 77 GLY C C 78 172.225 172.225 173.065 -0.840 18003
9218 1 15 . 1 1 77 77 GLY CA C 78 44.462 44.462 43.837 0.625 18003
9219 1 15 . 1 1 77 77 GLY H H 78 8.265 8.265 8.491 -0.226 18003
9220 1 15 . 1 1 78 78 ASP N N 79 122.826 122.826 124.411 -1.585 18003
9221 1 15 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.812 -0.066 18003
9222 1 15 . 1 1 78 78 ASP C C 79 174.817 174.817 175.082 -0.265 18003
9223 1 15 . 1 1 78 78 ASP CA C 79 53.111 53.111 52.740 0.371 18003
9224 1 15 . 1 1 78 78 ASP CB C 79 43.655 43.655 42.526 1.129 18003
9225 1 15 . 1 1 78 78 ASP H H 79 8.479 8.479 8.605 -0.126 18003
9226 1 15 . 1 1 79 79 ARG N N 80 122.613 122.613 125.873 -3.260 18003
9227 1 15 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.093 0.319 18003
9228 1 15 . 1 1 79 79 ARG C C 80 175.546 175.546 174.888 0.658 18003
9229 1 15 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.514 -0.196 18003
9230 1 15 . 1 1 79 79 ARG CB C 80 30.376 30.376 30.596 -0.220 18003
9231 1 15 . 1 1 79 79 ARG H H 80 8.580 8.580 8.674 -0.094 18003
9232 1 15 . 1 1 80 80 ALA N N 81 129.263 129.263 128.967 0.296 18003
9233 1 15 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.654 -0.202 18003
9234 1 15 . 1 1 80 80 ALA C C 81 177.126 177.126 177.629 -0.503 18003
9235 1 15 . 1 1 80 80 ALA CA C 81 51.620 51.620 50.791 0.829 18003
9236 1 15 . 1 1 80 80 ALA CB C 81 19.260 19.260 21.505 -2.245 18003
9237 1 15 . 1 1 80 80 ALA H H 81 8.396 8.396 8.164 0.232 18003
9238 1 15 . 1 1 81 81 GLY N N 82 112.739 112.739 108.948 3.791 18003
9239 1 15 . 1 1 81 81 GLY C C 82 174.856 174.856 175.654 -0.798 18003
9240 1 15 . 1 1 81 81 GLY CA C 82 46.392 46.392 47.026 -0.634 18003
9241 1 15 . 1 1 81 81 GLY H H 82 8.641 8.641 8.784 -0.143 18003
9242 1 15 . 1 1 82 82 ARG N N 83 124.780 124.780 119.268 5.512 18003
9243 1 15 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.309 0.014 18003
9244 1 15 . 1 1 82 82 ARG C C 83 176.339 176.339 176.081 0.258 18003
9245 1 15 . 1 1 82 82 ARG CA C 83 56.690 56.690 57.218 -0.528 18003
9246 1 15 . 1 1 82 82 ARG CB C 83 30.221 30.221 30.989 -0.768 18003
9247 1 15 . 1 1 82 82 ARG H H 83 8.728 8.728 8.272 0.456 18003
9248 1 15 . 1 1 83 83 SER N N 84 114.678 114.678 109.215 5.463 18003
9249 1 15 . 1 1 83 83 SER C C 84 172.869 172.869 171.963 0.906 18003
9250 1 15 . 1 1 83 83 SER CA C 84 56.834 56.834 57.468 -0.634 18003
9251 1 15 . 1 1 83 83 SER CB C 84 65.191 65.191 65.013 0.178 18003
9252 1 15 . 1 1 83 83 SER H H 84 7.821 7.821 7.413 0.408 18003
9253 1 15 . 1 1 84 84 ILE N N 85 122.996 122.996 122.202 0.794 18003
9254 1 15 . 1 1 84 84 ILE C C 85 175.521 175.521 174.418 1.103 18003
9255 1 15 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.593 0.642 18003
9256 1 15 . 1 1 84 84 ILE CB C 85 38.136 38.136 38.983 -0.846 18003
9257 1 15 . 1 1 84 84 ILE H H 85 8.232 8.232 8.258 -0.026 18003
9258 1 15 . 1 1 85 85 VAL N N 86 121.845 121.845 129.690 -7.845 18003
9259 1 15 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.140 0.170 18003
9260 1 15 . 1 1 85 85 VAL C C 86 174.818 174.818 174.299 0.519 18003
9261 1 15 . 1 1 85 85 VAL CA C 86 59.738 59.738 60.569 -0.831 18003
9262 1 15 . 1 1 85 85 VAL CB C 86 34.221 34.221 34.484 -0.263 18003
9263 1 15 . 1 1 85 85 VAL H H 86 8.495 8.495 8.365 0.130 18003
9264 1 15 . 1 1 86 86 TYR N N 87 125.020 125.020 127.139 -2.119 18003
9265 1 15 . 1 1 86 86 TYR HA H 87 4.319 4.319 5.097 -0.778 18003
9266 1 15 . 1 1 86 86 TYR C C 87 173.808 173.808 175.348 -1.540 18003
9267 1 15 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.222 0.243 18003
9268 1 15 . 1 1 86 86 TYR CB C 87 41.480 41.480 40.657 0.823 18003
9269 1 15 . 1 1 86 86 TYR H H 87 8.488 8.488 8.667 -0.179 18003
9270 1 15 . 1 1 87 87 SER N N 88 110.681 110.681 115.369 -4.688 18003
9271 1 15 . 1 1 87 87 SER HA H 88 5.414 5.414 4.806 0.608 18003
9272 1 15 . 1 1 87 87 SER C C 88 174.693 174.693 172.751 1.942 18003
9273 1 15 . 1 1 87 87 SER CA C 88 56.113 56.113 55.865 0.248 18003
9274 1 15 . 1 1 87 87 SER CB C 88 66.309 66.309 65.979 0.330 18003
9275 1 15 . 1 1 87 87 SER H H 88 8.718 8.718 9.024 -0.306 18003
9276 1 15 . 1 1 88 88 LEU N N 89 119.612 119.612 124.161 -4.549 18003
9277 1 15 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.275 0.652 18003
9278 1 15 . 1 1 88 88 LEU C C 89 179.031 179.031 177.768 1.263 18003
9279 1 15 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.563 -0.238 18003
9280 1 15 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.404 -0.684 18003
9281 1 15 . 1 1 88 88 LEU H H 89 9.034 9.034 8.562 0.472 18003
9282 1 15 . 1 1 89 89 TYR N N 90 120.540 120.540 124.075 -3.535 18003
9283 1 15 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.156 0.466 18003
9284 1 15 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.986 0.726 18003
9285 1 15 . 1 1 89 89 TYR H H 90 8.075 8.075 8.441 -0.366 18003
9286 1 15 . 1 1 92 92 HIS C C 93 177.850 177.850 177.464 0.386 18003
9287 1 15 . 1 1 93 93 VAL N N 94 120.211 120.211 116.044 4.167 18003
9288 1 15 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.708 -0.207 18003
9289 1 15 . 1 1 93 93 VAL C C 94 176.785 176.785 177.512 -0.727 18003
9290 1 15 . 1 1 93 93 VAL CA C 94 66.666 66.666 65.503 1.163 18003
9291 1 15 . 1 1 93 93 VAL CB C 94 31.637 31.637 30.687 0.950 18003
9292 1 15 . 1 1 93 93 VAL H H 94 8.164 8.164 8.404 -0.240 18003
9293 1 15 . 1 1 94 94 ALA N N 95 119.221 119.221 121.810 -2.589 18003
9294 1 15 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.990 -0.200 18003
9295 1 15 . 1 1 94 94 ALA C C 95 177.979 177.979 179.790 -1.811 18003
9296 1 15 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.037 0.442 18003
9297 1 15 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.123 -0.013 18003
9298 1 15 . 1 1 94 94 ALA H H 95 6.942 6.942 7.318 -0.376 18003
9299 1 15 . 1 1 95 95 GLN N N 96 115.416 115.416 118.733 -3.317 18003
9300 1 15 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.021 0.014 18003
9301 1 15 . 1 1 95 95 GLN C C 96 177.993 177.993 178.741 -0.748 18003
9302 1 15 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.426 0.416 18003
9303 1 15 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.314 -0.285 18003
9304 1 15 . 1 1 95 95 GLN H H 96 7.795 7.795 8.344 -0.549 18003
9305 1 15 . 1 1 96 96 LEU N N 97 120.758 120.758 121.285 -0.527 18003
9306 1 15 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.016 -0.167 18003
9307 1 15 . 1 1 96 96 LEU C C 97 177.974 177.974 178.818 -0.844 18003
9308 1 15 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.015 1.267 18003
9309 1 15 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.781 -0.735 18003
9310 1 15 . 1 1 96 96 LEU H H 97 8.197 8.197 7.948 0.249 18003
9311 1 15 . 1 1 97 97 LEU N N 98 117.567 117.567 119.843 -2.276 18003
9312 1 15 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.939 -0.109 18003
9313 1 15 . 1 1 97 97 LEU C C 98 178.219 178.219 178.353 -0.134 18003
9314 1 15 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.132 -0.402 18003
9315 1 15 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.344 0.518 18003
9316 1 15 . 1 1 97 97 LEU H H 98 7.660 7.660 8.027 -0.367 18003
9317 1 15 . 1 1 98 98 ASP N N 99 118.607 118.607 119.892 -1.285 18003
9318 1 15 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.320 -0.211 18003
9319 1 15 . 1 1 98 98 ASP C C 99 179.382 179.382 178.934 0.448 18003
9320 1 15 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.632 0.403 18003
9321 1 15 . 1 1 98 98 ASP CB C 99 39.839 39.839 39.928 -0.089 18003
9322 1 15 . 1 1 98 98 ASP H H 99 8.295 8.295 8.437 -0.142 18003
9323 1 15 . 1 1 99 99 GLU N N 100 117.542 117.542 119.670 -2.128 18003
9324 1 15 . 1 1 99 99 GLU HA H 100 3.849 3.849 3.921 -0.072 18003
9325 1 15 . 1 1 99 99 GLU C C 100 179.389 179.389 179.061 0.328 18003
9326 1 15 . 1 1 99 99 GLU CA C 100 58.023 58.023 58.954 -0.931 18003
9327 1 15 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.172 -0.143 18003
9328 1 15 . 1 1 99 99 GLU H H 100 8.334 8.334 8.068 0.266 18003
9329 1 15 . 1 1 100 100 ALA N N 101 122.890 122.890 123.782 -0.892 18003
9330 1 15 . 1 1 100 100 ALA HA H 101 3.998 3.998 3.956 0.042 18003
9331 1 15 . 1 1 100 100 ALA C C 101 180.184 180.184 179.938 0.246 18003
9332 1 15 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.241 0.279 18003
9333 1 15 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.372 -0.753 18003
9334 1 15 . 1 1 100 100 ALA H H 101 8.550 8.550 8.284 0.266 18003
9335 1 15 . 1 1 101 101 ILE N N 102 119.952 119.952 119.147 0.805 18003
9336 1 15 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.784 -0.195 18003
9337 1 15 . 1 1 101 101 ILE C C 102 178.114 178.114 178.220 -0.106 18003
9338 1 15 . 1 1 101 101 ILE CA C 102 65.376 65.376 65.207 0.169 18003
9339 1 15 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.019 1.010 18003
9340 1 15 . 1 1 101 101 ILE H H 102 8.493 8.493 8.439 0.054 18003
9341 1 15 . 1 1 102 102 TYR N N 103 120.625 120.625 118.860 1.765 18003
9342 1 15 . 1 1 102 102 TYR HA H 103 4.171 4.171 3.741 0.430 18003
9343 1 15 . 1 1 102 102 TYR C C 103 179.772 179.772 177.879 1.893 18003
9344 1 15 . 1 1 102 102 TYR CA C 103 60.724 60.724 61.208 -0.484 18003
9345 1 15 . 1 1 102 102 TYR CB C 103 37.500 37.500 37.566 -0.066 18003
9346 1 15 . 1 1 102 102 TYR H H 103 8.520 8.520 8.524 -0.004 18003
9347 1 15 . 1 1 103 103 HIS N N 104 117.456 117.456 118.457 -1.001 18003
9348 1 15 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.309 0.116 18003
9349 1 15 . 1 1 103 103 HIS C C 104 176.377 176.377 177.586 -1.209 18003
9350 1 15 . 1 1 103 103 HIS CA C 104 60.043 60.043 59.267 0.776 18003
9351 1 15 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.300 -0.271 18003
9352 1 15 . 1 1 103 103 HIS H H 104 8.622 8.622 8.859 -0.237 18003
9353 1 15 . 1 1 104 104 SER N N 105 113.596 113.596 115.246 -1.650 18003
9354 1 15 . 1 1 104 104 SER C C 105 176.712 176.712 176.656 0.056 18003
9355 1 15 . 1 1 104 104 SER CA C 105 61.852 61.852 61.590 0.262 18003
9356 1 15 . 1 1 104 104 SER CB C 105 63.550 63.550 63.096 0.453 18003
9357 1 15 . 1 1 104 104 SER H H 105 7.900 7.900 8.471 -0.571 18003
9358 1 15 . 1 1 105 105 GLU N N 106 119.022 119.022 120.593 -1.571 18003
9359 1 15 . 1 1 105 105 GLU HA H 106 4.013 4.013 4.155 -0.142 18003
9360 1 15 . 1 1 105 105 GLU C C 106 177.902 177.902 178.915 -1.013 18003
9361 1 15 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.552 -0.521 18003
9362 1 15 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.493 -0.214 18003
9363 1 15 . 1 1 105 105 GLU H H 106 8.181 8.181 7.770 0.411 18003
9364 1 15 . 1 1 106 106 HIS N N 107 116.482 116.482 116.088 0.394 18003
9365 1 15 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.282 0.125 18003
9366 1 15 . 1 1 106 106 HIS C C 107 175.575 175.575 176.625 -1.050 18003
9367 1 15 . 1 1 106 106 HIS CA C 107 57.343 57.343 58.375 -1.032 18003
9368 1 15 . 1 1 106 106 HIS CB C 107 28.580 28.580 29.968 -1.388 18003
9369 1 15 . 1 1 106 106 HIS H H 107 7.770 7.770 7.985 -0.215 18003
9370 1 15 . 1 1 107 107 LEU N N 108 120.346 120.346 116.530 3.816 18003
9371 1 15 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.536 -0.482 18003
9372 1 15 . 1 1 107 107 LEU C C 108 177.404 177.404 176.893 0.511 18003
9373 1 15 . 1 1 107 107 LEU CA C 108 55.991 55.991 55.026 0.966 18003
9374 1 15 . 1 1 107 107 LEU CB C 108 42.030 42.030 43.263 -1.233 18003
9375 1 15 . 1 1 107 107 LEU H H 108 7.682 7.682 7.606 0.076 18003
9376 1 15 . 1 1 108 108 HIS N N 109 117.222 117.222 118.793 -1.571 18003
9377 1 15 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.260 -0.206 18003
9378 1 15 . 1 1 108 108 HIS C C 109 174.606 174.606 175.012 -0.406 18003
9379 1 15 . 1 1 108 108 HIS CA C 109 56.029 56.029 56.509 -0.480 18003
9380 1 15 . 1 1 108 108 HIS CB C 109 28.517 28.517 28.220 0.297 18003
9381 1 15 . 1 1 108 108 HIS H H 109 8.030 8.030 8.133 -0.102 18003
9382 1 15 . 1 1 109 109 LEU N N 110 121.114 121.114 122.012 -0.898 18003
9383 1 15 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.114 0.184 18003
9384 1 15 . 1 1 109 109 LEU C C 110 178.028 178.028 177.236 0.792 18003
9385 1 15 . 1 1 109 109 LEU CA C 110 55.574 55.574 56.114 -0.540 18003
9386 1 15 . 1 1 109 109 LEU CB C 110 42.076 42.076 42.107 -0.031 18003
9387 1 15 . 1 1 109 109 LEU H H 110 7.973 7.973 8.067 -0.094 18003
9388 1 15 . 1 1 110 110 GLY N N 111 108.631 108.631 106.217 2.414 18003
9389 1 15 . 1 1 110 110 GLY C C 111 174.606 174.606 174.034 0.572 18003
9390 1 15 . 1 1 110 110 GLY CA C 111 45.580 45.580 43.993 1.587 18003
9391 1 15 . 1 1 110 110 GLY H H 111 8.255 8.255 7.494 0.761 18003
9392 1 15 . 1 1 111 111 LEU N N 112 121.022 121.022 119.625 1.397 18003
9393 1 15 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.105 0.254 18003
9394 1 15 . 1 1 111 111 LEU C C 112 177.701 177.701 177.146 0.555 18003
9395 1 15 . 1 1 111 111 LEU CA C 112 55.476 55.476 56.965 -1.490 18003
9396 1 15 . 1 1 111 111 LEU CB C 112 41.899 41.899 41.578 0.321 18003
9397 1 15 . 1 1 111 111 LEU H H 112 7.981 7.981 9.168 -1.187 18003
9398 1 15 . 1 1 112 112 SER N N 113 115.471 115.471 115.385 0.086 18003
9399 1 15 . 1 1 112 112 SER HA H 113 4.432 4.432 4.587 -0.155 18003
9400 1 15 . 1 1 112 112 SER C C 113 174.381 174.381 173.342 1.039 18003
9401 1 15 . 1 1 112 112 SER CA C 113 58.527 58.527 58.125 0.402 18003
9402 1 15 . 1 1 112 112 SER CB C 113 63.593 63.593 64.118 -0.525 18003
9403 1 15 . 1 1 112 112 SER H H 113 8.215 8.215 8.347 -0.132 18003
9404 1 15 . 1 1 113 113 ASP N N 114 121.696 121.696 119.016 2.680 18003
9405 1 15 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.875 -0.448 18003
9406 1 15 . 1 1 113 113 ASP C C 114 175.958 175.958 176.423 -0.465 18003
9407 1 15 . 1 1 113 113 ASP CA C 114 54.213 54.213 53.635 0.578 18003
9408 1 15 . 1 1 113 113 ASP CB C 114 41.030 41.030 43.258 -2.228 18003
9409 1 15 . 1 1 113 113 ASP H H 114 8.203 8.203 8.389 -0.186 18003
9410 1 15 . 1 1 114 114 ARG N N 115 120.088 120.088 119.040 1.048 18003
9411 1 15 . 1 1 114 114 ARG HA H 115 4.272 4.272 3.650 0.622 18003
9412 1 15 . 1 1 114 114 ARG C C 115 175.792 175.792 175.397 0.395 18003
9413 1 15 . 1 1 114 114 ARG CA C 115 55.735 55.735 58.073 -2.338 18003
9414 1 15 . 1 1 114 114 ARG CB C 115 30.586 30.586 28.628 1.958 18003
9415 1 15 . 1 1 114 114 ARG H H 115 8.016 8.016 8.770 -0.754 18003
9416 1 15 . 1 1 115 115 HIS N N 116 120.597 120.597 118.359 2.238 18003
9417 1 15 . 1 1 115 115 HIS CA C 116 53.697 53.697 54.815 -1.118 18003
9418 1 15 . 1 1 115 115 HIS CB C 116 29.299 29.299 27.342 1.957 18003
9419 1 15 . 1 1 115 115 HIS H H 116 8.385 8.385 8.222 0.163 18003
9420 1 15 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.407 0.075 18003
9421 1 15 . 1 1 116 116 PRO C C 117 177.090 177.090 176.755 0.335 18003
9422 1 15 . 1 1 116 116 PRO CA C 117 63.177 63.177 62.985 0.192 18003
9423 1 15 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.324 -0.504 18003
9424 1 15 . 1 1 117 117 SER N N 118 116.220 116.220 117.290 -1.070 18003
9425 1 15 . 1 1 117 117 SER HA H 118 4.465 4.465 4.267 0.198 18003
9426 1 15 . 1 1 117 117 SER C C 118 174.287 174.287 175.146 -0.859 18003
9427 1 15 . 1 1 117 117 SER CA C 118 58.110 58.110 59.653 -1.543 18003
9428 1 15 . 1 1 117 117 SER CB C 118 63.750 63.750 63.176 0.574 18003
9429 1 15 . 1 1 117 117 SER H H 118 8.487 8.487 8.399 0.088 18003
9430 1 15 . 1 1 118 118 ALA N N 119 126.082 126.082 123.734 2.348 18003
9431 1 15 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.349 0.090 18003
9432 1 15 . 1 1 118 118 ALA C C 119 176.879 176.879 177.478 -0.599 18003
9433 1 15 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.409 0.040 18003
9434 1 15 . 1 1 118 118 ALA CB C 119 19.483 19.483 19.291 0.192 18003
9435 1 15 . 1 1 118 118 ALA H H 119 8.295 8.295 7.794 0.501 18003
9436 1 16 . 1 1 2 2 HIS C C 3 175.176 175.176 177.426 -2.250 18003
9437 1 16 . 1 1 2 2 HIS CA C 3 55.900 55.900 58.531 -2.631 18003
9438 1 16 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.239 -0.211 18003
9439 1 16 . 1 1 3 3 GLY N N 4 110.613 110.613 107.782 2.831 18003
9440 1 16 . 1 1 3 3 GLY C C 4 174.068 174.068 175.054 -0.986 18003
9441 1 16 . 1 1 3 3 GLY CA C 4 45.141 45.141 45.397 -0.256 18003
9442 1 16 . 1 1 3 3 GLY H H 4 8.500 8.500 8.231 0.269 18003
9443 1 16 . 1 1 4 4 VAL N N 5 119.318 119.318 119.915 -0.597 18003
9444 1 16 . 1 1 4 4 VAL HA H 5 4.128 4.128 4.250 -0.122 18003
9445 1 16 . 1 1 4 4 VAL C C 5 176.361 176.361 174.160 2.201 18003
9446 1 16 . 1 1 4 4 VAL CA C 5 61.987 61.987 60.739 1.248 18003
9447 1 16 . 1 1 4 4 VAL CB C 5 32.635 32.635 34.087 -1.452 18003
9448 1 16 . 1 1 4 4 VAL H H 5 8.094 8.094 7.475 0.619 18003
9449 1 16 . 1 1 5 5 GLU N N 6 124.369 124.369 125.543 -1.174 18003
9450 1 16 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.205 0.083 18003
9451 1 16 . 1 1 5 5 GLU C C 6 177.012 177.012 177.150 -0.138 18003
9452 1 16 . 1 1 5 5 GLU CA C 6 56.699 56.699 56.804 -0.105 18003
9453 1 16 . 1 1 5 5 GLU CB C 6 30.029 30.029 30.125 -0.097 18003
9454 1 16 . 1 1 5 5 GLU H H 6 8.545 8.545 8.499 0.046 18003
9455 1 16 . 1 1 6 6 GLY N N 7 109.747 109.747 110.470 -0.723 18003
9456 1 16 . 1 1 6 6 GLY C C 7 174.117 174.117 174.002 0.115 18003
9457 1 16 . 1 1 6 6 GLY CA C 7 45.568 45.568 44.828 0.740 18003
9458 1 16 . 1 1 6 6 GLY H H 7 8.352 8.352 8.265 0.087 18003
9459 1 16 . 1 1 7 7 ARG N N 8 120.059 120.059 120.217 -0.158 18003
9460 1 16 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.275 0.067 18003
9461 1 16 . 1 1 7 7 ARG C C 8 176.016 176.016 175.973 0.043 18003
9462 1 16 . 1 1 7 7 ARG CA C 8 55.833 55.833 56.300 -0.467 18003
9463 1 16 . 1 1 7 7 ARG CB C 8 30.444 30.444 30.858 -0.414 18003
9464 1 16 . 1 1 7 7 ARG H H 8 8.084 8.084 8.410 -0.326 18003
9465 1 16 . 1 1 8 8 ASN N N 9 119.379 119.379 121.698 -2.319 18003
9466 1 16 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.848 -0.516 18003
9467 1 16 . 1 1 8 8 ASN C C 9 174.667 174.667 176.198 -1.531 18003
9468 1 16 . 1 1 8 8 ASN CA C 9 53.441 53.441 53.334 0.107 18003
9469 1 16 . 1 1 8 8 ASN CB C 9 38.480 38.480 38.773 -0.293 18003
9470 1 16 . 1 1 8 8 ASN H H 9 8.411 8.411 8.802 -0.391 18003
9471 1 16 . 1 1 9 9 ARG N N 10 121.700 121.700 120.224 1.476 18003
9472 1 16 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.391 0.258 18003
9473 1 16 . 1 1 9 9 ARG CA C 10 53.147 53.147 57.367 -4.220 18003
9474 1 16 . 1 1 9 9 ARG CB C 10 30.197 30.197 29.283 0.914 18003
9475 1 16 . 1 1 9 9 ARG H H 10 8.138 8.138 8.050 0.088 18003
9476 1 16 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.486 -0.043 18003
9477 1 16 . 1 1 10 10 PRO C C 11 176.815 176.815 175.507 1.308 18003
9478 1 16 . 1 1 10 10 PRO CA C 11 63.177 63.177 63.712 -0.535 18003
9479 1 16 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.260 -0.439 18003
9480 1 16 . 1 1 11 11 SER N N 12 116.291 116.291 116.349 -0.058 18003
9481 1 16 . 1 1 11 11 SER HA H 12 4.418 4.418 4.498 -0.080 18003
9482 1 16 . 1 1 11 11 SER C C 12 173.702 173.702 173.401 0.301 18003
9483 1 16 . 1 1 11 11 SER CA C 12 58.031 58.031 57.744 0.287 18003
9484 1 16 . 1 1 11 11 SER CB C 12 64.032 64.032 64.832 -0.800 18003
9485 1 16 . 1 1 11 11 SER H H 12 8.325 8.325 7.998 0.327 18003
9486 1 16 . 1 1 12 12 ALA N N 13 126.862 126.862 124.514 2.348 18003
9487 1 16 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.205 0.183 18003
9488 1 16 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.670 -1.212 18003
9489 1 16 . 1 1 12 12 ALA CB C 13 18.257 18.257 17.688 0.570 18003
9490 1 16 . 1 1 12 12 ALA H H 13 8.166 8.166 8.387 -0.221 18003
9491 1 16 . 1 1 13 13 PRO C C 14 176.368 176.368 176.236 0.132 18003
9492 1 16 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.596 0.341 18003
9493 1 16 . 1 1 13 13 PRO CB C 14 32.022 32.022 32.351 -0.329 18003
9494 1 16 . 1 1 14 14 LEU N N 15 120.969 120.969 124.804 -3.835 18003
9495 1 16 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.376 -0.118 18003
9496 1 16 . 1 1 14 14 LEU C C 15 176.124 176.124 177.869 -1.745 18003
9497 1 16 . 1 1 14 14 LEU CA C 15 54.527 54.527 54.540 -0.013 18003
9498 1 16 . 1 1 14 14 LEU CB C 15 43.418 43.418 41.736 1.682 18003
9499 1 16 . 1 1 14 14 LEU H H 15 7.875 7.875 8.166 -0.291 18003
9500 1 16 . 1 1 15 15 ASP N N 16 121.780 121.780 125.300 -3.520 18003
9501 1 16 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.170 0.423 18003
9502 1 16 . 1 1 15 15 ASP C C 16 176.208 176.208 177.996 -1.788 18003
9503 1 16 . 1 1 15 15 ASP CA C 16 52.468 52.468 57.055 -4.587 18003
9504 1 16 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.813 0.816 18003
9505 1 16 . 1 1 15 15 ASP H H 16 7.850 7.850 8.934 -1.084 18003
9506 1 16 . 1 1 16 16 SER N N 17 114.435 114.435 114.252 0.183 18003
9507 1 16 . 1 1 16 16 SER HA H 17 4.120 4.120 4.057 0.063 18003
9508 1 16 . 1 1 16 16 SER C C 17 177.207 177.207 176.512 0.695 18003
9509 1 16 . 1 1 16 16 SER CA C 17 62.322 62.322 61.141 1.181 18003
9510 1 16 . 1 1 16 16 SER H H 17 8.658 8.658 8.192 0.466 18003
9511 1 16 . 1 1 17 17 GLN N N 18 122.403 122.403 119.390 3.013 18003
9512 1 16 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.065 0.132 18003
9513 1 16 . 1 1 17 17 GLN C C 18 178.715 178.715 178.202 0.513 18003
9514 1 16 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.664 -0.552 18003
9515 1 16 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.520 -0.480 18003
9516 1 16 . 1 1 17 17 GLN H H 18 8.140 8.140 8.148 -0.008 18003
9517 1 16 . 1 1 18 18 ALA N N 19 124.743 124.743 122.641 2.102 18003
9518 1 16 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.093 0.083 18003
9519 1 16 . 1 1 18 18 ALA C C 19 180.616 180.616 179.141 1.475 18003
9520 1 16 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.620 -0.015 18003
9521 1 16 . 1 1 18 18 ALA CB C 19 19.028 19.028 18.157 0.871 18003
9522 1 16 . 1 1 18 18 ALA H H 19 8.455 8.455 8.115 0.340 18003
9523 1 16 . 1 1 19 19 ALA N N 20 119.089 119.089 121.654 -2.565 18003
9524 1 16 . 1 1 19 19 ALA HA H 20 4.179 4.179 3.921 0.258 18003
9525 1 16 . 1 1 19 19 ALA C C 20 179.239 179.239 179.121 0.118 18003
9526 1 16 . 1 1 19 19 ALA CA C 20 55.271 55.271 55.224 0.047 18003
9527 1 16 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.377 -0.185 18003
9528 1 16 . 1 1 19 19 ALA H H 20 8.993 8.993 8.201 0.792 18003
9529 1 16 . 1 1 20 20 ALA N N 21 119.226 119.226 121.090 -1.864 18003
9530 1 16 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.892 0.168 18003
9531 1 16 . 1 1 20 20 ALA C C 21 180.230 180.230 179.547 0.683 18003
9532 1 16 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.178 -0.035 18003
9533 1 16 . 1 1 20 20 ALA CB C 21 18.028 18.028 17.943 0.085 18003
9534 1 16 . 1 1 20 20 ALA H H 21 7.724 7.724 7.814 -0.090 18003
9535 1 16 . 1 1 21 21 GLN N N 22 119.310 119.310 118.870 0.440 18003
9536 1 16 . 1 1 21 21 GLN HA H 22 4.129 4.129 3.956 0.173 18003
9537 1 16 . 1 1 21 21 GLN C C 22 179.319 179.319 178.358 0.961 18003
9538 1 16 . 1 1 21 21 GLN CA C 22 58.762 58.762 58.987 -0.225 18003
9539 1 16 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.798 -0.769 18003
9540 1 16 . 1 1 21 21 GLN H H 22 7.638 7.638 7.847 -0.209 18003
9541 1 16 . 1 1 22 22 VAL N N 23 121.565 121.565 119.598 1.967 18003
9542 1 16 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.653 0.313 18003
9543 1 16 . 1 1 22 22 VAL C C 23 178.026 178.026 177.877 0.149 18003
9544 1 16 . 1 1 22 22 VAL CA C 23 66.142 66.142 65.980 0.162 18003
9545 1 16 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.147 -0.181 18003
9546 1 16 . 1 1 22 22 VAL H H 23 8.442 8.442 8.068 0.374 18003
9547 1 16 . 1 1 23 23 ALA N N 24 121.400 121.400 122.881 -1.481 18003
9548 1 16 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.850 0.246 18003
9549 1 16 . 1 1 23 23 ALA C C 24 178.758 178.758 179.793 -1.035 18003
9550 1 16 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.708 0.207 18003
9551 1 16 . 1 1 23 23 ALA CB C 24 16.650 16.650 18.032 -1.382 18003
9552 1 16 . 1 1 23 23 ALA H H 24 8.495 8.495 8.584 -0.089 18003
9553 1 16 . 1 1 24 24 SER N N 25 112.138 112.138 114.497 -2.359 18003
9554 1 16 . 1 1 24 24 SER HA H 25 4.093 4.093 4.104 -0.011 18003
9555 1 16 . 1 1 24 24 SER C C 25 177.271 177.271 176.887 0.384 18003
9556 1 16 . 1 1 24 24 SER CA C 25 62.166 62.166 62.352 -0.186 18003
9557 1 16 . 1 1 24 24 SER CB C 25 63.032 63.032 63.113 -0.081 18003
9558 1 16 . 1 1 24 24 SER H H 25 7.936 7.936 8.165 -0.229 18003
9559 1 16 . 1 1 25 25 THR N N 26 119.701 119.701 120.109 -0.408 18003
9560 1 16 . 1 1 25 25 THR HA H 26 4.380 4.380 3.957 0.423 18003
9561 1 16 . 1 1 25 25 THR C C 26 175.456 175.456 176.453 -0.997 18003
9562 1 16 . 1 1 25 25 THR CA C 26 67.129 67.129 67.280 -0.151 18003
9563 1 16 . 1 1 25 25 THR CB C 26 68.800 68.800 68.814 -0.014 18003
9564 1 16 . 1 1 25 25 THR H H 26 7.775 7.775 7.609 0.166 18003
9565 1 16 . 1 1 26 26 LEU N N 27 119.270 119.270 120.399 -1.129 18003
9566 1 16 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.025 -0.462 18003
9567 1 16 . 1 1 26 26 LEU C C 27 178.390 178.390 178.924 -0.534 18003
9568 1 16 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.300 0.369 18003
9569 1 16 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.430 0.600 18003
9570 1 16 . 1 1 26 26 LEU H H 27 8.006 8.006 8.594 -0.588 18003
9571 1 16 . 1 1 27 27 GLN N N 28 115.843 115.843 119.729 -3.886 18003
9572 1 16 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.057 -0.253 18003
9573 1 16 . 1 1 27 27 GLN C C 28 178.657 178.657 178.135 0.522 18003
9574 1 16 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.855 -0.143 18003
9575 1 16 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.911 -0.882 18003
9576 1 16 . 1 1 27 27 GLN H H 28 8.485 8.485 8.130 0.355 18003
9577 1 16 . 1 1 28 28 ALA N N 29 118.779 118.779 122.355 -3.576 18003
9578 1 16 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.095 -0.087 18003
9579 1 16 . 1 1 28 28 ALA C C 29 178.259 178.259 180.555 -2.296 18003
9580 1 16 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.733 -0.770 18003
9581 1 16 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.361 0.377 18003
9582 1 16 . 1 1 28 28 ALA H H 29 7.432 7.432 8.073 -0.641 18003
9583 1 16 . 1 1 29 29 LEU N N 30 113.442 113.442 118.113 -4.671 18003
9584 1 16 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.895 0.101 18003
9585 1 16 . 1 1 29 29 LEU C C 30 175.924 175.924 176.990 -1.066 18003
9586 1 16 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.933 -1.369 18003
9587 1 16 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.538 0.728 18003
9588 1 16 . 1 1 29 29 LEU H H 30 7.311 7.311 7.964 -0.653 18003
9589 1 16 . 1 1 30 30 ALA N N 31 119.563 119.563 118.675 0.888 18003
9590 1 16 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.186 -0.014 18003
9591 1 16 . 1 1 30 30 ALA C C 31 176.316 176.316 176.440 -0.124 18003
9592 1 16 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.160 -1.504 18003
9593 1 16 . 1 1 30 30 ALA CB C 31 18.077 18.077 19.142 -1.065 18003
9594 1 16 . 1 1 30 30 ALA H H 31 7.223 7.223 7.186 0.037 18003
9595 1 16 . 1 1 31 31 THR N N 32 114.613 114.613 108.026 6.587 18003
9596 1 16 . 1 1 31 31 THR HA H 32 4.950 4.950 4.100 0.850 18003
9597 1 16 . 1 1 31 31 THR CA C 32 58.129 58.129 61.934 -3.805 18003
9598 1 16 . 1 1 31 31 THR CB C 32 69.098 69.098 67.313 1.785 18003
9599 1 16 . 1 1 31 31 THR H H 32 8.399 8.399 8.175 0.224 18003
9600 1 16 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.180 0.258 18003
9601 1 16 . 1 1 32 32 PRO C C 33 178.207 178.207 178.988 -0.781 18003
9602 1 16 . 1 1 32 32 PRO CA C 33 66.905 66.905 66.060 0.845 18003
9603 1 16 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.404 -0.140 18003
9604 1 16 . 1 1 33 33 SER N N 34 110.767 110.767 113.187 -2.420 18003
9605 1 16 . 1 1 33 33 SER HA H 34 4.026 4.026 4.182 -0.156 18003
9606 1 16 . 1 1 33 33 SER C C 34 176.742 176.742 176.672 0.070 18003
9607 1 16 . 1 1 33 33 SER CA C 34 61.782 61.782 61.401 0.381 18003
9608 1 16 . 1 1 33 33 SER CB C 34 62.432 62.432 62.857 -0.425 18003
9609 1 16 . 1 1 33 33 SER H H 34 8.407 8.407 8.300 0.107 18003
9610 1 16 . 1 1 34 34 ARG N N 35 120.135 120.135 122.584 -2.449 18003
9611 1 16 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.110 -0.056 18003
9612 1 16 . 1 1 34 34 ARG C C 35 178.283 178.283 178.665 -0.382 18003
9613 1 16 . 1 1 34 34 ARG CA C 35 60.532 60.532 59.153 1.379 18003
9614 1 16 . 1 1 34 34 ARG CB C 35 28.953 28.953 30.053 -1.100 18003
9615 1 16 . 1 1 34 34 ARG H H 35 7.341 7.341 8.141 -0.800 18003
9616 1 16 . 1 1 35 35 LEU N N 36 118.454 118.454 121.129 -2.675 18003
9617 1 16 . 1 1 35 35 LEU HA H 36 4.054 4.054 3.940 0.114 18003
9618 1 16 . 1 1 35 35 LEU C C 36 180.643 180.643 179.165 1.478 18003
9619 1 16 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.355 -0.546 18003
9620 1 16 . 1 1 35 35 LEU CB C 36 41.778 41.778 41.930 -0.152 18003
9621 1 16 . 1 1 35 35 LEU H H 36 8.226 8.226 8.542 -0.316 18003
9622 1 16 . 1 1 36 36 MET N N 37 121.073 121.073 119.888 1.185 18003
9623 1 16 . 1 1 36 36 MET HA H 37 3.928 3.928 4.146 -0.218 18003
9624 1 16 . 1 1 36 36 MET C C 37 177.671 177.671 179.101 -1.430 18003
9625 1 16 . 1 1 36 36 MET CA C 37 60.613 60.613 57.837 2.776 18003
9626 1 16 . 1 1 36 36 MET CB C 37 33.128 33.128 31.917 1.211 18003
9627 1 16 . 1 1 36 36 MET H H 37 8.447 8.447 8.183 0.264 18003
9628 1 16 . 1 1 37 37 ILE N N 38 118.239 118.239 119.613 -1.374 18003
9629 1 16 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.669 -0.229 18003
9630 1 16 . 1 1 37 37 ILE C C 38 177.092 177.092 178.204 -1.112 18003
9631 1 16 . 1 1 37 37 ILE CA C 38 65.675 65.675 65.221 0.454 18003
9632 1 16 . 1 1 37 37 ILE CB C 38 38.255 38.255 37.627 0.628 18003
9633 1 16 . 1 1 37 37 ILE H H 38 7.763 7.763 7.895 -0.132 18003
9634 1 16 . 1 1 38 38 LEU N N 39 116.073 116.073 120.441 -4.368 18003
9635 1 16 . 1 1 38 38 LEU HA H 39 3.826 3.826 4.039 -0.213 18003
9636 1 16 . 1 1 38 38 LEU C C 39 178.941 178.941 179.336 -0.395 18003
9637 1 16 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.271 -0.240 18003
9638 1 16 . 1 1 38 38 LEU CB C 39 41.780 41.780 40.881 0.899 18003
9639 1 16 . 1 1 38 38 LEU H H 39 8.538 8.538 8.534 0.004 18003
9640 1 16 . 1 1 39 39 THR N N 40 106.678 106.678 112.521 -5.843 18003
9641 1 16 . 1 1 39 39 THR HA H 40 3.932 3.932 3.891 0.041 18003
9642 1 16 . 1 1 39 39 THR C C 40 177.747 177.747 176.799 0.948 18003
9643 1 16 . 1 1 39 39 THR CA C 40 65.536 65.536 66.025 -0.489 18003
9644 1 16 . 1 1 39 39 THR CB C 40 68.360 68.360 68.659 -0.299 18003
9645 1 16 . 1 1 39 39 THR H H 40 8.086 8.086 8.677 -0.591 18003
9646 1 16 . 1 1 40 40 GLN N N 41 122.344 122.344 120.809 1.535 18003
9647 1 16 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.068 -0.062 18003
9648 1 16 . 1 1 40 40 GLN C C 41 178.348 178.348 178.664 -0.316 18003
9649 1 16 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.786 -0.861 18003
9650 1 16 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.431 -0.911 18003
9651 1 16 . 1 1 40 40 GLN H H 41 7.593 7.593 7.713 -0.120 18003
9652 1 16 . 1 1 41 41 LEU N N 42 116.302 116.302 119.488 -3.186 18003
9653 1 16 . 1 1 41 41 LEU C C 42 178.418 178.418 179.895 -1.477 18003
9654 1 16 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.279 -1.748 18003
9655 1 16 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.853 -0.504 18003
9656 1 16 . 1 1 41 41 LEU H H 42 7.570 7.570 7.919 -0.349 18003
9657 1 16 . 1 1 42 42 ARG N N 43 119.954 119.954 118.123 1.831 18003
9658 1 16 . 1 1 42 42 ARG HA H 43 3.915 3.915 3.928 -0.013 18003
9659 1 16 . 1 1 42 42 ARG C C 43 177.205 177.205 177.963 -0.758 18003
9660 1 16 . 1 1 42 42 ARG CA C 43 58.704 58.704 59.215 -0.512 18003
9661 1 16 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.127 -0.684 18003
9662 1 16 . 1 1 42 42 ARG H H 43 7.612 7.612 8.332 -0.720 18003
9663 1 16 . 1 1 43 43 ASN N N 44 114.682 114.682 116.363 -1.681 18003
9664 1 16 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.585 0.175 18003
9665 1 16 . 1 1 43 43 ASN C C 44 174.507 174.507 175.696 -1.189 18003
9666 1 16 . 1 1 43 43 ASN CA C 44 53.953 53.953 54.643 -0.690 18003
9667 1 16 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.081 -0.051 18003
9668 1 16 . 1 1 43 43 ASN H H 44 7.567 7.567 7.765 -0.198 18003
9669 1 16 . 1 1 44 44 GLY N N 45 109.113 109.113 106.111 3.002 18003
9670 1 16 . 1 1 44 44 GLY CA C 45 44.268 44.268 44.759 -0.491 18003
9671 1 16 . 1 1 44 44 GLY H H 45 7.361 7.361 7.570 -0.209 18003
9672 1 16 . 1 1 45 45 PRO C C 46 178.412 178.412 176.160 2.252 18003
9673 1 16 . 1 1 45 45 PRO CA C 46 62.580 62.580 63.714 -1.134 18003
9674 1 16 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.901 1.228 18003
9675 1 16 . 1 1 46 46 LEU N N 47 120.363 120.363 118.565 1.798 18003
9676 1 16 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.709 0.322 18003
9677 1 16 . 1 1 46 46 LEU CA C 47 52.550 52.550 53.512 -0.962 18003
9678 1 16 . 1 1 46 46 LEU CB C 47 48.210 48.210 41.723 6.487 18003
9679 1 16 . 1 1 46 46 LEU H H 47 8.252 8.252 8.097 0.155 18003
9680 1 16 . 1 1 47 47 PRO C C 48 177.313 177.313 178.531 -1.218 18003
9681 1 16 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.502 -0.667 18003
9682 1 16 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.543 -0.160 18003
9683 1 16 . 1 1 48 48 VAL N N 49 119.384 119.384 116.758 2.626 18003
9684 1 16 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.729 -0.122 18003
9685 1 16 . 1 1 48 48 VAL C C 49 176.710 176.710 178.206 -1.496 18003
9686 1 16 . 1 1 48 48 VAL CA C 49 66.188 66.188 66.776 -0.588 18003
9687 1 16 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.082 0.499 18003
9688 1 16 . 1 1 48 48 VAL H H 49 9.074 9.074 8.873 0.201 18003
9689 1 16 . 1 1 49 49 THR N N 50 111.293 111.293 115.981 -4.688 18003
9690 1 16 . 1 1 49 49 THR HA H 50 4.181 4.181 4.102 0.079 18003
9691 1 16 . 1 1 49 49 THR C C 50 176.717 176.717 176.520 0.197 18003
9692 1 16 . 1 1 49 49 THR CA C 50 65.063 65.063 67.381 -2.318 18003
9693 1 16 . 1 1 49 49 THR CB C 50 68.032 68.032 68.009 0.023 18003
9694 1 16 . 1 1 49 49 THR H H 50 7.848 7.848 8.285 -0.437 18003
9695 1 16 . 1 1 50 50 ASP N N 51 120.138 120.138 122.195 -2.057 18003
9696 1 16 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.513 -0.308 18003
9697 1 16 . 1 1 50 50 ASP C C 51 174.723 174.723 178.636 -3.913 18003
9698 1 16 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.702 -0.921 18003
9699 1 16 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.720 0.391 18003
9700 1 16 . 1 1 50 50 ASP H H 51 7.108 7.108 8.184 -1.076 18003
9701 1 16 . 1 1 51 51 LEU N N 52 121.089 121.089 121.085 0.004 18003
9702 1 16 . 1 1 51 51 LEU HA H 52 3.985 3.985 4.010 -0.025 18003
9703 1 16 . 1 1 51 51 LEU C C 52 177.089 177.089 178.359 -1.270 18003
9704 1 16 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.863 0.298 18003
9705 1 16 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.972 -0.192 18003
9706 1 16 . 1 1 51 51 LEU H H 52 7.943 7.943 8.540 -0.597 18003
9707 1 16 . 1 1 52 52 ALA N N 53 119.237 119.237 120.013 -0.776 18003
9708 1 16 . 1 1 52 52 ALA HA H 53 3.872 3.872 4.010 -0.138 18003
9709 1 16 . 1 1 52 52 ALA C C 53 179.466 179.466 179.989 -0.523 18003
9710 1 16 . 1 1 52 52 ALA CA C 53 55.663 55.663 54.905 0.758 18003
9711 1 16 . 1 1 52 52 ALA CB C 53 17.619 17.619 18.043 -0.424 18003
9712 1 16 . 1 1 52 52 ALA H H 53 8.480 8.480 8.508 -0.028 18003
9713 1 16 . 1 1 53 53 GLU N N 54 115.655 115.655 119.953 -4.298 18003
9714 1 16 . 1 1 53 53 GLU HA H 54 4.054 4.054 3.995 0.059 18003
9715 1 16 . 1 1 53 53 GLU C C 54 179.073 179.073 178.474 0.599 18003
9716 1 16 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.823 0.004 18003
9717 1 16 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.567 -0.167 18003
9718 1 16 . 1 1 53 53 GLU H H 54 7.705 7.705 8.036 -0.331 18003
9719 1 16 . 1 1 54 54 ALA N N 55 120.276 120.276 121.960 -1.684 18003
9720 1 16 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.109 0.028 18003
9721 1 16 . 1 1 54 54 ALA C C 55 179.771 179.771 178.714 1.057 18003
9722 1 16 . 1 1 54 54 ALA CA C 55 54.661 54.661 55.017 -0.356 18003
9723 1 16 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.057 -0.822 18003
9724 1 16 . 1 1 54 54 ALA H H 55 7.928 7.928 7.976 -0.048 18003
9725 1 16 . 1 1 55 55 ILE N N 56 107.195 107.195 110.487 -3.292 18003
9726 1 16 . 1 1 55 55 ILE C C 56 176.053 176.053 177.266 -1.213 18003
9727 1 16 . 1 1 55 55 ILE CA C 56 60.551 60.551 61.237 -0.686 18003
9728 1 16 . 1 1 55 55 ILE CB C 56 38.497 38.497 38.518 -0.021 18003
9729 1 16 . 1 1 55 55 ILE H H 56 7.507 7.507 7.328 0.179 18003
9730 1 16 . 1 1 56 56 GLY N N 57 111.108 111.108 111.523 -0.415 18003
9731 1 16 . 1 1 56 56 GLY C C 57 174.421 174.421 175.244 -0.823 18003
9732 1 16 . 1 1 56 56 GLY CA C 57 46.960 46.960 46.149 0.811 18003
9733 1 16 . 1 1 56 56 GLY H H 57 7.757 7.757 7.863 -0.106 18003
9734 1 16 . 1 1 57 57 MET N N 58 118.089 118.089 118.128 -0.039 18003
9735 1 16 . 1 1 57 57 MET HA H 58 3.933 3.933 4.167 -0.234 18003
9736 1 16 . 1 1 57 57 MET C C 58 174.157 174.157 174.924 -0.767 18003
9737 1 16 . 1 1 57 57 MET CA C 58 54.091 54.091 55.768 -1.677 18003
9738 1 16 . 1 1 57 57 MET CB C 58 38.062 38.062 31.049 7.013 18003
9739 1 16 . 1 1 57 57 MET H H 58 7.659 7.659 7.877 -0.218 18003
9740 1 16 . 1 1 58 58 GLU N N 59 121.656 121.656 118.460 3.196 18003
9741 1 16 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.381 -0.041 18003
9742 1 16 . 1 1 58 58 GLU C C 59 178.355 178.355 176.116 2.239 18003
9743 1 16 . 1 1 58 58 GLU CA C 59 56.643 56.643 56.358 0.285 18003
9744 1 16 . 1 1 58 58 GLU CB C 59 30.029 30.029 30.006 0.023 18003
9745 1 16 . 1 1 58 58 GLU H H 59 8.523 8.523 8.155 0.368 18003
9746 1 16 . 1 1 59 59 GLN N N 60 123.686 123.686 119.862 3.824 18003
9747 1 16 . 1 1 59 59 GLN HA H 60 4.214 4.214 3.911 0.303 18003
9748 1 16 . 1 1 59 59 GLN C C 60 177.961 177.961 176.942 1.019 18003
9749 1 16 . 1 1 59 59 GLN CA C 60 60.616 60.616 59.208 1.408 18003
9750 1 16 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.608 0.407 18003
9751 1 16 . 1 1 59 59 GLN H H 60 9.009 9.009 8.732 0.277 18003
9752 1 16 . 1 1 60 60 SER N N 61 115.101 115.101 116.163 -1.062 18003
9753 1 16 . 1 1 60 60 SER C C 61 176.801 176.801 176.134 0.667 18003
9754 1 16 . 1 1 60 60 SER CA C 61 61.213 61.213 62.005 -0.791 18003
9755 1 16 . 1 1 60 60 SER H H 61 8.964 8.964 8.033 0.931 18003
9756 1 16 . 1 1 61 61 ALA N N 62 126.069 126.069 124.112 1.957 18003
9757 1 16 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.110 0.241 18003
9758 1 16 . 1 1 61 61 ALA C C 62 180.635 180.635 179.354 1.281 18003
9759 1 16 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.845 -0.587 18003
9760 1 16 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.223 0.400 18003
9761 1 16 . 1 1 61 61 ALA H H 62 7.103 7.103 8.375 -1.272 18003
9762 1 16 . 1 1 62 62 VAL N N 63 119.252 119.252 119.223 0.029 18003
9763 1 16 . 1 1 62 62 VAL C C 63 177.842 177.842 177.773 0.069 18003
9764 1 16 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.426 0.372 18003
9765 1 16 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.414 -0.150 18003
9766 1 16 . 1 1 62 62 VAL H H 63 7.971 7.971 7.542 0.429 18003
9767 1 16 . 1 1 63 63 SER N N 64 115.494 115.494 115.089 0.405 18003
9768 1 16 . 1 1 63 63 SER HA H 64 4.034 4.034 3.916 0.118 18003
9769 1 16 . 1 1 63 63 SER C C 64 176.835 176.835 176.552 0.283 18003
9770 1 16 . 1 1 63 63 SER CA C 64 62.400 62.400 61.770 0.630 18003
9771 1 16 . 1 1 63 63 SER CB C 64 62.752 62.752 63.016 -0.264 18003
9772 1 16 . 1 1 63 63 SER H H 64 8.743 8.743 8.148 0.595 18003
9773 1 16 . 1 1 64 64 HIS N N 65 120.010 120.010 120.902 -0.892 18003
9774 1 16 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.263 0.097 18003
9775 1 16 . 1 1 64 64 HIS C C 65 177.731 177.731 177.513 0.218 18003
9776 1 16 . 1 1 64 64 HIS CA C 65 59.998 59.998 59.727 0.271 18003
9777 1 16 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.856 0.078 18003
9778 1 16 . 1 1 64 64 HIS H H 65 7.804 7.804 8.072 -0.268 18003
9779 1 16 . 1 1 65 65 GLN N N 66 115.590 115.590 118.618 -3.028 18003
9780 1 16 . 1 1 65 65 GLN HA H 66 4.035 4.035 3.858 0.177 18003
9781 1 16 . 1 1 65 65 GLN C C 66 179.055 179.055 178.412 0.643 18003
9782 1 16 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.847 -1.317 18003
9783 1 16 . 1 1 65 65 GLN H H 66 7.751 7.751 7.960 -0.209 18003
9784 1 16 . 1 1 66 66 LEU N N 67 118.746 118.746 121.181 -2.435 18003
9785 1 16 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.862 0.085 18003
9786 1 16 . 1 1 66 66 LEU C C 67 178.334 178.334 178.459 -0.125 18003
9787 1 16 . 1 1 66 66 LEU CA C 67 57.846 57.846 58.192 -0.346 18003
9788 1 16 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.753 -0.650 18003
9789 1 16 . 1 1 66 66 LEU H H 67 8.648 8.648 8.576 0.072 18003
9790 1 16 . 1 1 67 67 ARG N N 68 119.610 119.610 118.677 0.933 18003
9791 1 16 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.886 0.057 18003
9792 1 16 . 1 1 67 67 ARG C C 68 178.807 178.807 178.749 0.058 18003
9793 1 16 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.560 -0.183 18003
9794 1 16 . 1 1 67 67 ARG CB C 68 29.475 29.475 30.006 -0.531 18003
9795 1 16 . 1 1 67 67 ARG H H 68 7.607 7.607 7.936 -0.329 18003
9796 1 16 . 1 1 68 68 VAL N N 69 119.719 119.719 120.237 -0.518 18003
9797 1 16 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.602 0.031 18003
9798 1 16 . 1 1 68 68 VAL C C 69 178.690 178.690 177.975 0.715 18003
9799 1 16 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.479 -0.025 18003
9800 1 16 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.378 0.401 18003
9801 1 16 . 1 1 68 68 VAL H H 69 7.259 7.259 7.567 -0.308 18003
9802 1 16 . 1 1 69 69 LEU N N 70 117.532 117.532 118.812 -1.280 18003
9803 1 16 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.910 0.038 18003
9804 1 16 . 1 1 69 69 LEU C C 70 179.144 179.144 178.979 0.165 18003
9805 1 16 . 1 1 69 69 LEU CA C 70 57.750 57.750 57.853 -0.103 18003
9806 1 16 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.227 0.632 18003
9807 1 16 . 1 1 69 69 LEU H H 70 8.375 8.375 8.158 0.217 18003
9808 1 16 . 1 1 70 70 ARG N N 71 122.498 122.498 119.778 2.720 18003
9809 1 16 . 1 1 70 70 ARG HA H 71 3.931 3.931 3.992 -0.061 18003
9810 1 16 . 1 1 70 70 ARG C C 71 180.499 180.499 178.483 2.016 18003
9811 1 16 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.168 -0.391 18003
9812 1 16 . 1 1 70 70 ARG CB C 71 30.155 30.155 29.735 0.420 18003
9813 1 16 . 1 1 70 70 ARG H H 71 8.822 8.822 8.427 0.395 18003
9814 1 16 . 1 1 71 71 ASN N N 72 121.816 121.816 118.701 3.115 18003
9815 1 16 . 1 1 71 71 ASN C C 72 177.170 177.170 177.470 -0.300 18003
9816 1 16 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.476 0.301 18003
9817 1 16 . 1 1 71 71 ASN CB C 72 37.734 37.734 37.669 0.066 18003
9818 1 16 . 1 1 71 71 ASN H H 72 8.144 8.144 7.887 0.257 18003
9819 1 16 . 1 1 72 72 LEU N N 73 117.044 117.044 117.803 -0.759 18003
9820 1 16 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.243 0.102 18003
9821 1 16 . 1 1 72 72 LEU C C 73 176.984 176.984 178.026 -1.042 18003
9822 1 16 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.183 -1.058 18003
9823 1 16 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.027 1.242 18003
9824 1 16 . 1 1 72 72 LEU H H 73 7.804 7.804 7.333 0.471 18003
9825 1 16 . 1 1 73 73 GLY N N 74 106.621 106.621 104.942 1.679 18003
9826 1 16 . 1 1 73 73 GLY C C 74 173.266 173.266 174.645 -1.379 18003
9827 1 16 . 1 1 73 73 GLY CA C 74 46.022 46.022 45.207 0.815 18003
9828 1 16 . 1 1 73 73 GLY H H 74 7.851 7.851 8.010 -0.159 18003
9829 1 16 . 1 1 74 74 LEU N N 75 114.582 114.582 119.041 -4.459 18003
9830 1 16 . 1 1 74 74 LEU C C 75 177.562 177.562 176.304 1.258 18003
9831 1 16 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.352 0.679 18003
9832 1 16 . 1 1 74 74 LEU CB C 75 44.444 44.444 42.986 1.458 18003
9833 1 16 . 1 1 74 74 LEU H H 75 7.808 7.808 7.743 0.065 18003
9834 1 16 . 1 1 75 75 VAL N N 76 110.980 110.980 112.380 -1.400 18003
9835 1 16 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.551 -0.024 18003
9836 1 16 . 1 1 75 75 VAL C C 76 173.922 173.922 174.237 -0.315 18003
9837 1 16 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.587 -2.644 18003
9838 1 16 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.557 0.472 18003
9839 1 16 . 1 1 75 75 VAL H H 76 7.079 7.079 7.380 -0.301 18003
9840 1 16 . 1 1 76 76 VAL N N 77 118.619 118.619 120.434 -1.815 18003
9841 1 16 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.458 0.844 18003
9842 1 16 . 1 1 76 76 VAL C C 77 174.041 174.041 174.504 -0.463 18003
9843 1 16 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.884 -0.885 18003
9844 1 16 . 1 1 76 76 VAL H H 77 9.024 9.024 9.258 -0.234 18003
9845 1 16 . 1 1 77 77 GLY N N 78 109.451 109.451 111.096 -1.645 18003
9846 1 16 . 1 1 77 77 GLY C C 78 172.225 172.225 172.787 -0.562 18003
9847 1 16 . 1 1 77 77 GLY CA C 78 44.462 44.462 44.366 0.096 18003
9848 1 16 . 1 1 77 77 GLY H H 78 8.265 8.265 8.441 -0.176 18003
9849 1 16 . 1 1 78 78 ASP N N 79 122.826 122.826 123.505 -0.679 18003
9850 1 16 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.829 -0.083 18003
9851 1 16 . 1 1 78 78 ASP C C 79 174.817 174.817 174.977 -0.160 18003
9852 1 16 . 1 1 78 78 ASP CA C 79 53.111 53.111 52.788 0.323 18003
9853 1 16 . 1 1 78 78 ASP CB C 79 43.655 43.655 42.664 0.991 18003
9854 1 16 . 1 1 78 78 ASP H H 79 8.479 8.479 8.451 0.028 18003
9855 1 16 . 1 1 79 79 ARG N N 80 122.613 122.613 125.408 -2.795 18003
9856 1 16 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.323 0.089 18003
9857 1 16 . 1 1 79 79 ARG C C 80 175.546 175.546 174.789 0.757 18003
9858 1 16 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.282 0.036 18003
9859 1 16 . 1 1 79 79 ARG CB C 80 30.376 30.376 30.747 -0.371 18003
9860 1 16 . 1 1 79 79 ARG H H 80 8.580 8.580 8.588 -0.008 18003
9861 1 16 . 1 1 80 80 ALA N N 81 129.263 129.263 128.804 0.459 18003
9862 1 16 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.647 -0.195 18003
9863 1 16 . 1 1 80 80 ALA C C 81 177.126 177.126 177.471 -0.345 18003
9864 1 16 . 1 1 80 80 ALA CA C 81 51.620 51.620 50.994 0.626 18003
9865 1 16 . 1 1 80 80 ALA CB C 81 19.260 19.260 21.614 -2.354 18003
9866 1 16 . 1 1 80 80 ALA H H 81 8.396 8.396 8.124 0.272 18003
9867 1 16 . 1 1 81 81 GLY N N 82 112.739 112.739 108.810 3.929 18003
9868 1 16 . 1 1 81 81 GLY C C 82 174.856 174.856 175.790 -0.934 18003
9869 1 16 . 1 1 81 81 GLY CA C 82 46.392 46.392 47.078 -0.686 18003
9870 1 16 . 1 1 81 81 GLY H H 82 8.641 8.641 8.749 -0.108 18003
9871 1 16 . 1 1 82 82 ARG N N 83 124.780 124.780 119.619 5.161 18003
9872 1 16 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.353 -0.030 18003
9873 1 16 . 1 1 82 82 ARG C C 83 176.339 176.339 175.839 0.500 18003
9874 1 16 . 1 1 82 82 ARG CA C 83 56.690 56.690 57.037 -0.347 18003
9875 1 16 . 1 1 82 82 ARG CB C 83 30.221 30.221 30.930 -0.709 18003
9876 1 16 . 1 1 82 82 ARG H H 83 8.728 8.728 8.258 0.470 18003
9877 1 16 . 1 1 83 83 SER N N 84 114.678 114.678 108.799 5.879 18003
9878 1 16 . 1 1 83 83 SER C C 84 172.869 172.869 171.917 0.952 18003
9879 1 16 . 1 1 83 83 SER CA C 84 56.834 56.834 57.500 -0.666 18003
9880 1 16 . 1 1 83 83 SER CB C 84 65.191 65.191 64.818 0.373 18003
9881 1 16 . 1 1 83 83 SER H H 84 7.821 7.821 7.353 0.468 18003
9882 1 16 . 1 1 84 84 ILE N N 85 122.996 122.996 122.940 0.056 18003
9883 1 16 . 1 1 84 84 ILE C C 85 175.521 175.521 174.527 0.994 18003
9884 1 16 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.319 0.916 18003
9885 1 16 . 1 1 84 84 ILE CB C 85 38.136 38.136 38.885 -0.749 18003
9886 1 16 . 1 1 84 84 ILE H H 85 8.232 8.232 8.280 -0.048 18003
9887 1 16 . 1 1 85 85 VAL N N 86 121.845 121.845 130.251 -8.406 18003
9888 1 16 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.110 0.200 18003
9889 1 16 . 1 1 85 85 VAL C C 86 174.818 174.818 174.272 0.546 18003
9890 1 16 . 1 1 85 85 VAL CA C 86 59.738 59.738 61.042 -1.304 18003
9891 1 16 . 1 1 85 85 VAL CB C 86 34.221 34.221 33.510 0.711 18003
9892 1 16 . 1 1 85 85 VAL H H 86 8.495 8.495 8.341 0.154 18003
9893 1 16 . 1 1 86 86 TYR N N 87 125.020 125.020 127.312 -2.292 18003
9894 1 16 . 1 1 86 86 TYR HA H 87 4.319 4.319 5.029 -0.710 18003
9895 1 16 . 1 1 86 86 TYR C C 87 173.808 173.808 175.566 -1.758 18003
9896 1 16 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.290 0.175 18003
9897 1 16 . 1 1 86 86 TYR CB C 87 41.480 41.480 39.663 1.817 18003
9898 1 16 . 1 1 86 86 TYR H H 87 8.488 8.488 8.704 -0.216 18003
9899 1 16 . 1 1 87 87 SER N N 88 110.681 110.681 115.314 -4.633 18003
9900 1 16 . 1 1 87 87 SER HA H 88 5.414 5.414 4.917 0.497 18003
9901 1 16 . 1 1 87 87 SER C C 88 174.693 174.693 173.093 1.600 18003
9902 1 16 . 1 1 87 87 SER CA C 88 56.113 56.113 57.315 -1.202 18003
9903 1 16 . 1 1 87 87 SER CB C 88 66.309 66.309 67.457 -1.149 18003
9904 1 16 . 1 1 87 87 SER H H 88 8.718 8.718 9.233 -0.515 18003
9905 1 16 . 1 1 88 88 LEU N N 89 119.612 119.612 122.174 -2.562 18003
9906 1 16 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.237 0.690 18003
9907 1 16 . 1 1 88 88 LEU C C 89 179.031 179.031 177.923 1.108 18003
9908 1 16 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.595 -0.270 18003
9909 1 16 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.348 -0.628 18003
9910 1 16 . 1 1 88 88 LEU H H 89 9.034 9.034 8.614 0.420 18003
9911 1 16 . 1 1 89 89 TYR N N 90 120.540 120.540 123.548 -3.008 18003
9912 1 16 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.157 0.465 18003
9913 1 16 . 1 1 89 89 TYR CA C 90 61.712 61.712 61.137 0.575 18003
9914 1 16 . 1 1 89 89 TYR H H 90 8.075 8.075 8.401 -0.326 18003
9915 1 16 . 1 1 92 92 HIS C C 93 177.850 177.850 177.315 0.535 18003
9916 1 16 . 1 1 93 93 VAL N N 94 120.211 120.211 116.869 3.342 18003
9917 1 16 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.770 -0.269 18003
9918 1 16 . 1 1 93 93 VAL C C 94 176.785 176.785 177.435 -0.650 18003
9919 1 16 . 1 1 93 93 VAL CA C 94 66.666 66.666 65.760 0.906 18003
9920 1 16 . 1 1 93 93 VAL CB C 94 31.637 31.637 30.598 1.039 18003
9921 1 16 . 1 1 93 93 VAL H H 94 8.164 8.164 8.188 -0.024 18003
9922 1 16 . 1 1 94 94 ALA N N 95 119.221 119.221 121.245 -2.024 18003
9923 1 16 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.944 -0.154 18003
9924 1 16 . 1 1 94 94 ALA C C 95 177.979 177.979 179.556 -1.577 18003
9925 1 16 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.095 0.384 18003
9926 1 16 . 1 1 94 94 ALA CB C 95 18.110 18.110 17.993 0.117 18003
9927 1 16 . 1 1 94 94 ALA H H 95 6.942 6.942 7.988 -1.046 18003
9928 1 16 . 1 1 95 95 GLN N N 96 115.416 115.416 119.514 -4.098 18003
9929 1 16 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.026 0.009 18003
9930 1 16 . 1 1 95 95 GLN C C 96 177.993 177.993 178.283 -0.290 18003
9931 1 16 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.591 0.251 18003
9932 1 16 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.407 -0.378 18003
9933 1 16 . 1 1 95 95 GLN H H 96 7.795 7.795 8.286 -0.491 18003
9934 1 16 . 1 1 96 96 LEU N N 97 120.758 120.758 121.058 -0.300 18003
9935 1 16 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.011 -0.162 18003
9936 1 16 . 1 1 96 96 LEU C C 97 177.974 177.974 178.606 -0.632 18003
9937 1 16 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.199 1.083 18003
9938 1 16 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.831 -0.785 18003
9939 1 16 . 1 1 96 96 LEU H H 97 8.197 8.197 7.952 0.245 18003
9940 1 16 . 1 1 97 97 LEU N N 98 117.567 117.567 119.243 -1.676 18003
9941 1 16 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.858 -0.028 18003
9942 1 16 . 1 1 97 97 LEU C C 98 178.219 178.219 178.897 -0.678 18003
9943 1 16 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.348 -0.618 18003
9944 1 16 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.134 0.728 18003
9945 1 16 . 1 1 97 97 LEU H H 98 7.660 7.660 8.046 -0.386 18003
9946 1 16 . 1 1 98 98 ASP N N 99 118.607 118.607 119.391 -0.784 18003
9947 1 16 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.344 -0.235 18003
9948 1 16 . 1 1 98 98 ASP C C 99 179.382 179.382 178.648 0.734 18003
9949 1 16 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.587 0.448 18003
9950 1 16 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.386 -0.547 18003
9951 1 16 . 1 1 98 98 ASP H H 99 8.295 8.295 8.195 0.100 18003
9952 1 16 . 1 1 99 99 GLU N N 100 117.542 117.542 119.276 -1.734 18003
9953 1 16 . 1 1 99 99 GLU HA H 100 3.849 3.849 3.965 -0.116 18003
9954 1 16 . 1 1 99 99 GLU C C 100 179.389 179.389 178.970 0.419 18003
9955 1 16 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.056 -1.033 18003
9956 1 16 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.370 -0.341 18003
9957 1 16 . 1 1 99 99 GLU H H 100 8.334 8.334 7.912 0.422 18003
9958 1 16 . 1 1 100 100 ALA N N 101 122.890 122.890 123.040 -0.150 18003
9959 1 16 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.080 -0.082 18003
9960 1 16 . 1 1 100 100 ALA C C 101 180.184 180.184 179.822 0.362 18003
9961 1 16 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.408 0.112 18003
9962 1 16 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.363 -0.744 18003
9963 1 16 . 1 1 100 100 ALA H H 101 8.550 8.550 8.405 0.145 18003
9964 1 16 . 1 1 101 101 ILE N N 102 119.952 119.952 118.889 1.063 18003
9965 1 16 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.765 -0.176 18003
9966 1 16 . 1 1 101 101 ILE C C 102 178.114 178.114 178.228 -0.114 18003
9967 1 16 . 1 1 101 101 ILE CA C 102 65.376 65.376 65.133 0.243 18003
9968 1 16 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.062 0.967 18003
9969 1 16 . 1 1 101 101 ILE H H 102 8.493 8.493 8.471 0.022 18003
9970 1 16 . 1 1 102 102 TYR N N 103 120.625 120.625 119.460 1.165 18003
9971 1 16 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.114 0.057 18003
9972 1 16 . 1 1 102 102 TYR C C 103 179.772 179.772 178.376 1.396 18003
9973 1 16 . 1 1 102 102 TYR CA C 103 60.724 60.724 61.702 -0.978 18003
9974 1 16 . 1 1 102 102 TYR CB C 103 37.500 37.500 37.346 0.154 18003
9975 1 16 . 1 1 102 102 TYR H H 103 8.520 8.520 8.363 0.157 18003
9976 1 16 . 1 1 103 103 HIS N N 104 117.456 117.456 119.369 -1.913 18003
9977 1 16 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.298 0.127 18003
9978 1 16 . 1 1 103 103 HIS C C 104 176.377 176.377 177.773 -1.396 18003
9979 1 16 . 1 1 103 103 HIS CA C 104 60.043 60.043 58.947 1.096 18003
9980 1 16 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.613 -0.584 18003
9981 1 16 . 1 1 103 103 HIS H H 104 8.622 8.622 8.548 0.074 18003
9982 1 16 . 1 1 104 104 SER N N 105 113.596 113.596 114.844 -1.248 18003
9983 1 16 . 1 1 104 104 SER C C 105 176.712 176.712 176.000 0.712 18003
9984 1 16 . 1 1 104 104 SER CA C 105 61.852 61.852 61.167 0.685 18003
9985 1 16 . 1 1 104 104 SER CB C 105 63.550 63.550 63.073 0.477 18003
9986 1 16 . 1 1 104 104 SER H H 105 7.900 7.900 8.134 -0.234 18003
9987 1 16 . 1 1 105 105 GLU N N 106 119.022 119.022 119.603 -0.581 18003
9988 1 16 . 1 1 105 105 GLU HA H 106 4.013 4.013 3.980 0.033 18003
9989 1 16 . 1 1 105 105 GLU C C 106 177.902 177.902 178.786 -0.884 18003
9990 1 16 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.108 -0.077 18003
9991 1 16 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.716 -0.437 18003
9992 1 16 . 1 1 105 105 GLU H H 106 8.181 8.181 7.731 0.450 18003
9993 1 16 . 1 1 106 106 HIS N N 107 116.482 116.482 118.607 -2.125 18003
9994 1 16 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.184 0.223 18003
9995 1 16 . 1 1 106 106 HIS C C 107 175.575 175.575 175.652 -0.077 18003
9996 1 16 . 1 1 106 106 HIS CA C 107 57.343 57.343 58.538 -1.196 18003
9997 1 16 . 1 1 106 106 HIS CB C 107 28.580 28.580 30.210 -1.630 18003
9998 1 16 . 1 1 106 106 HIS H H 107 7.770 7.770 8.308 -0.538 18003
9999 1 16 . 1 1 107 107 LEU N N 108 120.346 120.346 118.747 1.599 18003
10000 1 16 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.301 -0.247 18003
10001 1 16 . 1 1 107 107 LEU C C 108 177.404 177.404 174.592 2.812 18003
10002 1 16 . 1 1 107 107 LEU CA C 108 55.991 55.991 54.202 1.789 18003
10003 1 16 . 1 1 107 107 LEU CB C 108 42.030 42.030 43.431 -1.401 18003
10004 1 16 . 1 1 107 107 LEU H H 108 7.682 7.682 7.618 0.064 18003
10005 1 16 . 1 1 108 108 HIS N N 109 117.222 117.222 125.435 -8.213 18003
10006 1 16 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.565 -0.511 18003
10007 1 16 . 1 1 108 108 HIS C C 109 174.606 174.606 175.925 -1.319 18003
10008 1 16 . 1 1 108 108 HIS CA C 109 56.029 56.029 55.265 0.764 18003
10009 1 16 . 1 1 108 108 HIS CB C 109 28.517 28.517 29.425 -0.908 18003
10010 1 16 . 1 1 108 108 HIS H H 109 8.030 8.030 8.567 -0.537 18003
10011 1 16 . 1 1 109 109 LEU N N 110 121.114 121.114 119.119 1.995 18003
10012 1 16 . 1 1 109 109 LEU HA H 110 4.298 4.298 3.937 0.361 18003
10013 1 16 . 1 1 109 109 LEU C C 110 178.028 178.028 178.252 -0.224 18003
10014 1 16 . 1 1 109 109 LEU CA C 110 55.574 55.574 55.528 0.046 18003
10015 1 16 . 1 1 109 109 LEU CB C 110 42.076 42.076 40.157 1.919 18003
10016 1 16 . 1 1 109 109 LEU H H 110 7.973 7.973 8.151 -0.178 18003
10017 1 16 . 1 1 110 110 GLY N N 111 108.631 108.631 105.068 3.563 18003
10018 1 16 . 1 1 110 110 GLY C C 111 174.606 174.606 175.753 -1.147 18003
10019 1 16 . 1 1 110 110 GLY CA C 111 45.580 45.580 45.888 -0.308 18003
10020 1 16 . 1 1 110 110 GLY H H 111 8.255 8.255 8.598 -0.343 18003
10021 1 16 . 1 1 111 111 LEU N N 112 121.022 121.022 120.441 0.581 18003
10022 1 16 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.178 0.181 18003
10023 1 16 . 1 1 111 111 LEU C C 112 177.701 177.701 178.003 -0.302 18003
10024 1 16 . 1 1 111 111 LEU CA C 112 55.476 55.476 55.867 -0.391 18003
10025 1 16 . 1 1 111 111 LEU CB C 112 41.899 41.899 41.636 0.263 18003
10026 1 16 . 1 1 111 111 LEU H H 112 7.981 7.981 7.702 0.279 18003
10027 1 16 . 1 1 112 112 SER N N 113 115.471 115.471 114.682 0.789 18003
10028 1 16 . 1 1 112 112 SER HA H 113 4.432 4.432 4.237 0.195 18003
10029 1 16 . 1 1 112 112 SER C C 113 174.381 174.381 175.244 -0.863 18003
10030 1 16 . 1 1 112 112 SER CA C 113 58.527 58.527 59.284 -0.757 18003
10031 1 16 . 1 1 112 112 SER CB C 113 63.593 63.593 64.097 -0.504 18003
10032 1 16 . 1 1 112 112 SER H H 113 8.215 8.215 7.578 0.637 18003
10033 1 16 . 1 1 113 113 ASP N N 114 121.696 121.696 121.359 0.337 18003
10034 1 16 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.445 -0.018 18003
10035 1 16 . 1 1 113 113 ASP C C 114 175.958 175.958 176.409 -0.451 18003
10036 1 16 . 1 1 113 113 ASP CA C 114 54.213 54.213 54.864 -0.651 18003
10037 1 16 . 1 1 113 113 ASP CB C 114 41.030 41.030 40.251 0.779 18003
10038 1 16 . 1 1 113 113 ASP H H 114 8.203 8.203 8.583 -0.380 18003
10039 1 16 . 1 1 114 114 ARG N N 115 120.088 120.088 120.914 -0.826 18003
10040 1 16 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.033 0.239 18003
10041 1 16 . 1 1 114 114 ARG C C 115 175.792 175.792 176.618 -0.826 18003
10042 1 16 . 1 1 114 114 ARG CA C 115 55.735 55.735 56.779 -1.044 18003
10043 1 16 . 1 1 114 114 ARG CB C 115 30.586 30.586 30.069 0.517 18003
10044 1 16 . 1 1 114 114 ARG H H 115 8.016 8.016 8.519 -0.503 18003
10045 1 16 . 1 1 115 115 HIS N N 116 120.597 120.597 118.966 1.631 18003
10046 1 16 . 1 1 115 115 HIS CA C 116 53.697 53.697 54.296 -0.599 18003
10047 1 16 . 1 1 115 115 HIS CB C 116 29.299 29.299 28.788 0.510 18003
10048 1 16 . 1 1 115 115 HIS H H 116 8.385 8.385 8.405 -0.020 18003
10049 1 16 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.519 -0.037 18003
10050 1 16 . 1 1 116 116 PRO C C 117 177.090 177.090 176.981 0.109 18003
10051 1 16 . 1 1 116 116 PRO CA C 117 63.177 63.177 62.943 0.234 18003
10052 1 16 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.504 -0.684 18003
10053 1 16 . 1 1 117 117 SER N N 118 116.220 116.220 118.119 -1.899 18003
10054 1 16 . 1 1 117 117 SER HA H 118 4.465 4.465 4.078 0.387 18003
10055 1 16 . 1 1 117 117 SER C C 118 174.287 174.287 174.759 -0.472 18003
10056 1 16 . 1 1 117 117 SER CA C 118 58.110 58.110 59.851 -1.741 18003
10057 1 16 . 1 1 117 117 SER CB C 118 63.750 63.750 63.296 0.454 18003
10058 1 16 . 1 1 117 117 SER H H 118 8.487 8.487 8.406 0.081 18003
10059 1 16 . 1 1 118 118 ALA N N 119 126.082 126.082 122.610 3.472 18003
10060 1 16 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.108 0.331 18003
10061 1 16 . 1 1 118 118 ALA C C 119 176.879 176.879 177.211 -0.332 18003
10062 1 16 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.670 -0.221 18003
10063 1 16 . 1 1 118 118 ALA CB C 119 19.483 19.483 18.292 1.191 18003
10064 1 16 . 1 1 118 118 ALA H H 119 8.295 8.295 7.938 0.357 18003
10065 1 17 . 1 1 2 2 HIS C C 3 175.176 175.176 174.760 0.416 18003
10066 1 17 . 1 1 2 2 HIS CA C 3 55.900 55.900 55.775 0.125 18003
10067 1 17 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.047 -0.018 18003
10068 1 17 . 1 1 3 3 GLY N N 4 110.613 110.613 111.014 -0.401 18003
10069 1 17 . 1 1 3 3 GLY C C 4 174.068 174.068 174.466 -0.398 18003
10070 1 17 . 1 1 3 3 GLY CA C 4 45.141 45.141 44.755 0.386 18003
10071 1 17 . 1 1 3 3 GLY H H 4 8.500 8.500 8.341 0.159 18003
10072 1 17 . 1 1 4 4 VAL N N 5 119.318 119.318 117.668 1.650 18003
10073 1 17 . 1 1 4 4 VAL HA H 5 4.128 4.128 4.018 0.110 18003
10074 1 17 . 1 1 4 4 VAL C C 5 176.361 176.361 175.900 0.461 18003
10075 1 17 . 1 1 4 4 VAL CA C 5 61.987 61.987 62.870 -0.883 18003
10076 1 17 . 1 1 4 4 VAL CB C 5 32.635 32.635 32.101 0.534 18003
10077 1 17 . 1 1 4 4 VAL H H 5 8.094 8.094 8.244 -0.150 18003
10078 1 17 . 1 1 5 5 GLU N N 6 124.369 124.369 119.920 4.449 18003
10079 1 17 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.080 0.208 18003
10080 1 17 . 1 1 5 5 GLU C C 6 177.012 177.012 176.756 0.256 18003
10081 1 17 . 1 1 5 5 GLU CA C 6 56.699 56.699 56.798 -0.099 18003
10082 1 17 . 1 1 5 5 GLU CB C 6 30.029 30.029 30.113 -0.084 18003
10083 1 17 . 1 1 5 5 GLU H H 6 8.545 8.545 7.942 0.603 18003
10084 1 17 . 1 1 6 6 GLY N N 7 109.747 109.747 111.197 -1.450 18003
10085 1 17 . 1 1 6 6 GLY C C 7 174.117 174.117 173.507 0.610 18003
10086 1 17 . 1 1 6 6 GLY CA C 7 45.568 45.568 45.237 0.331 18003
10087 1 17 . 1 1 6 6 GLY H H 7 8.352 8.352 8.327 0.025 18003
10088 1 17 . 1 1 7 7 ARG N N 8 120.059 120.059 118.756 1.303 18003
10089 1 17 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.342 0.000 18003
10090 1 17 . 1 1 7 7 ARG C C 8 176.016 176.016 175.286 0.730 18003
10091 1 17 . 1 1 7 7 ARG CA C 8 55.833 55.833 55.755 0.078 18003
10092 1 17 . 1 1 7 7 ARG CB C 8 30.444 30.444 30.792 -0.348 18003
10093 1 17 . 1 1 7 7 ARG H H 8 8.084 8.084 7.966 0.118 18003
10094 1 17 . 1 1 8 8 ASN N N 9 119.379 119.379 120.666 -1.287 18003
10095 1 17 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.888 -0.556 18003
10096 1 17 . 1 1 8 8 ASN C C 9 174.667 174.667 174.610 0.057 18003
10097 1 17 . 1 1 8 8 ASN CA C 9 53.441 53.441 52.508 0.933 18003
10098 1 17 . 1 1 8 8 ASN CB C 9 38.480 38.480 40.394 -1.914 18003
10099 1 17 . 1 1 8 8 ASN H H 9 8.411 8.411 8.552 -0.141 18003
10100 1 17 . 1 1 9 9 ARG N N 10 121.700 121.700 123.019 -1.319 18003
10101 1 17 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.679 -0.030 18003
10102 1 17 . 1 1 9 9 ARG CA C 10 53.147 53.147 54.125 -0.978 18003
10103 1 17 . 1 1 9 9 ARG CB C 10 30.197 30.197 30.479 -0.281 18003
10104 1 17 . 1 1 9 9 ARG H H 10 8.138 8.138 8.502 -0.364 18003
10105 1 17 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.450 -0.007 18003
10106 1 17 . 1 1 10 10 PRO C C 11 176.815 176.815 176.005 0.810 18003
10107 1 17 . 1 1 10 10 PRO CA C 11 63.177 63.177 62.694 0.482 18003
10108 1 17 . 1 1 10 10 PRO CB C 11 31.820 31.820 30.821 0.999 18003
10109 1 17 . 1 1 11 11 SER N N 12 116.291 116.291 119.297 -3.006 18003
10110 1 17 . 1 1 11 11 SER HA H 12 4.418 4.418 4.472 -0.054 18003
10111 1 17 . 1 1 11 11 SER C C 12 173.702 173.702 174.718 -1.016 18003
10112 1 17 . 1 1 11 11 SER CA C 12 58.031 58.031 59.053 -1.022 18003
10113 1 17 . 1 1 11 11 SER CB C 12 64.032 64.032 63.639 0.393 18003
10114 1 17 . 1 1 11 11 SER H H 12 8.325 8.325 8.397 -0.072 18003
10115 1 17 . 1 1 12 12 ALA N N 13 126.862 126.862 127.100 -0.238 18003
10116 1 17 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.132 0.256 18003
10117 1 17 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.672 -1.214 18003
10118 1 17 . 1 1 12 12 ALA CB C 13 18.257 18.257 17.484 0.773 18003
10119 1 17 . 1 1 12 12 ALA H H 13 8.166 8.166 8.162 0.004 18003
10120 1 17 . 1 1 13 13 PRO C C 14 176.368 176.368 177.157 -0.789 18003
10121 1 17 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.169 0.768 18003
10122 1 17 . 1 1 13 13 PRO CB C 14 32.022 32.022 32.021 0.001 18003
10123 1 17 . 1 1 14 14 LEU N N 15 120.969 120.969 121.529 -0.560 18003
10124 1 17 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.284 -0.026 18003
10125 1 17 . 1 1 14 14 LEU C C 15 176.124 176.124 176.808 -0.684 18003
10126 1 17 . 1 1 14 14 LEU CA C 15 54.527 54.527 54.804 -0.278 18003
10127 1 17 . 1 1 14 14 LEU CB C 15 43.418 43.418 38.540 4.878 18003
10128 1 17 . 1 1 14 14 LEU H H 15 7.875 7.875 8.534 -0.658 18003
10129 1 17 . 1 1 15 15 ASP N N 16 121.780 121.780 122.779 -0.999 18003
10130 1 17 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.787 -0.194 18003
10131 1 17 . 1 1 15 15 ASP C C 16 176.208 176.208 178.057 -1.849 18003
10132 1 17 . 1 1 15 15 ASP CA C 16 52.468 52.468 56.591 -4.123 18003
10133 1 17 . 1 1 15 15 ASP CB C 16 41.629 41.629 41.505 0.124 18003
10134 1 17 . 1 1 15 15 ASP H H 16 7.850 7.850 8.642 -0.792 18003
10135 1 17 . 1 1 16 16 SER N N 17 114.435 114.435 116.096 -1.661 18003
10136 1 17 . 1 1 16 16 SER HA H 17 4.120 4.120 4.043 0.077 18003
10137 1 17 . 1 1 16 16 SER C C 17 177.207 177.207 176.346 0.861 18003
10138 1 17 . 1 1 16 16 SER CA C 17 62.322 62.322 61.442 0.880 18003
10139 1 17 . 1 1 16 16 SER H H 17 8.658 8.658 8.404 0.254 18003
10140 1 17 . 1 1 17 17 GLN N N 18 122.403 122.403 122.163 0.240 18003
10141 1 17 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.076 0.121 18003
10142 1 17 . 1 1 17 17 GLN C C 18 178.715 178.715 177.416 1.299 18003
10143 1 17 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.754 -0.641 18003
10144 1 17 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.629 -0.589 18003
10145 1 17 . 1 1 17 17 GLN H H 18 8.140 8.140 8.450 -0.310 18003
10146 1 17 . 1 1 18 18 ALA N N 19 124.743 124.743 122.068 2.675 18003
10147 1 17 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.045 0.131 18003
10148 1 17 . 1 1 18 18 ALA C C 19 180.616 180.616 179.352 1.264 18003
10149 1 17 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.834 -0.229 18003
10150 1 17 . 1 1 18 18 ALA CB C 19 19.028 19.028 18.116 0.912 18003
10151 1 17 . 1 1 18 18 ALA H H 19 8.455 8.455 7.822 0.633 18003
10152 1 17 . 1 1 19 19 ALA N N 20 119.089 119.089 120.931 -1.842 18003
10153 1 17 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.018 0.161 18003
10154 1 17 . 1 1 19 19 ALA C C 20 179.239 179.239 179.405 -0.166 18003
10155 1 17 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.898 0.373 18003
10156 1 17 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.326 -0.134 18003
10157 1 17 . 1 1 19 19 ALA H H 20 8.993 8.993 7.904 1.089 18003
10158 1 17 . 1 1 20 20 ALA N N 21 119.226 119.226 121.210 -1.984 18003
10159 1 17 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.927 0.133 18003
10160 1 17 . 1 1 20 20 ALA C C 21 180.230 180.230 179.631 0.599 18003
10161 1 17 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.112 0.031 18003
10162 1 17 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.051 -0.023 18003
10163 1 17 . 1 1 20 20 ALA H H 21 7.724 7.724 8.064 -0.340 18003
10164 1 17 . 1 1 21 21 GLN N N 22 119.310 119.310 119.021 0.289 18003
10165 1 17 . 1 1 21 21 GLN HA H 22 4.129 4.129 3.983 0.146 18003
10166 1 17 . 1 1 21 21 GLN C C 22 179.319 179.319 178.394 0.925 18003
10167 1 17 . 1 1 21 21 GLN CA C 22 58.762 58.762 59.055 -0.293 18003
10168 1 17 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.821 -0.792 18003
10169 1 17 . 1 1 21 21 GLN H H 22 7.638 7.638 8.398 -0.760 18003
10170 1 17 . 1 1 22 22 VAL N N 23 121.565 121.565 119.955 1.610 18003
10171 1 17 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.691 0.275 18003
10172 1 17 . 1 1 22 22 VAL C C 23 178.026 178.026 177.896 0.130 18003
10173 1 17 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.109 0.033 18003
10174 1 17 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.375 -0.409 18003
10175 1 17 . 1 1 22 22 VAL H H 23 8.442 8.442 8.010 0.432 18003
10176 1 17 . 1 1 23 23 ALA N N 24 121.400 121.400 121.969 -0.569 18003
10177 1 17 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.947 0.149 18003
10178 1 17 . 1 1 23 23 ALA C C 24 178.758 178.758 179.998 -1.240 18003
10179 1 17 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.445 0.470 18003
10180 1 17 . 1 1 23 23 ALA CB C 24 16.650 16.650 18.035 -1.385 18003
10181 1 17 . 1 1 23 23 ALA H H 24 8.495 8.495 8.575 -0.080 18003
10182 1 17 . 1 1 24 24 SER N N 25 112.138 112.138 115.101 -2.963 18003
10183 1 17 . 1 1 24 24 SER HA H 25 4.093 4.093 4.146 -0.053 18003
10184 1 17 . 1 1 24 24 SER C C 25 177.271 177.271 176.755 0.516 18003
10185 1 17 . 1 1 24 24 SER CA C 25 62.166 62.166 62.306 -0.140 18003
10186 1 17 . 1 1 24 24 SER CB C 25 63.032 63.032 63.068 -0.036 18003
10187 1 17 . 1 1 24 24 SER H H 25 7.936 7.936 8.379 -0.443 18003
10188 1 17 . 1 1 25 25 THR N N 26 119.701 119.701 119.696 0.005 18003
10189 1 17 . 1 1 25 25 THR HA H 26 4.380 4.380 4.052 0.328 18003
10190 1 17 . 1 1 25 25 THR C C 26 175.456 175.456 176.307 -0.851 18003
10191 1 17 . 1 1 25 25 THR CA C 26 67.129 67.129 67.024 0.105 18003
10192 1 17 . 1 1 25 25 THR CB C 26 68.800 68.800 68.604 0.196 18003
10193 1 17 . 1 1 25 25 THR H H 26 7.775 7.775 7.731 0.044 18003
10194 1 17 . 1 1 26 26 LEU N N 27 119.270 119.270 120.561 -1.291 18003
10195 1 17 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.009 -0.446 18003
10196 1 17 . 1 1 26 26 LEU C C 27 178.390 178.390 179.002 -0.612 18003
10197 1 17 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.451 0.218 18003
10198 1 17 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.293 0.737 18003
10199 1 17 . 1 1 26 26 LEU H H 27 8.006 8.006 8.360 -0.354 18003
10200 1 17 . 1 1 27 27 GLN N N 28 115.843 115.843 119.449 -3.606 18003
10201 1 17 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.067 -0.263 18003
10202 1 17 . 1 1 27 27 GLN C C 28 178.657 178.657 177.950 0.707 18003
10203 1 17 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.723 -0.011 18003
10204 1 17 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.972 -0.943 18003
10205 1 17 . 1 1 27 27 GLN H H 28 8.485 8.485 8.023 0.462 18003
10206 1 17 . 1 1 28 28 ALA N N 29 118.779 118.779 122.802 -4.023 18003
10207 1 17 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.085 -0.077 18003
10208 1 17 . 1 1 28 28 ALA C C 29 178.259 178.259 179.987 -1.728 18003
10209 1 17 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.904 -0.942 18003
10210 1 17 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.484 0.254 18003
10211 1 17 . 1 1 28 28 ALA H H 29 7.432 7.432 7.913 -0.481 18003
10212 1 17 . 1 1 29 29 LEU N N 30 113.442 113.442 117.234 -3.792 18003
10213 1 17 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.933 0.063 18003
10214 1 17 . 1 1 29 29 LEU C C 30 175.924 175.924 177.891 -1.967 18003
10215 1 17 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.753 -1.189 18003
10216 1 17 . 1 1 29 29 LEU CB C 30 42.266 42.266 40.653 1.613 18003
10217 1 17 . 1 1 29 29 LEU H H 30 7.311 7.311 8.005 -0.694 18003
10218 1 17 . 1 1 30 30 ALA N N 31 119.563 119.563 118.680 0.883 18003
10219 1 17 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.190 -0.018 18003
10220 1 17 . 1 1 30 30 ALA C C 31 176.316 176.316 176.562 -0.246 18003
10221 1 17 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.100 -1.444 18003
10222 1 17 . 1 1 30 30 ALA CB C 31 18.077 18.077 19.239 -1.162 18003
10223 1 17 . 1 1 30 30 ALA H H 31 7.223 7.223 7.120 0.103 18003
10224 1 17 . 1 1 31 31 THR N N 32 114.613 114.613 107.954 6.659 18003
10225 1 17 . 1 1 31 31 THR HA H 32 4.950 4.950 4.125 0.825 18003
10226 1 17 . 1 1 31 31 THR CA C 32 58.129 58.129 62.103 -3.974 18003
10227 1 17 . 1 1 31 31 THR CB C 32 69.098 69.098 67.621 1.477 18003
10228 1 17 . 1 1 31 31 THR H H 32 8.399 8.399 8.166 0.233 18003
10229 1 17 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.163 0.275 18003
10230 1 17 . 1 1 32 32 PRO C C 33 178.207 178.207 178.919 -0.712 18003
10231 1 17 . 1 1 32 32 PRO CA C 33 66.905 66.905 65.720 1.185 18003
10232 1 17 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.471 -0.207 18003
10233 1 17 . 1 1 33 33 SER N N 34 110.767 110.767 112.595 -1.828 18003
10234 1 17 . 1 1 33 33 SER HA H 34 4.026 4.026 4.236 -0.210 18003
10235 1 17 . 1 1 33 33 SER C C 34 176.742 176.742 176.852 -0.110 18003
10236 1 17 . 1 1 33 33 SER CA C 34 61.782 61.782 61.542 0.240 18003
10237 1 17 . 1 1 33 33 SER CB C 34 62.432 62.432 62.762 -0.330 18003
10238 1 17 . 1 1 33 33 SER H H 34 8.407 8.407 8.345 0.062 18003
10239 1 17 . 1 1 34 34 ARG N N 35 120.135 120.135 121.898 -1.763 18003
10240 1 17 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.088 -0.034 18003
10241 1 17 . 1 1 34 34 ARG C C 35 178.283 178.283 178.781 -0.498 18003
10242 1 17 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.663 1.869 18003
10243 1 17 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.566 -0.613 18003
10244 1 17 . 1 1 34 34 ARG H H 35 7.341 7.341 7.555 -0.214 18003
10245 1 17 . 1 1 35 35 LEU N N 36 118.454 118.454 121.996 -3.542 18003
10246 1 17 . 1 1 35 35 LEU HA H 36 4.054 4.054 4.047 0.007 18003
10247 1 17 . 1 1 35 35 LEU C C 36 180.643 180.643 178.988 1.655 18003
10248 1 17 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.423 -0.614 18003
10249 1 17 . 1 1 35 35 LEU CB C 36 41.778 41.778 41.188 0.590 18003
10250 1 17 . 1 1 35 35 LEU H H 36 8.226 8.226 8.206 0.020 18003
10251 1 17 . 1 1 36 36 MET N N 37 121.073 121.073 119.862 1.211 18003
10252 1 17 . 1 1 36 36 MET HA H 37 3.928 3.928 4.178 -0.250 18003
10253 1 17 . 1 1 36 36 MET C C 37 177.671 177.671 179.295 -1.624 18003
10254 1 17 . 1 1 36 36 MET CA C 37 60.613 60.613 57.668 2.945 18003
10255 1 17 . 1 1 36 36 MET CB C 37 33.128 33.128 31.658 1.470 18003
10256 1 17 . 1 1 36 36 MET H H 37 8.447 8.447 8.028 0.419 18003
10257 1 17 . 1 1 37 37 ILE N N 38 118.239 118.239 119.228 -0.989 18003
10258 1 17 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.758 -0.318 18003
10259 1 17 . 1 1 37 37 ILE C C 38 177.092 177.092 178.497 -1.405 18003
10260 1 17 . 1 1 37 37 ILE CA C 38 65.675 65.675 63.931 1.744 18003
10261 1 17 . 1 1 37 37 ILE CB C 38 38.255 38.255 36.492 1.763 18003
10262 1 17 . 1 1 37 37 ILE H H 38 7.763 7.763 8.044 -0.281 18003
10263 1 17 . 1 1 38 38 LEU N N 39 116.073 116.073 121.544 -5.471 18003
10264 1 17 . 1 1 38 38 LEU HA H 39 3.826 3.826 4.052 -0.226 18003
10265 1 17 . 1 1 38 38 LEU C C 39 178.941 178.941 178.451 0.490 18003
10266 1 17 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.573 -0.542 18003
10267 1 17 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.378 0.402 18003
10268 1 17 . 1 1 38 38 LEU H H 39 8.538 8.538 8.591 -0.053 18003
10269 1 17 . 1 1 39 39 THR N N 40 106.678 106.678 113.501 -6.823 18003
10270 1 17 . 1 1 39 39 THR HA H 40 3.932 3.932 3.940 -0.008 18003
10271 1 17 . 1 1 39 39 THR C C 40 177.747 177.747 176.996 0.751 18003
10272 1 17 . 1 1 39 39 THR CA C 40 65.536 65.536 65.975 -0.439 18003
10273 1 17 . 1 1 39 39 THR CB C 40 68.360 68.360 68.222 0.139 18003
10274 1 17 . 1 1 39 39 THR H H 40 8.086 8.086 8.546 -0.460 18003
10275 1 17 . 1 1 40 40 GLN N N 41 122.344 122.344 121.022 1.322 18003
10276 1 17 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.033 -0.027 18003
10277 1 17 . 1 1 40 40 GLN C C 41 178.348 178.348 178.399 -0.051 18003
10278 1 17 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.782 -0.857 18003
10279 1 17 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.616 -1.096 18003
10280 1 17 . 1 1 40 40 GLN H H 41 7.593 7.593 7.609 -0.016 18003
10281 1 17 . 1 1 41 41 LEU N N 42 116.302 116.302 119.008 -2.706 18003
10282 1 17 . 1 1 41 41 LEU C C 42 178.418 178.418 178.530 -0.112 18003
10283 1 17 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.302 -1.771 18003
10284 1 17 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.906 -0.557 18003
10285 1 17 . 1 1 41 41 LEU H H 42 7.570 7.570 7.715 -0.145 18003
10286 1 17 . 1 1 42 42 ARG N N 43 119.954 119.954 116.771 3.183 18003
10287 1 17 . 1 1 42 42 ARG HA H 43 3.915 3.915 4.035 -0.120 18003
10288 1 17 . 1 1 42 42 ARG C C 43 177.205 177.205 177.582 -0.377 18003
10289 1 17 . 1 1 42 42 ARG CA C 43 58.704 58.704 58.389 0.315 18003
10290 1 17 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.252 -0.809 18003
10291 1 17 . 1 1 42 42 ARG H H 43 7.612 7.612 8.298 -0.686 18003
10292 1 17 . 1 1 43 43 ASN N N 44 114.682 114.682 116.280 -1.598 18003
10293 1 17 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.685 0.075 18003
10294 1 17 . 1 1 43 43 ASN C C 44 174.507 174.507 175.393 -0.886 18003
10295 1 17 . 1 1 43 43 ASN CA C 44 53.953 53.953 54.669 -0.716 18003
10296 1 17 . 1 1 43 43 ASN CB C 44 39.030 39.030 40.040 -1.010 18003
10297 1 17 . 1 1 43 43 ASN H H 44 7.567 7.567 7.627 -0.060 18003
10298 1 17 . 1 1 44 44 GLY N N 45 109.113 109.113 106.459 2.654 18003
10299 1 17 . 1 1 44 44 GLY CA C 45 44.268 44.268 45.172 -0.904 18003
10300 1 17 . 1 1 44 44 GLY H H 45 7.361 7.361 7.571 -0.210 18003
10301 1 17 . 1 1 45 45 PRO C C 46 178.412 178.412 175.862 2.550 18003
10302 1 17 . 1 1 45 45 PRO CA C 46 62.580 62.580 64.259 -1.679 18003
10303 1 17 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.904 1.225 18003
10304 1 17 . 1 1 46 46 LEU N N 47 120.363 120.363 126.261 -5.898 18003
10305 1 17 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.732 0.299 18003
10306 1 17 . 1 1 46 46 LEU CA C 47 52.550 52.550 52.211 0.339 18003
10307 1 17 . 1 1 46 46 LEU CB C 47 48.210 48.210 43.152 5.058 18003
10308 1 17 . 1 1 46 46 LEU H H 47 8.252 8.252 8.481 -0.229 18003
10309 1 17 . 1 1 47 47 PRO C C 48 177.313 177.313 178.226 -0.913 18003
10310 1 17 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.879 -1.044 18003
10311 1 17 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.562 -0.179 18003
10312 1 17 . 1 1 48 48 VAL N N 49 119.384 119.384 123.745 -4.361 18003
10313 1 17 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.620 -0.013 18003
10314 1 17 . 1 1 48 48 VAL C C 49 176.710 176.710 178.135 -1.425 18003
10315 1 17 . 1 1 48 48 VAL CA C 49 66.188 66.188 66.986 -0.798 18003
10316 1 17 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.534 0.047 18003
10317 1 17 . 1 1 48 48 VAL H H 49 9.074 9.074 8.530 0.544 18003
10318 1 17 . 1 1 49 49 THR N N 50 111.293 111.293 109.919 1.374 18003
10319 1 17 . 1 1 49 49 THR HA H 50 4.181 4.181 4.112 0.069 18003
10320 1 17 . 1 1 49 49 THR C C 50 176.717 176.717 175.927 0.790 18003
10321 1 17 . 1 1 49 49 THR CA C 50 65.063 65.063 65.663 -0.600 18003
10322 1 17 . 1 1 49 49 THR CB C 50 68.032 68.032 68.430 -0.398 18003
10323 1 17 . 1 1 49 49 THR H H 50 7.848 7.848 8.131 -0.283 18003
10324 1 17 . 1 1 50 50 ASP N N 51 120.138 120.138 122.801 -2.663 18003
10325 1 17 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.479 -0.274 18003
10326 1 17 . 1 1 50 50 ASP C C 51 174.723 174.723 178.411 -3.688 18003
10327 1 17 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.179 -0.398 18003
10328 1 17 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.110 1.001 18003
10329 1 17 . 1 1 50 50 ASP H H 51 7.108 7.108 8.184 -1.076 18003
10330 1 17 . 1 1 51 51 LEU N N 52 121.089 121.089 121.949 -0.860 18003
10331 1 17 . 1 1 51 51 LEU HA H 52 3.985 3.985 4.010 -0.025 18003
10332 1 17 . 1 1 51 51 LEU C C 52 177.089 177.089 178.365 -1.276 18003
10333 1 17 . 1 1 51 51 LEU CA C 52 58.161 58.161 58.053 0.108 18003
10334 1 17 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.151 0.629 18003
10335 1 17 . 1 1 51 51 LEU H H 52 7.943 7.943 8.453 -0.510 18003
10336 1 17 . 1 1 52 52 ALA N N 53 119.237 119.237 121.522 -2.285 18003
10337 1 17 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.847 0.025 18003
10338 1 17 . 1 1 52 52 ALA C C 53 179.466 179.466 179.625 -0.159 18003
10339 1 17 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.389 0.274 18003
10340 1 17 . 1 1 52 52 ALA CB C 53 17.619 17.619 17.953 -0.334 18003
10341 1 17 . 1 1 52 52 ALA H H 53 8.480 8.480 8.070 0.410 18003
10342 1 17 . 1 1 53 53 GLU N N 54 115.655 115.655 119.074 -3.419 18003
10343 1 17 . 1 1 53 53 GLU HA H 54 4.054 4.054 3.992 0.062 18003
10344 1 17 . 1 1 53 53 GLU C C 54 179.073 179.073 178.160 0.913 18003
10345 1 17 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.833 -0.006 18003
10346 1 17 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.362 0.038 18003
10347 1 17 . 1 1 53 53 GLU H H 54 7.705 7.705 7.871 -0.166 18003
10348 1 17 . 1 1 54 54 ALA N N 55 120.276 120.276 121.025 -0.749 18003
10349 1 17 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.110 0.027 18003
10350 1 17 . 1 1 54 54 ALA C C 55 179.771 179.771 179.198 0.573 18003
10351 1 17 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.402 0.259 18003
10352 1 17 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.005 -0.770 18003
10353 1 17 . 1 1 54 54 ALA H H 55 7.928 7.928 7.677 0.251 18003
10354 1 17 . 1 1 55 55 ILE N N 56 107.195 107.195 117.089 -9.894 18003
10355 1 17 . 1 1 55 55 ILE C C 56 176.053 176.053 176.259 -0.206 18003
10356 1 17 . 1 1 55 55 ILE CA C 56 60.551 60.551 62.858 -2.307 18003
10357 1 17 . 1 1 55 55 ILE CB C 56 38.497 38.497 39.103 -0.606 18003
10358 1 17 . 1 1 55 55 ILE H H 56 7.507 7.507 8.263 -0.756 18003
10359 1 17 . 1 1 56 56 GLY N N 57 111.108 111.108 106.719 4.389 18003
10360 1 17 . 1 1 56 56 GLY C C 57 174.421 174.421 173.784 0.637 18003
10361 1 17 . 1 1 56 56 GLY CA C 57 46.960 46.960 44.659 2.301 18003
10362 1 17 . 1 1 56 56 GLY H H 57 7.757 7.757 7.779 -0.022 18003
10363 1 17 . 1 1 57 57 MET N N 58 118.089 118.089 118.820 -0.731 18003
10364 1 17 . 1 1 57 57 MET HA H 58 3.933 3.933 4.031 -0.098 18003
10365 1 17 . 1 1 57 57 MET C C 58 174.157 174.157 174.883 -0.726 18003
10366 1 17 . 1 1 57 57 MET CA C 58 54.091 54.091 56.769 -2.678 18003
10367 1 17 . 1 1 57 57 MET CB C 58 38.062 38.062 31.195 6.867 18003
10368 1 17 . 1 1 57 57 MET H H 58 7.659 7.659 8.175 -0.516 18003
10369 1 17 . 1 1 58 58 GLU N N 59 121.656 121.656 119.617 2.039 18003
10370 1 17 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.298 0.042 18003
10371 1 17 . 1 1 58 58 GLU C C 59 178.355 178.355 176.157 2.198 18003
10372 1 17 . 1 1 58 58 GLU CA C 59 56.643 56.643 56.647 -0.004 18003
10373 1 17 . 1 1 58 58 GLU CB C 59 30.029 30.029 30.059 -0.030 18003
10374 1 17 . 1 1 58 58 GLU H H 59 8.523 8.523 8.364 0.159 18003
10375 1 17 . 1 1 59 59 GLN N N 60 123.686 123.686 119.149 4.537 18003
10376 1 17 . 1 1 59 59 GLN HA H 60 4.214 4.214 4.278 -0.064 18003
10377 1 17 . 1 1 59 59 GLN C C 60 177.961 177.961 177.614 0.347 18003
10378 1 17 . 1 1 59 59 GLN CA C 60 60.616 60.616 57.884 2.732 18003
10379 1 17 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.307 0.708 18003
10380 1 17 . 1 1 59 59 GLN H H 60 9.009 9.009 8.600 0.409 18003
10381 1 17 . 1 1 60 60 SER N N 61 115.101 115.101 116.770 -1.669 18003
10382 1 17 . 1 1 60 60 SER C C 61 176.801 176.801 176.218 0.583 18003
10383 1 17 . 1 1 60 60 SER CA C 61 61.213 61.213 60.430 0.783 18003
10384 1 17 . 1 1 60 60 SER H H 61 8.964 8.964 8.459 0.505 18003
10385 1 17 . 1 1 61 61 ALA N N 62 126.069 126.069 122.761 3.308 18003
10386 1 17 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.035 0.316 18003
10387 1 17 . 1 1 61 61 ALA C C 62 180.635 180.635 179.274 1.361 18003
10388 1 17 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.694 -0.437 18003
10389 1 17 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.249 0.374 18003
10390 1 17 . 1 1 61 61 ALA H H 62 7.103 7.103 8.102 -0.999 18003
10391 1 17 . 1 1 62 62 VAL N N 63 119.252 119.252 119.654 -0.402 18003
10392 1 17 . 1 1 62 62 VAL C C 63 177.842 177.842 177.893 -0.051 18003
10393 1 17 . 1 1 62 62 VAL CA C 63 66.798 66.798 65.797 1.001 18003
10394 1 17 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.607 -0.343 18003
10395 1 17 . 1 1 62 62 VAL H H 63 7.971 7.971 7.370 0.601 18003
10396 1 17 . 1 1 63 63 SER N N 64 115.494 115.494 114.888 0.606 18003
10397 1 17 . 1 1 63 63 SER HA H 64 4.034 4.034 3.964 0.070 18003
10398 1 17 . 1 1 63 63 SER C C 64 176.835 176.835 176.671 0.164 18003
10399 1 17 . 1 1 63 63 SER CA C 64 62.400 62.400 61.959 0.441 18003
10400 1 17 . 1 1 63 63 SER CB C 64 62.752 62.752 63.191 -0.439 18003
10401 1 17 . 1 1 63 63 SER H H 64 8.743 8.743 8.525 0.218 18003
10402 1 17 . 1 1 64 64 HIS N N 65 120.010 120.010 120.265 -0.255 18003
10403 1 17 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.239 0.121 18003
10404 1 17 . 1 1 64 64 HIS C C 65 177.731 177.731 177.964 -0.233 18003
10405 1 17 . 1 1 64 64 HIS CA C 65 59.998 59.998 58.883 1.115 18003
10406 1 17 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.185 0.749 18003
10407 1 17 . 1 1 64 64 HIS H H 65 7.804 7.804 8.408 -0.604 18003
10408 1 17 . 1 1 65 65 GLN N N 66 115.590 115.590 119.320 -3.730 18003
10409 1 17 . 1 1 65 65 GLN HA H 66 4.035 4.035 4.023 0.012 18003
10410 1 17 . 1 1 65 65 GLN C C 66 179.055 179.055 178.672 0.383 18003
10411 1 17 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.983 -1.453 18003
10412 1 17 . 1 1 65 65 GLN H H 66 7.751 7.751 7.995 -0.244 18003
10413 1 17 . 1 1 66 66 LEU N N 67 118.746 118.746 120.011 -1.265 18003
10414 1 17 . 1 1 66 66 LEU HA H 67 3.947 3.947 4.016 -0.069 18003
10415 1 17 . 1 1 66 66 LEU C C 67 178.334 178.334 179.204 -0.870 18003
10416 1 17 . 1 1 66 66 LEU CA C 67 57.846 57.846 57.955 -0.109 18003
10417 1 17 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.104 -0.001 18003
10418 1 17 . 1 1 66 66 LEU H H 67 8.648 8.648 8.102 0.546 18003
10419 1 17 . 1 1 67 67 ARG N N 68 119.610 119.610 118.971 0.639 18003
10420 1 17 . 1 1 67 67 ARG HA H 68 3.943 3.943 4.008 -0.065 18003
10421 1 17 . 1 1 67 67 ARG C C 68 178.807 178.807 178.944 -0.137 18003
10422 1 17 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.629 -0.252 18003
10423 1 17 . 1 1 67 67 ARG CB C 68 29.475 29.475 30.076 -0.602 18003
10424 1 17 . 1 1 67 67 ARG H H 68 7.607 7.607 8.219 -0.612 18003
10425 1 17 . 1 1 68 68 VAL N N 69 119.719 119.719 120.147 -0.428 18003
10426 1 17 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.750 -0.117 18003
10427 1 17 . 1 1 68 68 VAL C C 69 178.690 178.690 178.508 0.182 18003
10428 1 17 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.216 0.238 18003
10429 1 17 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.378 0.401 18003
10430 1 17 . 1 1 68 68 VAL H H 69 7.259 7.259 8.072 -0.813 18003
10431 1 17 . 1 1 69 69 LEU N N 70 117.532 117.532 119.600 -2.068 18003
10432 1 17 . 1 1 69 69 LEU HA H 70 3.948 3.948 4.051 -0.103 18003
10433 1 17 . 1 1 69 69 LEU C C 70 179.144 179.144 178.910 0.234 18003
10434 1 17 . 1 1 69 69 LEU CA C 70 57.750 57.750 57.730 0.020 18003
10435 1 17 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.075 0.785 18003
10436 1 17 . 1 1 69 69 LEU H H 70 8.375 8.375 8.068 0.307 18003
10437 1 17 . 1 1 70 70 ARG N N 71 122.498 122.498 120.498 2.000 18003
10438 1 17 . 1 1 70 70 ARG HA H 71 3.931 3.931 4.024 -0.093 18003
10439 1 17 . 1 1 70 70 ARG C C 71 180.499 180.499 178.701 1.798 18003
10440 1 17 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.097 -0.320 18003
10441 1 17 . 1 1 70 70 ARG CB C 71 30.155 30.155 29.845 0.310 18003
10442 1 17 . 1 1 70 70 ARG H H 71 8.822 8.822 8.462 0.360 18003
10443 1 17 . 1 1 71 71 ASN N N 72 121.816 121.816 116.910 4.906 18003
10444 1 17 . 1 1 71 71 ASN C C 72 177.170 177.170 177.799 -0.629 18003
10445 1 17 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.722 0.055 18003
10446 1 17 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.419 -0.685 18003
10447 1 17 . 1 1 71 71 ASN H H 72 8.144 8.144 7.889 0.255 18003
10448 1 17 . 1 1 72 72 LEU N N 73 117.044 117.044 117.878 -0.834 18003
10449 1 17 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.123 0.222 18003
10450 1 17 . 1 1 72 72 LEU C C 73 176.984 176.984 178.232 -1.248 18003
10451 1 17 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.383 -1.258 18003
10452 1 17 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.302 0.967 18003
10453 1 17 . 1 1 72 72 LEU H H 73 7.804 7.804 7.394 0.410 18003
10454 1 17 . 1 1 73 73 GLY N N 74 106.621 106.621 105.052 1.569 18003
10455 1 17 . 1 1 73 73 GLY C C 74 173.266 173.266 174.374 -1.108 18003
10456 1 17 . 1 1 73 73 GLY CA C 74 46.022 46.022 45.180 0.842 18003
10457 1 17 . 1 1 73 73 GLY H H 74 7.851 7.851 8.317 -0.466 18003
10458 1 17 . 1 1 74 74 LEU N N 75 114.582 114.582 118.853 -4.271 18003
10459 1 17 . 1 1 74 74 LEU C C 75 177.562 177.562 176.417 1.145 18003
10460 1 17 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.188 0.843 18003
10461 1 17 . 1 1 74 74 LEU CB C 75 44.444 44.444 43.054 1.390 18003
10462 1 17 . 1 1 74 74 LEU H H 75 7.808 7.808 7.841 -0.033 18003
10463 1 17 . 1 1 75 75 VAL N N 76 110.980 110.980 112.767 -1.787 18003
10464 1 17 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.718 -0.191 18003
10465 1 17 . 1 1 75 75 VAL C C 76 173.922 173.922 174.180 -0.258 18003
10466 1 17 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.209 -2.266 18003
10467 1 17 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.426 0.603 18003
10468 1 17 . 1 1 75 75 VAL H H 76 7.079 7.079 7.387 -0.308 18003
10469 1 17 . 1 1 76 76 VAL N N 77 118.619 118.619 120.559 -1.940 18003
10470 1 17 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.566 0.736 18003
10471 1 17 . 1 1 76 76 VAL C C 77 174.041 174.041 174.286 -0.245 18003
10472 1 17 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.765 -0.766 18003
10473 1 17 . 1 1 76 76 VAL H H 77 9.024 9.024 9.302 -0.278 18003
10474 1 17 . 1 1 77 77 GLY N N 78 109.451 109.451 110.248 -0.797 18003
10475 1 17 . 1 1 77 77 GLY C C 78 172.225 172.225 172.362 -0.137 18003
10476 1 17 . 1 1 77 77 GLY CA C 78 44.462 44.462 44.442 0.020 18003
10477 1 17 . 1 1 77 77 GLY H H 78 8.265 8.265 8.430 -0.165 18003
10478 1 17 . 1 1 78 78 ASP N N 79 122.826 122.826 124.822 -1.996 18003
10479 1 17 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.849 -0.103 18003
10480 1 17 . 1 1 78 78 ASP C C 79 174.817 174.817 175.361 -0.544 18003
10481 1 17 . 1 1 78 78 ASP CA C 79 53.111 53.111 52.071 1.040 18003
10482 1 17 . 1 1 78 78 ASP CB C 79 43.655 43.655 42.601 1.054 18003
10483 1 17 . 1 1 78 78 ASP H H 79 8.479 8.479 8.503 -0.024 18003
10484 1 17 . 1 1 79 79 ARG N N 80 122.613 122.613 124.524 -1.911 18003
10485 1 17 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.241 0.171 18003
10486 1 17 . 1 1 79 79 ARG C C 80 175.546 175.546 174.506 1.040 18003
10487 1 17 . 1 1 79 79 ARG CA C 80 56.318 56.318 54.790 1.528 18003
10488 1 17 . 1 1 79 79 ARG CB C 80 30.376 30.376 29.971 0.405 18003
10489 1 17 . 1 1 79 79 ARG H H 80 8.580 8.580 8.349 0.231 18003
10490 1 17 . 1 1 80 80 ALA N N 81 129.263 129.263 127.613 1.650 18003
10491 1 17 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.573 -0.121 18003
10492 1 17 . 1 1 80 80 ALA C C 81 177.126 177.126 177.596 -0.470 18003
10493 1 17 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.321 0.299 18003
10494 1 17 . 1 1 80 80 ALA CB C 81 19.260 19.260 20.919 -1.659 18003
10495 1 17 . 1 1 80 80 ALA H H 81 8.396 8.396 7.966 0.430 18003
10496 1 17 . 1 1 81 81 GLY N N 82 112.739 112.739 108.142 4.597 18003
10497 1 17 . 1 1 81 81 GLY C C 82 174.856 174.856 175.745 -0.889 18003
10498 1 17 . 1 1 81 81 GLY CA C 82 46.392 46.392 46.501 -0.109 18003
10499 1 17 . 1 1 81 81 GLY H H 82 8.641 8.641 8.605 0.036 18003
10500 1 17 . 1 1 82 82 ARG N N 83 124.780 124.780 118.889 5.891 18003
10501 1 17 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.344 -0.021 18003
10502 1 17 . 1 1 82 82 ARG C C 83 176.339 176.339 176.070 0.269 18003
10503 1 17 . 1 1 82 82 ARG CA C 83 56.690 56.690 57.157 -0.467 18003
10504 1 17 . 1 1 82 82 ARG CB C 83 30.221 30.221 31.110 -0.889 18003
10505 1 17 . 1 1 82 82 ARG H H 83 8.728 8.728 8.198 0.530 18003
10506 1 17 . 1 1 83 83 SER N N 84 114.678 114.678 109.475 5.203 18003
10507 1 17 . 1 1 83 83 SER C C 84 172.869 172.869 171.981 0.888 18003
10508 1 17 . 1 1 83 83 SER CA C 84 56.834 56.834 57.686 -0.852 18003
10509 1 17 . 1 1 83 83 SER CB C 84 65.191 65.191 65.275 -0.084 18003
10510 1 17 . 1 1 83 83 SER H H 84 7.821 7.821 7.511 0.310 18003
10511 1 17 . 1 1 84 84 ILE N N 85 122.996 122.996 122.691 0.305 18003
10512 1 17 . 1 1 84 84 ILE C C 85 175.521 175.521 174.202 1.319 18003
10513 1 17 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.330 0.905 18003
10514 1 17 . 1 1 84 84 ILE CB C 85 38.136 38.136 39.220 -1.084 18003
10515 1 17 . 1 1 84 84 ILE H H 85 8.232 8.232 8.345 -0.113 18003
10516 1 17 . 1 1 85 85 VAL N N 86 121.845 121.845 129.687 -7.842 18003
10517 1 17 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.249 0.061 18003
10518 1 17 . 1 1 85 85 VAL C C 86 174.818 174.818 174.369 0.449 18003
10519 1 17 . 1 1 85 85 VAL CA C 86 59.738 59.738 61.429 -1.691 18003
10520 1 17 . 1 1 85 85 VAL CB C 86 34.221 34.221 32.907 1.314 18003
10521 1 17 . 1 1 85 85 VAL H H 86 8.495 8.495 8.304 0.191 18003
10522 1 17 . 1 1 86 86 TYR N N 87 125.020 125.020 128.636 -3.616 18003
10523 1 17 . 1 1 86 86 TYR HA H 87 4.319 4.319 4.938 -0.619 18003
10524 1 17 . 1 1 86 86 TYR C C 87 173.808 173.808 175.347 -1.539 18003
10525 1 17 . 1 1 86 86 TYR CA C 87 57.465 57.465 58.187 -0.722 18003
10526 1 17 . 1 1 86 86 TYR CB C 87 41.480 41.480 39.236 2.244 18003
10527 1 17 . 1 1 86 86 TYR H H 87 8.488 8.488 8.858 -0.370 18003
10528 1 17 . 1 1 87 87 SER N N 88 110.681 110.681 114.709 -4.028 18003
10529 1 17 . 1 1 87 87 SER HA H 88 5.414 5.414 4.861 0.553 18003
10530 1 17 . 1 1 87 87 SER C C 88 174.693 174.693 173.044 1.649 18003
10531 1 17 . 1 1 87 87 SER CA C 88 56.113 56.113 56.516 -0.403 18003
10532 1 17 . 1 1 87 87 SER CB C 88 66.309 66.309 65.956 0.353 18003
10533 1 17 . 1 1 87 87 SER H H 88 8.718 8.718 9.160 -0.442 18003
10534 1 17 . 1 1 88 88 LEU N N 89 119.612 119.612 121.770 -2.158 18003
10535 1 17 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.292 0.635 18003
10536 1 17 . 1 1 88 88 LEU C C 89 179.031 179.031 177.816 1.215 18003
10537 1 17 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.162 0.163 18003
10538 1 17 . 1 1 88 88 LEU CB C 89 41.720 41.720 41.014 0.706 18003
10539 1 17 . 1 1 88 88 LEU H H 89 9.034 9.034 8.540 0.494 18003
10540 1 17 . 1 1 89 89 TYR N N 90 120.540 120.540 124.068 -3.528 18003
10541 1 17 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.215 0.407 18003
10542 1 17 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.734 0.978 18003
10543 1 17 . 1 1 89 89 TYR H H 90 8.075 8.075 8.414 -0.339 18003
10544 1 17 . 1 1 92 92 HIS C C 93 177.850 177.850 177.621 0.229 18003
10545 1 17 . 1 1 93 93 VAL N N 94 120.211 120.211 119.848 0.363 18003
10546 1 17 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.746 -0.245 18003
10547 1 17 . 1 1 93 93 VAL C C 94 176.785 176.785 176.928 -0.143 18003
10548 1 17 . 1 1 93 93 VAL CA C 94 66.666 66.666 65.578 1.088 18003
10549 1 17 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.528 0.109 18003
10550 1 17 . 1 1 93 93 VAL H H 94 8.164 8.164 8.190 -0.026 18003
10551 1 17 . 1 1 94 94 ALA N N 95 119.221 119.221 120.653 -1.432 18003
10552 1 17 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.921 -0.131 18003
10553 1 17 . 1 1 94 94 ALA C C 95 177.979 177.979 179.305 -1.326 18003
10554 1 17 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.180 0.299 18003
10555 1 17 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.082 0.028 18003
10556 1 17 . 1 1 94 94 ALA H H 95 6.942 6.942 7.967 -1.025 18003
10557 1 17 . 1 1 95 95 GLN N N 96 115.416 115.416 119.409 -3.993 18003
10558 1 17 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.229 -0.194 18003
10559 1 17 . 1 1 95 95 GLN C C 96 177.993 177.993 178.308 -0.315 18003
10560 1 17 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.354 0.488 18003
10561 1 17 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.453 -0.424 18003
10562 1 17 . 1 1 95 95 GLN H H 96 7.795 7.795 7.743 0.052 18003
10563 1 17 . 1 1 96 96 LEU N N 97 120.758 120.758 121.464 -0.706 18003
10564 1 17 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.082 -0.233 18003
10565 1 17 . 1 1 96 96 LEU C C 97 177.974 177.974 178.652 -0.678 18003
10566 1 17 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.224 1.058 18003
10567 1 17 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.819 -0.773 18003
10568 1 17 . 1 1 96 96 LEU H H 97 8.197 8.197 7.893 0.304 18003
10569 1 17 . 1 1 97 97 LEU N N 98 117.567 117.567 119.373 -1.806 18003
10570 1 17 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.968 -0.138 18003
10571 1 17 . 1 1 97 97 LEU C C 98 178.219 178.219 179.331 -1.112 18003
10572 1 17 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.369 -0.639 18003
10573 1 17 . 1 1 97 97 LEU CB C 98 41.862 41.862 40.291 1.571 18003
10574 1 17 . 1 1 97 97 LEU H H 98 7.660 7.660 8.064 -0.404 18003
10575 1 17 . 1 1 98 98 ASP N N 99 118.607 118.607 120.081 -1.474 18003
10576 1 17 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.403 -0.294 18003
10577 1 17 . 1 1 98 98 ASP C C 99 179.382 179.382 179.346 0.036 18003
10578 1 17 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.673 0.362 18003
10579 1 17 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.166 -0.327 18003
10580 1 17 . 1 1 98 98 ASP H H 99 8.295 8.295 8.236 0.059 18003
10581 1 17 . 1 1 99 99 GLU N N 100 117.542 117.542 119.699 -2.157 18003
10582 1 17 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.215 -0.366 18003
10583 1 17 . 1 1 99 99 GLU C C 100 179.389 179.389 179.022 0.367 18003
10584 1 17 . 1 1 99 99 GLU CA C 100 58.023 58.023 58.989 -0.966 18003
10585 1 17 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.535 -0.506 18003
10586 1 17 . 1 1 99 99 GLU H H 100 8.334 8.334 7.903 0.431 18003
10587 1 17 . 1 1 100 100 ALA N N 101 122.890 122.890 123.076 -0.186 18003
10588 1 17 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.141 -0.143 18003
10589 1 17 . 1 1 100 100 ALA C C 101 180.184 180.184 179.560 0.624 18003
10590 1 17 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.251 0.269 18003
10591 1 17 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.510 -0.891 18003
10592 1 17 . 1 1 100 100 ALA H H 101 8.550 8.550 8.402 0.148 18003
10593 1 17 . 1 1 101 101 ILE N N 102 119.952 119.952 119.735 0.217 18003
10594 1 17 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.739 -0.150 18003
10595 1 17 . 1 1 101 101 ILE C C 102 178.114 178.114 176.909 1.205 18003
10596 1 17 . 1 1 101 101 ILE CA C 102 65.376 65.376 64.077 1.299 18003
10597 1 17 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.923 0.106 18003
10598 1 17 . 1 1 101 101 ILE H H 102 8.493 8.493 8.570 -0.077 18003
10599 1 17 . 1 1 102 102 TYR N N 103 120.625 120.625 120.706 -0.081 18003
10600 1 17 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.130 0.041 18003
10601 1 17 . 1 1 102 102 TYR C C 103 179.772 179.772 177.571 2.201 18003
10602 1 17 . 1 1 102 102 TYR CA C 103 60.724 60.724 61.616 -0.892 18003
10603 1 17 . 1 1 102 102 TYR CB C 103 37.500 37.500 38.171 -0.671 18003
10604 1 17 . 1 1 102 102 TYR H H 103 8.520 8.520 8.029 0.491 18003
10605 1 17 . 1 1 103 103 HIS N N 104 117.456 117.456 119.393 -1.937 18003
10606 1 17 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.333 0.092 18003
10607 1 17 . 1 1 103 103 HIS C C 104 176.377 176.377 177.039 -0.662 18003
10608 1 17 . 1 1 103 103 HIS CA C 104 60.043 60.043 58.667 1.376 18003
10609 1 17 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.551 -0.522 18003
10610 1 17 . 1 1 103 103 HIS H H 104 8.622 8.622 8.383 0.239 18003
10611 1 17 . 1 1 104 104 SER N N 105 113.596 113.596 114.024 -0.428 18003
10612 1 17 . 1 1 104 104 SER C C 105 176.712 176.712 176.608 0.104 18003
10613 1 17 . 1 1 104 104 SER CA C 105 61.852 61.852 60.833 1.019 18003
10614 1 17 . 1 1 104 104 SER CB C 105 63.550 63.550 63.367 0.183 18003
10615 1 17 . 1 1 104 104 SER H H 105 7.900 7.900 7.991 -0.091 18003
10616 1 17 . 1 1 105 105 GLU N N 106 119.022 119.022 121.722 -2.700 18003
10617 1 17 . 1 1 105 105 GLU HA H 106 4.013 4.013 4.083 -0.070 18003
10618 1 17 . 1 1 105 105 GLU C C 106 177.902 177.902 177.885 0.017 18003
10619 1 17 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.751 -0.720 18003
10620 1 17 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.723 -0.444 18003
10621 1 17 . 1 1 105 105 GLU H H 106 8.181 8.181 8.306 -0.125 18003
10622 1 17 . 1 1 106 106 HIS N N 107 116.482 116.482 116.636 -0.154 18003
10623 1 17 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.442 -0.035 18003
10624 1 17 . 1 1 106 106 HIS C C 107 175.575 175.575 174.688 0.887 18003
10625 1 17 . 1 1 106 106 HIS CA C 107 57.343 57.343 56.294 1.048 18003
10626 1 17 . 1 1 106 106 HIS CB C 107 28.580 28.580 29.884 -1.304 18003
10627 1 17 . 1 1 106 106 HIS H H 107 7.770 7.770 7.882 -0.112 18003
10628 1 17 . 1 1 107 107 LEU N N 108 120.346 120.346 121.986 -1.640 18003
10629 1 17 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.152 -0.098 18003
10630 1 17 . 1 1 107 107 LEU C C 108 177.404 177.404 175.124 2.280 18003
10631 1 17 . 1 1 107 107 LEU CA C 108 55.991 55.991 54.541 1.450 18003
10632 1 17 . 1 1 107 107 LEU CB C 108 42.030 42.030 40.649 1.381 18003
10633 1 17 . 1 1 107 107 LEU H H 108 7.682 7.682 6.933 0.749 18003
10634 1 17 . 1 1 108 108 HIS N N 109 117.222 117.222 122.840 -5.618 18003
10635 1 17 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.708 -0.654 18003
10636 1 17 . 1 1 108 108 HIS C C 109 174.606 174.606 175.209 -0.603 18003
10637 1 17 . 1 1 108 108 HIS CA C 109 56.029 56.029 54.971 1.058 18003
10638 1 17 . 1 1 108 108 HIS CB C 109 28.517 28.517 32.362 -3.845 18003
10639 1 17 . 1 1 108 108 HIS H H 109 8.030 8.030 7.667 0.363 18003
10640 1 17 . 1 1 109 109 LEU N N 110 121.114 121.114 122.599 -1.485 18003
10641 1 17 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.207 0.091 18003
10642 1 17 . 1 1 109 109 LEU C C 110 178.028 178.028 177.788 0.240 18003
10643 1 17 . 1 1 109 109 LEU CA C 110 55.574 55.574 55.591 -0.017 18003
10644 1 17 . 1 1 109 109 LEU CB C 110 42.076 42.076 42.572 -0.496 18003
10645 1 17 . 1 1 109 109 LEU H H 110 7.973 7.973 8.713 -0.740 18003
10646 1 17 . 1 1 110 110 GLY N N 111 108.631 108.631 107.273 1.358 18003
10647 1 17 . 1 1 110 110 GLY C C 111 174.606 174.606 174.622 -0.016 18003
10648 1 17 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.470 1.110 18003
10649 1 17 . 1 1 110 110 GLY H H 111 8.255 8.255 8.151 0.104 18003
10650 1 17 . 1 1 111 111 LEU N N 112 121.022 121.022 122.244 -1.222 18003
10651 1 17 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.510 -0.151 18003
10652 1 17 . 1 1 111 111 LEU C C 112 177.701 177.701 178.190 -0.489 18003
10653 1 17 . 1 1 111 111 LEU CA C 112 55.476 55.476 54.401 1.075 18003
10654 1 17 . 1 1 111 111 LEU CB C 112 41.899 41.899 42.985 -1.086 18003
10655 1 17 . 1 1 111 111 LEU H H 112 7.981 7.981 8.115 -0.134 18003
10656 1 17 . 1 1 112 112 SER N N 113 115.471 115.471 116.834 -1.363 18003
10657 1 17 . 1 1 112 112 SER HA H 113 4.432 4.432 4.432 0.000 18003
10658 1 17 . 1 1 112 112 SER C C 113 174.381 174.381 173.714 0.667 18003
10659 1 17 . 1 1 112 112 SER CA C 113 58.527 58.527 58.231 0.296 18003
10660 1 17 . 1 1 112 112 SER CB C 113 63.593 63.593 64.062 -0.469 18003
10661 1 17 . 1 1 112 112 SER H H 113 8.215 8.215 8.265 -0.050 18003
10662 1 17 . 1 1 113 113 ASP N N 114 121.696 121.696 122.805 -1.109 18003
10663 1 17 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.739 -0.312 18003
10664 1 17 . 1 1 113 113 ASP C C 114 175.958 175.958 175.533 0.425 18003
10665 1 17 . 1 1 113 113 ASP CA C 114 54.213 54.213 53.794 0.420 18003
10666 1 17 . 1 1 113 113 ASP CB C 114 41.030 41.030 40.833 0.197 18003
10667 1 17 . 1 1 113 113 ASP H H 114 8.203 8.203 8.476 -0.273 18003
10668 1 17 . 1 1 114 114 ARG N N 115 120.088 120.088 122.175 -2.087 18003
10669 1 17 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.589 -0.317 18003
10670 1 17 . 1 1 114 114 ARG C C 115 175.792 175.792 176.099 -0.307 18003
10671 1 17 . 1 1 114 114 ARG CA C 115 55.735 55.735 56.095 -0.360 18003
10672 1 17 . 1 1 114 114 ARG CB C 115 30.586 30.586 31.413 -0.827 18003
10673 1 17 . 1 1 114 114 ARG H H 115 8.016 8.016 8.618 -0.602 18003
10674 1 17 . 1 1 115 115 HIS N N 116 120.597 120.597 122.885 -2.288 18003
10675 1 17 . 1 1 115 115 HIS CA C 116 53.697 53.697 54.070 -0.373 18003
10676 1 17 . 1 1 115 115 HIS CB C 116 29.299 29.299 29.407 -0.108 18003
10677 1 17 . 1 1 115 115 HIS H H 116 8.385 8.385 8.495 -0.110 18003
10678 1 17 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.293 0.189 18003
10679 1 17 . 1 1 116 116 PRO C C 117 177.090 177.090 176.819 0.271 18003
10680 1 17 . 1 1 116 116 PRO CA C 117 63.177 63.177 63.169 0.008 18003
10681 1 17 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.164 -0.344 18003
10682 1 17 . 1 1 117 117 SER N N 118 116.220 116.220 113.211 3.009 18003
10683 1 17 . 1 1 117 117 SER HA H 118 4.465 4.465 4.190 0.275 18003
10684 1 17 . 1 1 117 117 SER C C 118 174.287 174.287 175.146 -0.859 18003
10685 1 17 . 1 1 117 117 SER CA C 118 58.110 58.110 57.377 0.733 18003
10686 1 17 . 1 1 117 117 SER CB C 118 63.750 63.750 63.059 0.691 18003
10687 1 17 . 1 1 117 117 SER H H 118 8.487 8.487 8.408 0.079 18003
10688 1 17 . 1 1 118 118 ALA N N 119 126.082 126.082 125.478 0.604 18003
10689 1 17 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.240 0.199 18003
10690 1 17 . 1 1 118 118 ALA C C 119 176.879 176.879 178.236 -1.357 18003
10691 1 17 . 1 1 118 118 ALA CA C 119 52.449 52.449 53.124 -0.675 18003
10692 1 17 . 1 1 118 118 ALA CB C 119 19.483 19.483 19.055 0.428 18003
10693 1 17 . 1 1 118 118 ALA H H 119 8.295 8.295 8.440 -0.145 18003
10694 1 18 . 1 1 2 2 HIS C C 3 175.176 175.176 175.839 -0.663 18003
10695 1 18 . 1 1 2 2 HIS CA C 3 55.900 55.900 56.390 -0.490 18003
10696 1 18 . 1 1 2 2 HIS CB C 3 30.029 30.029 29.038 0.991 18003
10697 1 18 . 1 1 3 3 GLY N N 4 110.613 110.613 108.472 2.141 18003
10698 1 18 . 1 1 3 3 GLY C C 4 174.068 174.068 173.236 0.832 18003
10699 1 18 . 1 1 3 3 GLY CA C 4 45.141 45.141 45.196 -0.055 18003
10700 1 18 . 1 1 3 3 GLY H H 4 8.500 8.500 8.608 -0.108 18003
10701 1 18 . 1 1 4 4 VAL N N 5 119.318 119.318 120.038 -0.720 18003
10702 1 18 . 1 1 4 4 VAL HA H 5 4.128 4.128 4.237 -0.109 18003
10703 1 18 . 1 1 4 4 VAL C C 5 176.361 176.361 175.662 0.699 18003
10704 1 18 . 1 1 4 4 VAL CA C 5 61.987 61.987 60.592 1.395 18003
10705 1 18 . 1 1 4 4 VAL CB C 5 32.635 32.635 32.944 -0.309 18003
10706 1 18 . 1 1 4 4 VAL H H 5 8.094 8.094 7.381 0.713 18003
10707 1 18 . 1 1 5 5 GLU N N 6 124.369 124.369 122.631 1.738 18003
10708 1 18 . 1 1 5 5 GLU HA H 6 4.288 4.288 3.960 0.328 18003
10709 1 18 . 1 1 5 5 GLU C C 6 177.012 177.012 176.476 0.536 18003
10710 1 18 . 1 1 5 5 GLU CA C 6 56.699 56.699 57.447 -0.748 18003
10711 1 18 . 1 1 5 5 GLU CB C 6 30.029 30.029 28.552 1.477 18003
10712 1 18 . 1 1 5 5 GLU H H 6 8.545 8.545 9.006 -0.461 18003
10713 1 18 . 1 1 6 6 GLY N N 7 109.747 109.747 106.339 3.408 18003
10714 1 18 . 1 1 6 6 GLY C C 7 174.117 174.117 174.719 -0.602 18003
10715 1 18 . 1 1 6 6 GLY CA C 7 45.568 45.568 45.361 0.207 18003
10716 1 18 . 1 1 6 6 GLY H H 7 8.352 8.352 8.097 0.255 18003
10717 1 18 . 1 1 7 7 ARG N N 8 120.059 120.059 121.121 -1.062 18003
10718 1 18 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.503 -0.161 18003
10719 1 18 . 1 1 7 7 ARG C C 8 176.016 176.016 174.865 1.151 18003
10720 1 18 . 1 1 7 7 ARG CA C 8 55.833 55.833 55.361 0.472 18003
10721 1 18 . 1 1 7 7 ARG CB C 8 30.444 30.444 30.647 -0.203 18003
10722 1 18 . 1 1 7 7 ARG H H 8 8.084 8.084 7.815 0.269 18003
10723 1 18 . 1 1 8 8 ASN N N 9 119.379 119.379 124.675 -5.296 18003
10724 1 18 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.744 -0.412 18003
10725 1 18 . 1 1 8 8 ASN C C 9 174.667 174.667 175.358 -0.691 18003
10726 1 18 . 1 1 8 8 ASN CA C 9 53.441 53.441 52.819 0.622 18003
10727 1 18 . 1 1 8 8 ASN CB C 9 38.480 38.480 39.088 -0.608 18003
10728 1 18 . 1 1 8 8 ASN H H 9 8.411 8.411 8.589 -0.178 18003
10729 1 18 . 1 1 9 9 ARG N N 10 121.700 121.700 124.863 -3.163 18003
10730 1 18 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.692 -0.043 18003
10731 1 18 . 1 1 9 9 ARG CA C 10 53.147 53.147 53.906 -0.759 18003
10732 1 18 . 1 1 9 9 ARG CB C 10 30.197 30.197 30.000 0.197 18003
10733 1 18 . 1 1 9 9 ARG H H 10 8.138 8.138 8.336 -0.198 18003
10734 1 18 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.350 0.093 18003
10735 1 18 . 1 1 10 10 PRO C C 11 176.815 176.815 175.625 1.190 18003
10736 1 18 . 1 1 10 10 PRO CA C 11 63.177 63.177 63.575 -0.398 18003
10737 1 18 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.090 -0.270 18003
10738 1 18 . 1 1 11 11 SER N N 12 116.291 116.291 118.177 -1.886 18003
10739 1 18 . 1 1 11 11 SER HA H 12 4.418 4.418 4.460 -0.042 18003
10740 1 18 . 1 1 11 11 SER C C 12 173.702 173.702 173.341 0.361 18003
10741 1 18 . 1 1 11 11 SER CA C 12 58.031 58.031 58.116 -0.085 18003
10742 1 18 . 1 1 11 11 SER CB C 12 64.032 64.032 64.131 -0.099 18003
10743 1 18 . 1 1 11 11 SER H H 12 8.325 8.325 8.145 0.180 18003
10744 1 18 . 1 1 12 12 ALA N N 13 126.862 126.862 127.561 -0.699 18003
10745 1 18 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.225 0.163 18003
10746 1 18 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.516 -1.058 18003
10747 1 18 . 1 1 12 12 ALA CB C 13 18.257 18.257 17.922 0.335 18003
10748 1 18 . 1 1 12 12 ALA H H 13 8.166 8.166 8.342 -0.176 18003
10749 1 18 . 1 1 13 13 PRO C C 14 176.368 176.368 176.616 -0.248 18003
10750 1 18 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.006 0.931 18003
10751 1 18 . 1 1 13 13 PRO CB C 14 32.022 32.022 32.548 -0.526 18003
10752 1 18 . 1 1 14 14 LEU N N 15 120.969 120.969 120.908 0.061 18003
10753 1 18 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.327 -0.069 18003
10754 1 18 . 1 1 14 14 LEU C C 15 176.124 176.124 177.125 -1.001 18003
10755 1 18 . 1 1 14 14 LEU CA C 15 54.527 54.527 55.233 -0.706 18003
10756 1 18 . 1 1 14 14 LEU CB C 15 43.418 43.418 40.289 3.129 18003
10757 1 18 . 1 1 14 14 LEU H H 15 7.875 7.875 8.534 -0.659 18003
10758 1 18 . 1 1 15 15 ASP N N 16 121.780 121.780 120.917 0.863 18003
10759 1 18 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.734 -0.141 18003
10760 1 18 . 1 1 15 15 ASP C C 16 176.208 176.208 177.837 -1.629 18003
10761 1 18 . 1 1 15 15 ASP CA C 16 52.468 52.468 56.741 -4.273 18003
10762 1 18 . 1 1 15 15 ASP CB C 16 41.629 41.629 41.098 0.531 18003
10763 1 18 . 1 1 15 15 ASP H H 16 7.850 7.850 7.935 -0.085 18003
10764 1 18 . 1 1 16 16 SER N N 17 114.435 114.435 116.342 -1.907 18003
10765 1 18 . 1 1 16 16 SER HA H 17 4.120 4.120 4.092 0.028 18003
10766 1 18 . 1 1 16 16 SER C C 17 177.207 177.207 176.617 0.590 18003
10767 1 18 . 1 1 16 16 SER CA C 17 62.322 62.322 61.785 0.537 18003
10768 1 18 . 1 1 16 16 SER H H 17 8.658 8.658 8.276 0.382 18003
10769 1 18 . 1 1 17 17 GLN N N 18 122.403 122.403 120.791 1.612 18003
10770 1 18 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.161 0.036 18003
10771 1 18 . 1 1 17 17 GLN C C 18 178.715 178.715 177.928 0.787 18003
10772 1 18 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.235 -0.122 18003
10773 1 18 . 1 1 17 17 GLN CB C 18 28.040 28.040 27.895 0.145 18003
10774 1 18 . 1 1 17 17 GLN H H 18 8.140 8.140 8.165 -0.025 18003
10775 1 18 . 1 1 18 18 ALA N N 19 124.743 124.743 121.951 2.792 18003
10776 1 18 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.014 0.162 18003
10777 1 18 . 1 1 18 18 ALA C C 19 180.616 180.616 179.593 1.023 18003
10778 1 18 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.775 -0.170 18003
10779 1 18 . 1 1 18 18 ALA CB C 19 19.028 19.028 17.951 1.077 18003
10780 1 18 . 1 1 18 18 ALA H H 19 8.455 8.455 7.808 0.647 18003
10781 1 18 . 1 1 19 19 ALA N N 20 119.089 119.089 120.916 -1.827 18003
10782 1 18 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.031 0.148 18003
10783 1 18 . 1 1 19 19 ALA C C 20 179.239 179.239 179.384 -0.145 18003
10784 1 18 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.846 0.425 18003
10785 1 18 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.345 -0.153 18003
10786 1 18 . 1 1 19 19 ALA H H 20 8.993 8.993 7.871 1.122 18003
10787 1 18 . 1 1 20 20 ALA N N 21 119.226 119.226 121.049 -1.823 18003
10788 1 18 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.949 0.111 18003
10789 1 18 . 1 1 20 20 ALA C C 21 180.230 180.230 180.001 0.229 18003
10790 1 18 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.079 0.064 18003
10791 1 18 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.192 -0.164 18003
10792 1 18 . 1 1 20 20 ALA H H 21 7.724 7.724 8.150 -0.426 18003
10793 1 18 . 1 1 21 21 GLN N N 22 119.310 119.310 118.220 1.090 18003
10794 1 18 . 1 1 21 21 GLN HA H 22 4.129 4.129 4.030 0.099 18003
10795 1 18 . 1 1 21 21 GLN C C 22 179.319 179.319 178.729 0.590 18003
10796 1 18 . 1 1 21 21 GLN CA C 22 58.762 58.762 58.772 -0.010 18003
10797 1 18 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.248 -0.219 18003
10798 1 18 . 1 1 21 21 GLN H H 22 7.638 7.638 8.516 -0.878 18003
10799 1 18 . 1 1 22 22 VAL N N 23 121.565 121.565 119.718 1.847 18003
10800 1 18 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.638 0.328 18003
10801 1 18 . 1 1 22 22 VAL C C 23 178.026 178.026 177.880 0.146 18003
10802 1 18 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.065 0.077 18003
10803 1 18 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.066 -0.100 18003
10804 1 18 . 1 1 22 22 VAL H H 23 8.442 8.442 8.013 0.429 18003
10805 1 18 . 1 1 23 23 ALA N N 24 121.400 121.400 122.360 -0.960 18003
10806 1 18 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.884 0.212 18003
10807 1 18 . 1 1 23 23 ALA C C 24 178.758 178.758 179.729 -0.971 18003
10808 1 18 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.562 0.353 18003
10809 1 18 . 1 1 23 23 ALA CB C 24 16.650 16.650 17.962 -1.312 18003
10810 1 18 . 1 1 23 23 ALA H H 24 8.495 8.495 8.587 -0.092 18003
10811 1 18 . 1 1 24 24 SER N N 25 112.138 112.138 112.838 -0.700 18003
10812 1 18 . 1 1 24 24 SER HA H 25 4.093 4.093 4.116 -0.023 18003
10813 1 18 . 1 1 24 24 SER C C 25 177.271 177.271 176.839 0.432 18003
10814 1 18 . 1 1 24 24 SER CA C 25 62.166 62.166 61.879 0.287 18003
10815 1 18 . 1 1 24 24 SER CB C 25 63.032 63.032 62.992 0.040 18003
10816 1 18 . 1 1 24 24 SER H H 25 7.936 7.936 8.217 -0.281 18003
10817 1 18 . 1 1 25 25 THR N N 26 119.701 119.701 119.478 0.223 18003
10818 1 18 . 1 1 25 25 THR HA H 26 4.380 4.380 3.995 0.385 18003
10819 1 18 . 1 1 25 25 THR C C 26 175.456 175.456 176.658 -1.202 18003
10820 1 18 . 1 1 25 25 THR CA C 26 67.129 67.129 67.104 0.025 18003
10821 1 18 . 1 1 25 25 THR CB C 26 68.800 68.800 68.837 -0.036 18003
10822 1 18 . 1 1 25 25 THR H H 26 7.775 7.775 7.709 0.066 18003
10823 1 18 . 1 1 26 26 LEU N N 27 119.270 119.270 120.602 -1.332 18003
10824 1 18 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.132 -0.569 18003
10825 1 18 . 1 1 26 26 LEU C C 27 178.390 178.390 179.141 -0.751 18003
10826 1 18 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.327 0.342 18003
10827 1 18 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.218 0.812 18003
10828 1 18 . 1 1 26 26 LEU H H 27 8.006 8.006 8.535 -0.529 18003
10829 1 18 . 1 1 27 27 GLN N N 28 115.843 115.843 119.885 -4.042 18003
10830 1 18 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.010 -0.206 18003
10831 1 18 . 1 1 27 27 GLN C C 28 178.657 178.657 178.000 0.657 18003
10832 1 18 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.903 -0.191 18003
10833 1 18 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.873 -0.844 18003
10834 1 18 . 1 1 27 27 GLN H H 28 8.485 8.485 8.044 0.441 18003
10835 1 18 . 1 1 28 28 ALA N N 29 118.779 118.779 122.441 -3.662 18003
10836 1 18 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.046 -0.038 18003
10837 1 18 . 1 1 28 28 ALA C C 29 178.259 178.259 179.910 -1.651 18003
10838 1 18 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.812 -0.849 18003
10839 1 18 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.505 0.233 18003
10840 1 18 . 1 1 28 28 ALA H H 29 7.432 7.432 7.912 -0.480 18003
10841 1 18 . 1 1 29 29 LEU N N 30 113.442 113.442 117.032 -3.590 18003
10842 1 18 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.881 0.115 18003
10843 1 18 . 1 1 29 29 LEU C C 30 175.924 175.924 177.491 -1.567 18003
10844 1 18 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.952 -1.388 18003
10845 1 18 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.507 0.759 18003
10846 1 18 . 1 1 29 29 LEU H H 30 7.311 7.311 7.845 -0.534 18003
10847 1 18 . 1 1 30 30 ALA N N 31 119.563 119.563 118.838 0.725 18003
10848 1 18 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.145 0.027 18003
10849 1 18 . 1 1 30 30 ALA C C 31 176.316 176.316 176.396 -0.080 18003
10850 1 18 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.487 -1.831 18003
10851 1 18 . 1 1 30 30 ALA CB C 31 18.077 18.077 18.955 -0.878 18003
10852 1 18 . 1 1 30 30 ALA H H 31 7.223 7.223 7.293 -0.070 18003
10853 1 18 . 1 1 31 31 THR N N 32 114.613 114.613 108.159 6.454 18003
10854 1 18 . 1 1 31 31 THR HA H 32 4.950 4.950 4.081 0.869 18003
10855 1 18 . 1 1 31 31 THR CA C 32 58.129 58.129 62.017 -3.888 18003
10856 1 18 . 1 1 31 31 THR CB C 32 69.098 69.098 67.277 1.821 18003
10857 1 18 . 1 1 31 31 THR H H 32 8.399 8.399 8.186 0.213 18003
10858 1 18 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.165 0.274 18003
10859 1 18 . 1 1 32 32 PRO C C 33 178.207 178.207 178.959 -0.752 18003
10860 1 18 . 1 1 32 32 PRO CA C 33 66.905 66.905 66.009 0.896 18003
10861 1 18 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.232 0.032 18003
10862 1 18 . 1 1 33 33 SER N N 34 110.767 110.767 113.413 -2.646 18003
10863 1 18 . 1 1 33 33 SER HA H 34 4.026 4.026 4.222 -0.196 18003
10864 1 18 . 1 1 33 33 SER C C 34 176.742 176.742 176.830 -0.088 18003
10865 1 18 . 1 1 33 33 SER CA C 34 61.782 61.782 61.563 0.219 18003
10866 1 18 . 1 1 33 33 SER CB C 34 62.432 62.432 62.837 -0.404 18003
10867 1 18 . 1 1 33 33 SER H H 34 8.407 8.407 8.403 0.004 18003
10868 1 18 . 1 1 34 34 ARG N N 35 120.135 120.135 123.004 -2.869 18003
10869 1 18 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.124 -0.070 18003
10870 1 18 . 1 1 34 34 ARG C C 35 178.283 178.283 178.858 -0.575 18003
10871 1 18 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.972 1.560 18003
10872 1 18 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.972 -1.019 18003
10873 1 18 . 1 1 34 34 ARG H H 35 7.341 7.341 8.197 -0.856 18003
10874 1 18 . 1 1 35 35 LEU N N 36 118.454 118.454 121.348 -2.894 18003
10875 1 18 . 1 1 35 35 LEU HA H 36 4.054 4.054 3.996 0.058 18003
10876 1 18 . 1 1 35 35 LEU C C 36 180.643 180.643 178.892 1.751 18003
10877 1 18 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.112 -0.303 18003
10878 1 18 . 1 1 35 35 LEU CB C 36 41.778 41.778 42.051 -0.273 18003
10879 1 18 . 1 1 35 35 LEU H H 36 8.226 8.226 8.803 -0.577 18003
10880 1 18 . 1 1 36 36 MET N N 37 121.073 121.073 118.939 2.134 18003
10881 1 18 . 1 1 36 36 MET HA H 37 3.928 3.928 4.103 -0.175 18003
10882 1 18 . 1 1 36 36 MET C C 37 177.671 177.671 178.449 -0.778 18003
10883 1 18 . 1 1 36 36 MET CA C 37 60.613 60.613 58.090 2.523 18003
10884 1 18 . 1 1 36 36 MET CB C 37 33.128 33.128 32.213 0.915 18003
10885 1 18 . 1 1 36 36 MET H H 37 8.447 8.447 8.180 0.267 18003
10886 1 18 . 1 1 37 37 ILE N N 38 118.239 118.239 119.845 -1.606 18003
10887 1 18 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.609 -0.169 18003
10888 1 18 . 1 1 37 37 ILE C C 38 177.092 177.092 178.388 -1.296 18003
10889 1 18 . 1 1 37 37 ILE CA C 38 65.675 65.675 65.518 0.157 18003
10890 1 18 . 1 1 37 37 ILE CB C 38 38.255 38.255 37.744 0.511 18003
10891 1 18 . 1 1 37 37 ILE H H 38 7.763 7.763 7.809 -0.046 18003
10892 1 18 . 1 1 38 38 LEU N N 39 116.073 116.073 120.372 -4.299 18003
10893 1 18 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.889 -0.063 18003
10894 1 18 . 1 1 38 38 LEU C C 39 178.941 178.941 178.972 -0.031 18003
10895 1 18 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.423 -0.392 18003
10896 1 18 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.510 0.270 18003
10897 1 18 . 1 1 38 38 LEU H H 39 8.538 8.538 8.459 0.079 18003
10898 1 18 . 1 1 39 39 THR N N 40 106.678 106.678 115.520 -8.842 18003
10899 1 18 . 1 1 39 39 THR HA H 40 3.932 3.932 3.896 0.036 18003
10900 1 18 . 1 1 39 39 THR C C 40 177.747 177.747 176.783 0.964 18003
10901 1 18 . 1 1 39 39 THR CA C 40 65.536 65.536 67.055 -1.519 18003
10902 1 18 . 1 1 39 39 THR CB C 40 68.360 68.360 68.406 -0.046 18003
10903 1 18 . 1 1 39 39 THR H H 40 8.086 8.086 8.614 -0.528 18003
10904 1 18 . 1 1 40 40 GLN N N 41 122.344 122.344 119.539 2.805 18003
10905 1 18 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.075 -0.069 18003
10906 1 18 . 1 1 40 40 GLN C C 41 178.348 178.348 178.634 -0.286 18003
10907 1 18 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.339 -0.414 18003
10908 1 18 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.328 -0.808 18003
10909 1 18 . 1 1 40 40 GLN H H 41 7.593 7.593 7.689 -0.096 18003
10910 1 18 . 1 1 41 41 LEU N N 42 116.302 116.302 122.804 -6.502 18003
10911 1 18 . 1 1 41 41 LEU C C 42 178.418 178.418 178.852 -0.434 18003
10912 1 18 . 1 1 41 41 LEU CA C 42 55.531 55.531 56.879 -1.348 18003
10913 1 18 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.951 -0.602 18003
10914 1 18 . 1 1 41 41 LEU H H 42 7.570 7.570 7.895 -0.325 18003
10915 1 18 . 1 1 42 42 ARG N N 43 119.954 119.954 117.172 2.782 18003
10916 1 18 . 1 1 42 42 ARG HA H 43 3.915 3.915 4.054 -0.139 18003
10917 1 18 . 1 1 42 42 ARG C C 43 177.205 177.205 176.427 0.778 18003
10918 1 18 . 1 1 42 42 ARG CA C 43 58.704 58.704 58.493 0.211 18003
10919 1 18 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.496 -1.053 18003
10920 1 18 . 1 1 42 42 ARG H H 43 7.612 7.612 8.495 -0.883 18003
10921 1 18 . 1 1 43 43 ASN N N 44 114.682 114.682 117.521 -2.839 18003
10922 1 18 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.785 -0.025 18003
10923 1 18 . 1 1 43 43 ASN C C 44 174.507 174.507 173.782 0.725 18003
10924 1 18 . 1 1 43 43 ASN CA C 44 53.953 53.953 52.995 0.958 18003
10925 1 18 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.063 -0.033 18003
10926 1 18 . 1 1 43 43 ASN H H 44 7.567 7.567 7.446 0.121 18003
10927 1 18 . 1 1 44 44 GLY N N 45 109.113 109.113 109.601 -0.488 18003
10928 1 18 . 1 1 44 44 GLY CA C 45 44.268 44.268 45.115 -0.847 18003
10929 1 18 . 1 1 44 44 GLY H H 45 7.361 7.361 7.604 -0.243 18003
10930 1 18 . 1 1 45 45 PRO C C 46 178.412 178.412 176.110 2.302 18003
10931 1 18 . 1 1 45 45 PRO CA C 46 62.580 62.580 62.847 -0.267 18003
10932 1 18 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.491 1.638 18003
10933 1 18 . 1 1 46 46 LEU N N 47 120.363 120.363 122.365 -2.002 18003
10934 1 18 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.810 0.221 18003
10935 1 18 . 1 1 46 46 LEU CA C 47 52.550 52.550 51.666 0.884 18003
10936 1 18 . 1 1 46 46 LEU CB C 47 48.210 48.210 42.218 5.992 18003
10937 1 18 . 1 1 46 46 LEU H H 47 8.252 8.252 7.896 0.356 18003
10938 1 18 . 1 1 47 47 PRO C C 48 177.313 177.313 177.699 -0.386 18003
10939 1 18 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.728 -0.893 18003
10940 1 18 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.509 -0.126 18003
10941 1 18 . 1 1 48 48 VAL N N 49 119.384 119.384 118.831 0.553 18003
10942 1 18 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.809 -0.202 18003
10943 1 18 . 1 1 48 48 VAL C C 49 176.710 176.710 178.112 -1.402 18003
10944 1 18 . 1 1 48 48 VAL CA C 49 66.188 66.188 66.307 -0.119 18003
10945 1 18 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.819 -0.238 18003
10946 1 18 . 1 1 48 48 VAL H H 49 9.074 9.074 8.416 0.658 18003
10947 1 18 . 1 1 49 49 THR N N 50 111.293 111.293 116.447 -5.154 18003
10948 1 18 . 1 1 49 49 THR HA H 50 4.181 4.181 3.881 0.300 18003
10949 1 18 . 1 1 49 49 THR C C 50 176.717 176.717 175.982 0.735 18003
10950 1 18 . 1 1 49 49 THR CA C 50 65.063 65.063 67.041 -1.978 18003
10951 1 18 . 1 1 49 49 THR CB C 50 68.032 68.032 67.803 0.229 18003
10952 1 18 . 1 1 49 49 THR H H 50 7.848 7.848 8.527 -0.679 18003
10953 1 18 . 1 1 50 50 ASP N N 51 120.138 120.138 120.659 -0.521 18003
10954 1 18 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.500 -0.295 18003
10955 1 18 . 1 1 50 50 ASP C C 51 174.723 174.723 178.535 -3.812 18003
10956 1 18 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.045 -0.264 18003
10957 1 18 . 1 1 50 50 ASP CB C 51 41.111 41.111 39.965 1.146 18003
10958 1 18 . 1 1 50 50 ASP H H 51 7.108 7.108 8.650 -1.542 18003
10959 1 18 . 1 1 51 51 LEU N N 52 121.089 121.089 121.324 -0.235 18003
10960 1 18 . 1 1 51 51 LEU HA H 52 3.985 3.985 3.942 0.043 18003
10961 1 18 . 1 1 51 51 LEU C C 52 177.089 177.089 178.177 -1.088 18003
10962 1 18 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.721 0.440 18003
10963 1 18 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.600 0.180 18003
10964 1 18 . 1 1 51 51 LEU H H 52 7.943 7.943 8.127 -0.184 18003
10965 1 18 . 1 1 52 52 ALA N N 53 119.237 119.237 121.420 -2.183 18003
10966 1 18 . 1 1 52 52 ALA HA H 53 3.872 3.872 4.078 -0.206 18003
10967 1 18 . 1 1 52 52 ALA C C 53 179.466 179.466 180.285 -0.819 18003
10968 1 18 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.399 0.264 18003
10969 1 18 . 1 1 52 52 ALA CB C 53 17.619 17.619 17.931 -0.312 18003
10970 1 18 . 1 1 52 52 ALA H H 53 8.480 8.480 8.558 -0.078 18003
10971 1 18 . 1 1 53 53 GLU N N 54 115.655 115.655 118.612 -2.957 18003
10972 1 18 . 1 1 53 53 GLU HA H 54 4.054 4.054 4.046 0.008 18003
10973 1 18 . 1 1 53 53 GLU C C 54 179.073 179.073 178.529 0.544 18003
10974 1 18 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.767 0.060 18003
10975 1 18 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.391 0.009 18003
10976 1 18 . 1 1 53 53 GLU H H 54 7.705 7.705 7.951 -0.246 18003
10977 1 18 . 1 1 54 54 ALA N N 55 120.276 120.276 121.042 -0.766 18003
10978 1 18 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.225 -0.088 18003
10979 1 18 . 1 1 54 54 ALA C C 55 179.771 179.771 177.832 1.939 18003
10980 1 18 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.111 0.550 18003
10981 1 18 . 1 1 54 54 ALA CB C 55 18.235 18.235 20.415 -2.180 18003
10982 1 18 . 1 1 54 54 ALA H H 55 7.928 7.928 7.693 0.235 18003
10983 1 18 . 1 1 55 55 ILE N N 56 107.195 107.195 116.083 -8.888 18003
10984 1 18 . 1 1 55 55 ILE C C 56 176.053 176.053 173.656 2.397 18003
10985 1 18 . 1 1 55 55 ILE CA C 56 60.551 60.551 61.607 -1.056 18003
10986 1 18 . 1 1 55 55 ILE CB C 56 38.497 38.497 38.050 0.447 18003
10987 1 18 . 1 1 55 55 ILE H H 56 7.507 7.507 8.264 -0.757 18003
10988 1 18 . 1 1 56 56 GLY N N 57 111.108 111.108 112.511 -1.403 18003
10989 1 18 . 1 1 56 56 GLY C C 57 174.421 174.421 174.847 -0.426 18003
10990 1 18 . 1 1 56 56 GLY CA C 57 46.960 46.960 46.115 0.845 18003
10991 1 18 . 1 1 56 56 GLY H H 57 7.757 7.757 7.945 -0.188 18003
10992 1 18 . 1 1 57 57 MET N N 58 118.089 118.089 118.857 -0.768 18003
10993 1 18 . 1 1 57 57 MET HA H 58 3.933 3.933 4.080 -0.147 18003
10994 1 18 . 1 1 57 57 MET C C 58 174.157 174.157 175.011 -0.854 18003
10995 1 18 . 1 1 57 57 MET CA C 58 54.091 54.091 56.817 -2.726 18003
10996 1 18 . 1 1 57 57 MET CB C 58 38.062 38.062 31.977 6.085 18003
10997 1 18 . 1 1 57 57 MET H H 58 7.659 7.659 7.689 -0.030 18003
10998 1 18 . 1 1 58 58 GLU N N 59 121.656 121.656 117.106 4.550 18003
10999 1 18 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.456 -0.116 18003
11000 1 18 . 1 1 58 58 GLU C C 59 178.355 178.355 176.156 2.199 18003
11001 1 18 . 1 1 58 58 GLU CA C 59 56.643 56.643 55.482 1.161 18003
11002 1 18 . 1 1 58 58 GLU CB C 59 30.029 30.029 30.219 -0.190 18003
11003 1 18 . 1 1 58 58 GLU H H 59 8.523 8.523 8.080 0.443 18003
11004 1 18 . 1 1 59 59 GLN N N 60 123.686 123.686 121.836 1.850 18003
11005 1 18 . 1 1 59 59 GLN HA H 60 4.214 4.214 3.964 0.250 18003
11006 1 18 . 1 1 59 59 GLN C C 60 177.961 177.961 177.991 -0.030 18003
11007 1 18 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.553 2.062 18003
11008 1 18 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.406 0.609 18003
11009 1 18 . 1 1 59 59 GLN H H 60 9.009 9.009 8.713 0.296 18003
11010 1 18 . 1 1 60 60 SER N N 61 115.101 115.101 114.751 0.350 18003
11011 1 18 . 1 1 60 60 SER C C 61 176.801 176.801 175.887 0.914 18003
11012 1 18 . 1 1 60 60 SER CA C 61 61.213 61.213 61.105 0.109 18003
11013 1 18 . 1 1 60 60 SER H H 61 8.964 8.964 8.301 0.663 18003
11014 1 18 . 1 1 61 61 ALA N N 62 126.069 126.069 123.104 2.965 18003
11015 1 18 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.030 0.321 18003
11016 1 18 . 1 1 61 61 ALA C C 62 180.635 180.635 179.775 0.860 18003
11017 1 18 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.671 -0.413 18003
11018 1 18 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.269 0.354 18003
11019 1 18 . 1 1 61 61 ALA H H 62 7.103 7.103 8.226 -1.123 18003
11020 1 18 . 1 1 62 62 VAL N N 63 119.252 119.252 118.812 0.440 18003
11021 1 18 . 1 1 62 62 VAL C C 63 177.842 177.842 177.947 -0.105 18003
11022 1 18 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.646 0.152 18003
11023 1 18 . 1 1 62 62 VAL CB C 63 31.264 31.264 30.773 0.491 18003
11024 1 18 . 1 1 62 62 VAL H H 63 7.971 7.971 7.701 0.270 18003
11025 1 18 . 1 1 63 63 SER N N 64 115.494 115.494 115.415 0.079 18003
11026 1 18 . 1 1 63 63 SER HA H 64 4.034 4.034 3.920 0.114 18003
11027 1 18 . 1 1 63 63 SER C C 64 176.835 176.835 176.718 0.117 18003
11028 1 18 . 1 1 63 63 SER CA C 64 62.400 62.400 61.843 0.557 18003
11029 1 18 . 1 1 63 63 SER CB C 64 62.752 62.752 62.964 -0.212 18003
11030 1 18 . 1 1 63 63 SER H H 64 8.743 8.743 8.144 0.599 18003
11031 1 18 . 1 1 64 64 HIS N N 65 120.010 120.010 120.207 -0.197 18003
11032 1 18 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.172 0.188 18003
11033 1 18 . 1 1 64 64 HIS C C 65 177.731 177.731 177.431 0.300 18003
11034 1 18 . 1 1 64 64 HIS CA C 65 59.998 59.998 58.714 1.284 18003
11035 1 18 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.806 0.128 18003
11036 1 18 . 1 1 64 64 HIS H H 65 7.804 7.804 8.063 -0.259 18003
11037 1 18 . 1 1 65 65 GLN N N 66 115.590 115.590 119.715 -4.125 18003
11038 1 18 . 1 1 65 65 GLN HA H 66 4.035 4.035 4.022 0.013 18003
11039 1 18 . 1 1 65 65 GLN C C 66 179.055 179.055 178.307 0.748 18003
11040 1 18 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.775 -1.245 18003
11041 1 18 . 1 1 65 65 GLN H H 66 7.751 7.751 8.173 -0.422 18003
11042 1 18 . 1 1 66 66 LEU N N 67 118.746 118.746 120.912 -2.166 18003
11043 1 18 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.934 0.013 18003
11044 1 18 . 1 1 66 66 LEU C C 67 178.334 178.334 178.697 -0.363 18003
11045 1 18 . 1 1 66 66 LEU CA C 67 57.846 57.846 58.099 -0.253 18003
11046 1 18 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.713 -0.610 18003
11047 1 18 . 1 1 66 66 LEU H H 67 8.648 8.648 8.490 0.158 18003
11048 1 18 . 1 1 67 67 ARG N N 68 119.610 119.610 119.222 0.388 18003
11049 1 18 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.963 -0.020 18003
11050 1 18 . 1 1 67 67 ARG C C 68 178.807 178.807 178.961 -0.154 18003
11051 1 18 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.705 -0.328 18003
11052 1 18 . 1 1 67 67 ARG CB C 68 29.475 29.475 30.065 -0.590 18003
11053 1 18 . 1 1 67 67 ARG H H 68 7.607 7.607 8.148 -0.541 18003
11054 1 18 . 1 1 68 68 VAL N N 69 119.719 119.719 120.201 -0.482 18003
11055 1 18 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.704 -0.071 18003
11056 1 18 . 1 1 68 68 VAL C C 69 178.690 178.690 178.024 0.666 18003
11057 1 18 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.413 0.041 18003
11058 1 18 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.335 0.444 18003
11059 1 18 . 1 1 68 68 VAL H H 69 7.259 7.259 7.881 -0.622 18003
11060 1 18 . 1 1 69 69 LEU N N 70 117.532 117.532 119.409 -1.877 18003
11061 1 18 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.896 0.052 18003
11062 1 18 . 1 1 69 69 LEU C C 70 179.144 179.144 178.952 0.192 18003
11063 1 18 . 1 1 69 69 LEU CA C 70 57.750 57.750 58.121 -0.371 18003
11064 1 18 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.290 0.570 18003
11065 1 18 . 1 1 69 69 LEU H H 70 8.375 8.375 8.292 0.083 18003
11066 1 18 . 1 1 70 70 ARG N N 71 122.498 122.498 119.658 2.840 18003
11067 1 18 . 1 1 70 70 ARG HA H 71 3.931 3.931 3.962 -0.031 18003
11068 1 18 . 1 1 70 70 ARG C C 71 180.499 180.499 178.821 1.678 18003
11069 1 18 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.475 -0.698 18003
11070 1 18 . 1 1 70 70 ARG CB C 71 30.155 30.155 30.065 0.090 18003
11071 1 18 . 1 1 70 70 ARG H H 71 8.822 8.822 8.654 0.168 18003
11072 1 18 . 1 1 71 71 ASN N N 72 121.816 121.816 117.943 3.873 18003
11073 1 18 . 1 1 71 71 ASN C C 72 177.170 177.170 177.415 -0.245 18003
11074 1 18 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.681 0.096 18003
11075 1 18 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.069 -0.335 18003
11076 1 18 . 1 1 71 71 ASN H H 72 8.144 8.144 7.817 0.327 18003
11077 1 18 . 1 1 72 72 LEU N N 73 117.044 117.044 118.714 -1.670 18003
11078 1 18 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.237 0.108 18003
11079 1 18 . 1 1 72 72 LEU C C 73 176.984 176.984 178.146 -1.162 18003
11080 1 18 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.414 -1.289 18003
11081 1 18 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.305 0.964 18003
11082 1 18 . 1 1 72 72 LEU H H 73 7.804 7.804 7.687 0.117 18003
11083 1 18 . 1 1 73 73 GLY N N 74 106.621 106.621 104.548 2.073 18003
11084 1 18 . 1 1 73 73 GLY C C 74 173.266 173.266 174.478 -1.212 18003
11085 1 18 . 1 1 73 73 GLY CA C 74 46.022 46.022 45.001 1.022 18003
11086 1 18 . 1 1 73 73 GLY H H 74 7.851 7.851 8.255 -0.404 18003
11087 1 18 . 1 1 74 74 LEU N N 75 114.582 114.582 119.824 -5.242 18003
11088 1 18 . 1 1 74 74 LEU C C 75 177.562 177.562 176.137 1.425 18003
11089 1 18 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.179 0.852 18003
11090 1 18 . 1 1 74 74 LEU CB C 75 44.444 44.444 43.116 1.328 18003
11091 1 18 . 1 1 74 74 LEU H H 75 7.808 7.808 8.111 -0.303 18003
11092 1 18 . 1 1 75 75 VAL N N 76 110.980 110.980 112.603 -1.623 18003
11093 1 18 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.749 -0.222 18003
11094 1 18 . 1 1 75 75 VAL C C 76 173.922 173.922 174.362 -0.440 18003
11095 1 18 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.593 -2.650 18003
11096 1 18 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.949 0.080 18003
11097 1 18 . 1 1 75 75 VAL H H 76 7.079 7.079 7.339 -0.260 18003
11098 1 18 . 1 1 76 76 VAL N N 77 118.619 118.619 121.113 -2.494 18003
11099 1 18 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.515 0.787 18003
11100 1 18 . 1 1 76 76 VAL C C 77 174.041 174.041 174.708 -0.667 18003
11101 1 18 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.919 -0.920 18003
11102 1 18 . 1 1 76 76 VAL H H 77 9.024 9.024 9.299 -0.275 18003
11103 1 18 . 1 1 77 77 GLY N N 78 109.451 109.451 110.989 -1.538 18003
11104 1 18 . 1 1 77 77 GLY C C 78 172.225 172.225 172.922 -0.697 18003
11105 1 18 . 1 1 77 77 GLY CA C 78 44.462 44.462 43.920 0.542 18003
11106 1 18 . 1 1 77 77 GLY H H 78 8.265 8.265 8.467 -0.202 18003
11107 1 18 . 1 1 78 78 ASP N N 79 122.826 122.826 120.898 1.928 18003
11108 1 18 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.927 -0.181 18003
11109 1 18 . 1 1 78 78 ASP C C 79 174.817 174.817 174.766 0.051 18003
11110 1 18 . 1 1 78 78 ASP CA C 79 53.111 53.111 53.180 -0.069 18003
11111 1 18 . 1 1 78 78 ASP CB C 79 43.655 43.655 44.731 -1.076 18003
11112 1 18 . 1 1 78 78 ASP H H 79 8.479 8.479 8.432 0.047 18003
11113 1 18 . 1 1 79 79 ARG N N 80 122.613 122.613 122.835 -0.222 18003
11114 1 18 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.837 -0.425 18003
11115 1 18 . 1 1 79 79 ARG C C 80 175.546 175.546 174.908 0.638 18003
11116 1 18 . 1 1 79 79 ARG CA C 80 56.318 56.318 55.211 1.107 18003
11117 1 18 . 1 1 79 79 ARG CB C 80 30.376 30.376 32.565 -2.189 18003
11118 1 18 . 1 1 79 79 ARG H H 80 8.580 8.580 8.569 0.011 18003
11119 1 18 . 1 1 80 80 ALA N N 81 129.263 129.263 129.258 0.005 18003
11120 1 18 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.704 -0.252 18003
11121 1 18 . 1 1 80 80 ALA C C 81 177.126 177.126 176.801 0.325 18003
11122 1 18 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.377 0.243 18003
11123 1 18 . 1 1 80 80 ALA CB C 81 19.260 19.260 21.540 -2.280 18003
11124 1 18 . 1 1 80 80 ALA H H 81 8.396 8.396 9.118 -0.722 18003
11125 1 18 . 1 1 81 81 GLY N N 82 112.739 112.739 110.780 1.959 18003
11126 1 18 . 1 1 81 81 GLY C C 82 174.856 174.856 175.223 -0.367 18003
11127 1 18 . 1 1 81 81 GLY CA C 82 46.392 46.392 47.355 -0.963 18003
11128 1 18 . 1 1 81 81 GLY H H 82 8.641 8.641 8.703 -0.062 18003
11129 1 18 . 1 1 82 82 ARG N N 83 124.780 124.780 124.053 0.727 18003
11130 1 18 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.598 -0.275 18003
11131 1 18 . 1 1 82 82 ARG C C 83 176.339 176.339 174.713 1.626 18003
11132 1 18 . 1 1 82 82 ARG CA C 83 56.690 56.690 55.518 1.172 18003
11133 1 18 . 1 1 82 82 ARG CB C 83 30.221 30.221 30.862 -0.641 18003
11134 1 18 . 1 1 82 82 ARG H H 83 8.728 8.728 8.505 0.223 18003
11135 1 18 . 1 1 83 83 SER N N 84 114.678 114.678 115.054 -0.376 18003
11136 1 18 . 1 1 83 83 SER C C 84 172.869 172.869 171.928 0.941 18003
11137 1 18 . 1 1 83 83 SER CA C 84 56.834 56.834 57.691 -0.857 18003
11138 1 18 . 1 1 83 83 SER CB C 84 65.191 65.191 65.912 -0.721 18003
11139 1 18 . 1 1 83 83 SER H H 84 7.821 7.821 8.594 -0.773 18003
11140 1 18 . 1 1 84 84 ILE N N 85 122.996 122.996 117.065 5.931 18003
11141 1 18 . 1 1 84 84 ILE C C 85 175.521 175.521 173.801 1.720 18003
11142 1 18 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.627 0.608 18003
11143 1 18 . 1 1 84 84 ILE CB C 85 38.136 38.136 42.089 -3.953 18003
11144 1 18 . 1 1 84 84 ILE H H 85 8.232 8.232 8.280 -0.048 18003
11145 1 18 . 1 1 85 85 VAL N N 86 121.845 121.845 115.412 6.433 18003
11146 1 18 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.490 -0.180 18003
11147 1 18 . 1 1 85 85 VAL C C 86 174.818 174.818 174.098 0.720 18003
11148 1 18 . 1 1 85 85 VAL CA C 86 59.738 59.738 59.041 0.697 18003
11149 1 18 . 1 1 85 85 VAL CB C 86 34.221 34.221 34.999 -0.778 18003
11150 1 18 . 1 1 85 85 VAL H H 86 8.495 8.495 8.229 0.266 18003
11151 1 18 . 1 1 86 86 TYR N N 87 125.020 125.020 120.879 4.141 18003
11152 1 18 . 1 1 86 86 TYR HA H 87 4.319 4.319 5.013 -0.694 18003
11153 1 18 . 1 1 86 86 TYR C C 87 173.808 173.808 175.363 -1.555 18003
11154 1 18 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.404 0.061 18003
11155 1 18 . 1 1 86 86 TYR CB C 87 41.480 41.480 40.485 0.995 18003
11156 1 18 . 1 1 86 86 TYR H H 87 8.488 8.488 8.223 0.265 18003
11157 1 18 . 1 1 87 87 SER N N 88 110.681 110.681 114.283 -3.602 18003
11158 1 18 . 1 1 87 87 SER HA H 88 5.414 5.414 4.786 0.628 18003
11159 1 18 . 1 1 87 87 SER C C 88 174.693 174.693 173.038 1.655 18003
11160 1 18 . 1 1 87 87 SER CA C 88 56.113 56.113 55.725 0.388 18003
11161 1 18 . 1 1 87 87 SER CB C 88 66.309 66.309 65.602 0.707 18003
11162 1 18 . 1 1 87 87 SER H H 88 8.718 8.718 9.162 -0.444 18003
11163 1 18 . 1 1 88 88 LEU N N 89 119.612 119.612 124.441 -4.829 18003
11164 1 18 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.260 0.667 18003
11165 1 18 . 1 1 88 88 LEU C C 89 179.031 179.031 178.406 0.625 18003
11166 1 18 . 1 1 88 88 LEU CA C 89 55.325 55.325 56.137 -0.812 18003
11167 1 18 . 1 1 88 88 LEU CB C 89 41.720 41.720 41.684 0.036 18003
11168 1 18 . 1 1 88 88 LEU H H 89 9.034 9.034 8.646 0.388 18003
11169 1 18 . 1 1 89 89 TYR N N 90 120.540 120.540 123.401 -2.861 18003
11170 1 18 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.134 0.488 18003
11171 1 18 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.764 0.948 18003
11172 1 18 . 1 1 89 89 TYR H H 90 8.075 8.075 8.653 -0.578 18003
11173 1 18 . 1 1 92 92 HIS C C 93 177.850 177.850 177.580 0.270 18003
11174 1 18 . 1 1 93 93 VAL N N 94 120.211 120.211 118.917 1.294 18003
11175 1 18 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.745 -0.244 18003
11176 1 18 . 1 1 93 93 VAL C C 94 176.785 176.785 178.050 -1.265 18003
11177 1 18 . 1 1 93 93 VAL CA C 94 66.666 66.666 66.116 0.550 18003
11178 1 18 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.067 0.570 18003
11179 1 18 . 1 1 93 93 VAL H H 94 8.164 8.164 8.324 -0.160 18003
11180 1 18 . 1 1 94 94 ALA N N 95 119.221 119.221 120.231 -1.010 18003
11181 1 18 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.999 -0.209 18003
11182 1 18 . 1 1 94 94 ALA C C 95 177.979 177.979 179.701 -1.722 18003
11183 1 18 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.194 0.285 18003
11184 1 18 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.055 0.055 18003
11185 1 18 . 1 1 94 94 ALA H H 95 6.942 6.942 7.446 -0.504 18003
11186 1 18 . 1 1 95 95 GLN N N 96 115.416 115.416 119.706 -4.290 18003
11187 1 18 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.194 -0.159 18003
11188 1 18 . 1 1 95 95 GLN C C 96 177.993 177.993 178.397 -0.404 18003
11189 1 18 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.796 0.046 18003
11190 1 18 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.633 -0.604 18003
11191 1 18 . 1 1 95 95 GLN H H 96 7.795 7.795 8.033 -0.238 18003
11192 1 18 . 1 1 96 96 LEU N N 97 120.758 120.758 120.527 0.231 18003
11193 1 18 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.049 -0.200 18003
11194 1 18 . 1 1 96 96 LEU C C 97 177.974 177.974 179.266 -1.292 18003
11195 1 18 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.230 1.052 18003
11196 1 18 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.570 -0.524 18003
11197 1 18 . 1 1 96 96 LEU H H 97 8.197 8.197 7.824 0.373 18003
11198 1 18 . 1 1 97 97 LEU N N 98 117.567 117.567 119.735 -2.168 18003
11199 1 18 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.903 -0.073 18003
11200 1 18 . 1 1 97 97 LEU C C 98 178.219 178.219 179.018 -0.799 18003
11201 1 18 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.318 -0.588 18003
11202 1 18 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.216 0.646 18003
11203 1 18 . 1 1 97 97 LEU H H 98 7.660 7.660 8.125 -0.465 18003
11204 1 18 . 1 1 98 98 ASP N N 99 118.607 118.607 120.398 -1.791 18003
11205 1 18 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.402 -0.293 18003
11206 1 18 . 1 1 98 98 ASP C C 99 179.382 179.382 179.202 0.180 18003
11207 1 18 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.711 0.324 18003
11208 1 18 . 1 1 98 98 ASP CB C 99 39.839 39.839 39.980 -0.141 18003
11209 1 18 . 1 1 98 98 ASP H H 99 8.295 8.295 8.626 -0.331 18003
11210 1 18 . 1 1 99 99 GLU N N 100 117.542 117.542 119.714 -2.172 18003
11211 1 18 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.164 -0.315 18003
11212 1 18 . 1 1 99 99 GLU C C 100 179.389 179.389 178.983 0.406 18003
11213 1 18 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.286 -1.263 18003
11214 1 18 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.351 -0.322 18003
11215 1 18 . 1 1 99 99 GLU H H 100 8.334 8.334 8.061 0.273 18003
11216 1 18 . 1 1 100 100 ALA N N 101 122.890 122.890 123.613 -0.723 18003
11217 1 18 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.127 -0.129 18003
11218 1 18 . 1 1 100 100 ALA C C 101 180.184 180.184 179.945 0.239 18003
11219 1 18 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.299 0.221 18003
11220 1 18 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.506 -0.887 18003
11221 1 18 . 1 1 100 100 ALA H H 101 8.550 8.550 7.958 0.592 18003
11222 1 18 . 1 1 101 101 ILE N N 102 119.952 119.952 119.145 0.807 18003
11223 1 18 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.788 -0.199 18003
11224 1 18 . 1 1 101 101 ILE C C 102 178.114 178.114 177.678 0.436 18003
11225 1 18 . 1 1 101 101 ILE CA C 102 65.376 65.376 64.839 0.537 18003
11226 1 18 . 1 1 101 101 ILE CB C 102 38.029 38.029 36.868 1.161 18003
11227 1 18 . 1 1 101 101 ILE H H 102 8.493 8.493 8.785 -0.292 18003
11228 1 18 . 1 1 102 102 TYR N N 103 120.625 120.625 121.294 -0.669 18003
11229 1 18 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.101 0.070 18003
11230 1 18 . 1 1 102 102 TYR C C 103 179.772 179.772 177.793 1.979 18003
11231 1 18 . 1 1 102 102 TYR CA C 103 60.724 60.724 61.757 -1.033 18003
11232 1 18 . 1 1 102 102 TYR CB C 103 37.500 37.500 38.470 -0.970 18003
11233 1 18 . 1 1 102 102 TYR H H 103 8.520 8.520 8.611 -0.091 18003
11234 1 18 . 1 1 103 103 HIS N N 104 117.456 117.456 117.897 -0.441 18003
11235 1 18 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.110 0.315 18003
11236 1 18 . 1 1 103 103 HIS C C 104 176.377 176.377 177.482 -1.105 18003
11237 1 18 . 1 1 103 103 HIS CA C 104 60.043 60.043 60.185 -0.143 18003
11238 1 18 . 1 1 103 103 HIS CB C 104 29.029 29.029 30.210 -1.181 18003
11239 1 18 . 1 1 103 103 HIS H H 104 8.622 8.622 8.893 -0.271 18003
11240 1 18 . 1 1 104 104 SER N N 105 113.596 113.596 114.886 -1.290 18003
11241 1 18 . 1 1 104 104 SER C C 105 176.712 176.712 176.894 -0.182 18003
11242 1 18 . 1 1 104 104 SER CA C 105 61.852 61.852 61.472 0.380 18003
11243 1 18 . 1 1 104 104 SER CB C 105 63.550 63.550 63.060 0.490 18003
11244 1 18 . 1 1 104 104 SER H H 105 7.900 7.900 8.187 -0.287 18003
11245 1 18 . 1 1 105 105 GLU N N 106 119.022 119.022 120.603 -1.581 18003
11246 1 18 . 1 1 105 105 GLU HA H 106 4.013 4.013 4.107 -0.094 18003
11247 1 18 . 1 1 105 105 GLU C C 106 177.902 177.902 178.386 -0.484 18003
11248 1 18 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.342 -0.311 18003
11249 1 18 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.551 -0.272 18003
11250 1 18 . 1 1 105 105 GLU H H 106 8.181 8.181 8.411 -0.230 18003
11251 1 18 . 1 1 106 106 HIS N N 107 116.482 116.482 118.563 -2.081 18003
11252 1 18 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.085 0.322 18003
11253 1 18 . 1 1 106 106 HIS C C 107 175.575 175.575 176.408 -0.833 18003
11254 1 18 . 1 1 106 106 HIS CA C 107 57.343 57.343 58.616 -1.273 18003
11255 1 18 . 1 1 106 106 HIS CB C 107 28.580 28.580 29.704 -1.124 18003
11256 1 18 . 1 1 106 106 HIS H H 107 7.770 7.770 7.752 0.018 18003
11257 1 18 . 1 1 107 107 LEU N N 108 120.346 120.346 116.684 3.662 18003
11258 1 18 . 1 1 107 107 LEU HA H 108 4.054 4.054 3.980 0.074 18003
11259 1 18 . 1 1 107 107 LEU C C 108 177.404 177.404 177.109 0.295 18003
11260 1 18 . 1 1 107 107 LEU CA C 108 55.991 55.991 55.138 0.853 18003
11261 1 18 . 1 1 107 107 LEU CB C 108 42.030 42.030 42.563 -0.533 18003
11262 1 18 . 1 1 107 107 LEU H H 108 7.682 7.682 7.473 0.209 18003
11263 1 18 . 1 1 108 108 HIS N N 109 117.222 117.222 117.922 -0.700 18003
11264 1 18 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.200 -0.146 18003
11265 1 18 . 1 1 108 108 HIS C C 109 174.606 174.606 175.476 -0.870 18003
11266 1 18 . 1 1 108 108 HIS CA C 109 56.029 56.029 56.468 -0.438 18003
11267 1 18 . 1 1 108 108 HIS CB C 109 28.517 28.517 28.210 0.307 18003
11268 1 18 . 1 1 108 108 HIS H H 109 8.030 8.030 7.933 0.097 18003
11269 1 18 . 1 1 109 109 LEU N N 110 121.114 121.114 119.797 1.317 18003
11270 1 18 . 1 1 109 109 LEU HA H 110 4.298 4.298 3.975 0.323 18003
11271 1 18 . 1 1 109 109 LEU C C 110 178.028 178.028 177.574 0.454 18003
11272 1 18 . 1 1 109 109 LEU CA C 110 55.574 55.574 56.654 -1.080 18003
11273 1 18 . 1 1 109 109 LEU CB C 110 42.076 42.076 42.151 -0.075 18003
11274 1 18 . 1 1 109 109 LEU H H 110 7.973 7.973 8.087 -0.114 18003
11275 1 18 . 1 1 110 110 GLY N N 111 108.631 108.631 105.488 3.143 18003
11276 1 18 . 1 1 110 110 GLY C C 111 174.606 174.606 174.613 -0.007 18003
11277 1 18 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.784 0.796 18003
11278 1 18 . 1 1 110 110 GLY H H 111 8.255 8.255 7.765 0.490 18003
11279 1 18 . 1 1 111 111 LEU N N 112 121.022 121.022 120.549 0.473 18003
11280 1 18 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.062 0.297 18003
11281 1 18 . 1 1 111 111 LEU C C 112 177.701 177.701 177.505 0.196 18003
11282 1 18 . 1 1 111 111 LEU CA C 112 55.476 55.476 54.735 0.741 18003
11283 1 18 . 1 1 111 111 LEU CB C 112 41.899 41.899 40.533 1.366 18003
11284 1 18 . 1 1 111 111 LEU H H 112 7.981 7.981 8.477 -0.496 18003
11285 1 18 . 1 1 112 112 SER N N 113 115.471 115.471 116.610 -1.139 18003
11286 1 18 . 1 1 112 112 SER HA H 113 4.432 4.432 4.166 0.266 18003
11287 1 18 . 1 1 112 112 SER C C 113 174.381 174.381 175.290 -0.909 18003
11288 1 18 . 1 1 112 112 SER CA C 113 58.527 58.527 59.772 -1.245 18003
11289 1 18 . 1 1 112 112 SER CB C 113 63.593 63.593 63.402 0.191 18003
11290 1 18 . 1 1 112 112 SER H H 113 8.215 8.215 8.280 -0.065 18003
11291 1 18 . 1 1 113 113 ASP N N 114 121.696 121.696 118.431 3.265 18003
11292 1 18 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.458 -0.031 18003
11293 1 18 . 1 1 113 113 ASP C C 114 175.958 175.958 176.227 -0.269 18003
11294 1 18 . 1 1 113 113 ASP CA C 114 54.213 54.213 55.253 -1.040 18003
11295 1 18 . 1 1 113 113 ASP CB C 114 41.030 41.030 39.728 1.302 18003
11296 1 18 . 1 1 113 113 ASP H H 114 8.203 8.203 8.586 -0.383 18003
11297 1 18 . 1 1 114 114 ARG N N 115 120.088 120.088 116.466 3.622 18003
11298 1 18 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.414 -0.142 18003
11299 1 18 . 1 1 114 114 ARG C C 115 175.792 175.792 175.799 -0.007 18003
11300 1 18 . 1 1 114 114 ARG CA C 115 55.735 55.735 55.378 0.357 18003
11301 1 18 . 1 1 114 114 ARG CB C 115 30.586 30.586 31.165 -0.579 18003
11302 1 18 . 1 1 114 114 ARG H H 115 8.016 8.016 7.866 0.150 18003
11303 1 18 . 1 1 115 115 HIS N N 116 120.597 120.597 120.039 0.558 18003
11304 1 18 . 1 1 115 115 HIS CA C 116 53.697 53.697 58.360 -4.663 18003
11305 1 18 . 1 1 115 115 HIS CB C 116 29.299 29.299 29.191 0.108 18003
11306 1 18 . 1 1 115 115 HIS H H 116 8.385 8.385 8.201 0.184 18003
11307 1 18 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.545 -0.063 18003
11308 1 18 . 1 1 116 116 PRO C C 117 177.090 177.090 176.101 0.989 18003
11309 1 18 . 1 1 116 116 PRO CA C 117 63.177 63.177 63.327 -0.150 18003
11310 1 18 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.086 -0.266 18003
11311 1 18 . 1 1 117 117 SER N N 118 116.220 116.220 118.816 -2.596 18003
11312 1 18 . 1 1 117 117 SER HA H 118 4.465 4.465 4.198 0.267 18003
11313 1 18 . 1 1 117 117 SER C C 118 174.287 174.287 174.714 -0.427 18003
11314 1 18 . 1 1 117 117 SER CA C 118 58.110 58.110 59.385 -1.275 18003
11315 1 18 . 1 1 117 117 SER CB C 118 63.750 63.750 63.108 0.642 18003
11316 1 18 . 1 1 117 117 SER H H 118 8.487 8.487 8.302 0.185 18003
11317 1 18 . 1 1 118 118 ALA N N 119 126.082 126.082 123.840 2.242 18003
11318 1 18 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.261 0.178 18003
11319 1 18 . 1 1 118 118 ALA C C 119 176.879 176.879 178.059 -1.180 18003
11320 1 18 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.645 -0.196 18003
11321 1 18 . 1 1 118 118 ALA CB C 119 19.483 19.483 17.027 2.456 18003
11322 1 18 . 1 1 118 118 ALA H H 119 8.295 8.295 8.441 -0.146 18003
11323 1 19 . 1 1 2 2 HIS C C 3 175.176 175.176 176.331 -1.155 18003
11324 1 19 . 1 1 2 2 HIS CA C 3 55.900 55.900 57.123 -1.223 18003
11325 1 19 . 1 1 2 2 HIS CB C 3 30.029 30.029 29.442 0.587 18003
11326 1 19 . 1 1 3 3 GLY N N 4 110.613 110.613 108.427 2.186 18003
11327 1 19 . 1 1 3 3 GLY C C 4 174.068 174.068 174.366 -0.298 18003
11328 1 19 . 1 1 3 3 GLY CA C 4 45.141 45.141 45.414 -0.273 18003
11329 1 19 . 1 1 3 3 GLY H H 4 8.500 8.500 8.623 -0.123 18003
11330 1 19 . 1 1 4 4 VAL N N 5 119.318 119.318 116.907 2.411 18003
11331 1 19 . 1 1 4 4 VAL HA H 5 4.128 4.128 4.093 0.035 18003
11332 1 19 . 1 1 4 4 VAL C C 5 176.361 176.361 176.281 0.080 18003
11333 1 19 . 1 1 4 4 VAL CA C 5 61.987 61.987 62.089 -0.102 18003
11334 1 19 . 1 1 4 4 VAL CB C 5 32.635 32.635 32.187 0.448 18003
11335 1 19 . 1 1 4 4 VAL H H 5 8.094 8.094 7.813 0.281 18003
11336 1 19 . 1 1 5 5 GLU N N 6 124.369 124.369 126.137 -1.768 18003
11337 1 19 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.482 -0.194 18003
11338 1 19 . 1 1 5 5 GLU C C 6 177.012 177.012 176.100 0.912 18003
11339 1 19 . 1 1 5 5 GLU CA C 6 56.699 56.699 55.887 0.812 18003
11340 1 19 . 1 1 5 5 GLU CB C 6 30.029 30.029 30.859 -0.830 18003
11341 1 19 . 1 1 5 5 GLU H H 6 8.545 8.545 8.504 0.041 18003
11342 1 19 . 1 1 6 6 GLY N N 7 109.747 109.747 107.150 2.597 18003
11343 1 19 . 1 1 6 6 GLY C C 7 174.117 174.117 174.053 0.064 18003
11344 1 19 . 1 1 6 6 GLY CA C 7 45.568 45.568 45.137 0.431 18003
11345 1 19 . 1 1 6 6 GLY H H 7 8.352 8.352 8.193 0.159 18003
11346 1 19 . 1 1 7 7 ARG N N 8 120.059 120.059 121.251 -1.192 18003
11347 1 19 . 1 1 7 7 ARG HA H 8 4.342 4.342 3.742 0.600 18003
11348 1 19 . 1 1 7 7 ARG C C 8 176.016 176.016 176.260 -0.244 18003
11349 1 19 . 1 1 7 7 ARG CA C 8 55.833 55.833 58.535 -2.702 18003
11350 1 19 . 1 1 7 7 ARG CB C 8 30.444 30.444 29.664 0.780 18003
11351 1 19 . 1 1 7 7 ARG H H 8 8.084 8.084 8.489 -0.405 18003
11352 1 19 . 1 1 8 8 ASN N N 9 119.379 119.379 116.960 2.419 18003
11353 1 19 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.367 -0.035 18003
11354 1 19 . 1 1 8 8 ASN C C 9 174.667 174.667 173.733 0.934 18003
11355 1 19 . 1 1 8 8 ASN CA C 9 53.441 53.441 54.161 -0.720 18003
11356 1 19 . 1 1 8 8 ASN CB C 9 38.480 38.480 38.491 -0.011 18003
11357 1 19 . 1 1 8 8 ASN H H 9 8.411 8.411 8.283 0.128 18003
11358 1 19 . 1 1 9 9 ARG N N 10 121.700 121.700 116.445 5.255 18003
11359 1 19 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.109 0.540 18003
11360 1 19 . 1 1 9 9 ARG CA C 10 53.147 53.147 55.788 -2.641 18003
11361 1 19 . 1 1 9 9 ARG CB C 10 30.197 30.197 28.179 2.018 18003
11362 1 19 . 1 1 9 9 ARG H H 10 8.138 8.138 8.573 -0.435 18003
11363 1 19 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.424 0.019 18003
11364 1 19 . 1 1 10 10 PRO C C 11 176.815 176.815 176.851 -0.036 18003
11365 1 19 . 1 1 10 10 PRO CA C 11 63.177 63.177 62.784 0.393 18003
11366 1 19 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.179 -0.359 18003
11367 1 19 . 1 1 11 11 SER N N 12 116.291 116.291 116.611 -0.320 18003
11368 1 19 . 1 1 11 11 SER HA H 12 4.418 4.418 4.196 0.222 18003
11369 1 19 . 1 1 11 11 SER C C 12 173.702 173.702 173.746 -0.044 18003
11370 1 19 . 1 1 11 11 SER CA C 12 58.031 58.031 59.073 -1.042 18003
11371 1 19 . 1 1 11 11 SER CB C 12 64.032 64.032 62.338 1.694 18003
11372 1 19 . 1 1 11 11 SER H H 12 8.325 8.325 8.476 -0.151 18003
11373 1 19 . 1 1 12 12 ALA N N 13 126.862 126.862 124.858 2.004 18003
11374 1 19 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.544 -0.156 18003
11375 1 19 . 1 1 12 12 ALA CA C 13 50.458 50.458 53.069 -2.611 18003
11376 1 19 . 1 1 12 12 ALA CB C 13 18.257 18.257 18.714 -0.457 18003
11377 1 19 . 1 1 12 12 ALA H H 13 8.166 8.166 8.675 -0.509 18003
11378 1 19 . 1 1 13 13 PRO C C 14 176.368 176.368 175.776 0.592 18003
11379 1 19 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.884 0.053 18003
11380 1 19 . 1 1 13 13 PRO CB C 14 32.022 32.022 29.807 2.215 18003
11381 1 19 . 1 1 14 14 LEU N N 15 120.969 120.969 121.327 -0.358 18003
11382 1 19 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.121 0.137 18003
11383 1 19 . 1 1 14 14 LEU C C 15 176.124 176.124 178.506 -2.382 18003
11384 1 19 . 1 1 14 14 LEU CA C 15 54.527 54.527 55.010 -0.483 18003
11385 1 19 . 1 1 14 14 LEU CB C 15 43.418 43.418 41.987 1.431 18003
11386 1 19 . 1 1 14 14 LEU H H 15 7.875 7.875 7.943 -0.068 18003
11387 1 19 . 1 1 15 15 ASP N N 16 121.780 121.780 122.865 -1.085 18003
11388 1 19 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.125 0.468 18003
11389 1 19 . 1 1 15 15 ASP C C 16 176.208 176.208 177.854 -1.646 18003
11390 1 19 . 1 1 15 15 ASP CA C 16 52.468 52.468 57.663 -5.195 18003
11391 1 19 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.637 0.992 18003
11392 1 19 . 1 1 15 15 ASP H H 16 7.850 7.850 8.899 -1.049 18003
11393 1 19 . 1 1 16 16 SER N N 17 114.435 114.435 114.154 0.281 18003
11394 1 19 . 1 1 16 16 SER HA H 17 4.120 4.120 4.028 0.092 18003
11395 1 19 . 1 1 16 16 SER C C 17 177.207 177.207 176.594 0.613 18003
11396 1 19 . 1 1 16 16 SER CA C 17 62.322 62.322 61.275 1.047 18003
11397 1 19 . 1 1 16 16 SER H H 17 8.658 8.658 8.182 0.476 18003
11398 1 19 . 1 1 17 17 GLN N N 18 122.403 122.403 121.846 0.557 18003
11399 1 19 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.034 0.163 18003
11400 1 19 . 1 1 17 17 GLN C C 18 178.715 178.715 177.928 0.787 18003
11401 1 19 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.633 -0.520 18003
11402 1 19 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.626 -0.586 18003
11403 1 19 . 1 1 17 17 GLN H H 18 8.140 8.140 8.529 -0.389 18003
11404 1 19 . 1 1 18 18 ALA N N 19 124.743 124.743 121.833 2.910 18003
11405 1 19 . 1 1 18 18 ALA HA H 19 4.176 4.176 3.996 0.180 18003
11406 1 19 . 1 1 18 18 ALA C C 19 180.616 180.616 179.487 1.129 18003
11407 1 19 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.838 -0.233 18003
11408 1 19 . 1 1 18 18 ALA CB C 19 19.028 19.028 17.931 1.097 18003
11409 1 19 . 1 1 18 18 ALA H H 19 8.455 8.455 7.529 0.926 18003
11410 1 19 . 1 1 19 19 ALA N N 20 119.089 119.089 121.135 -2.046 18003
11411 1 19 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.027 0.152 18003
11412 1 19 . 1 1 19 19 ALA C C 20 179.239 179.239 179.390 -0.151 18003
11413 1 19 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.976 0.295 18003
11414 1 19 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.303 -0.111 18003
11415 1 19 . 1 1 19 19 ALA H H 20 8.993 8.993 8.361 0.632 18003
11416 1 19 . 1 1 20 20 ALA N N 21 119.226 119.226 121.007 -1.781 18003
11417 1 19 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.948 0.112 18003
11418 1 19 . 1 1 20 20 ALA C C 21 180.230 180.230 179.683 0.547 18003
11419 1 19 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.047 0.097 18003
11420 1 19 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.081 -0.052 18003
11421 1 19 . 1 1 20 20 ALA H H 21 7.724 7.724 7.898 -0.174 18003
11422 1 19 . 1 1 21 21 GLN N N 22 119.310 119.310 118.991 0.319 18003
11423 1 19 . 1 1 21 21 GLN HA H 22 4.129 4.129 4.038 0.091 18003
11424 1 19 . 1 1 21 21 GLN C C 22 179.319 179.319 178.463 0.856 18003
11425 1 19 . 1 1 21 21 GLN CA C 22 58.762 58.762 59.065 -0.303 18003
11426 1 19 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.848 -0.819 18003
11427 1 19 . 1 1 21 21 GLN H H 22 7.638 7.638 8.369 -0.731 18003
11428 1 19 . 1 1 22 22 VAL N N 23 121.565 121.565 119.775 1.790 18003
11429 1 19 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.710 0.256 18003
11430 1 19 . 1 1 22 22 VAL C C 23 178.026 178.026 178.051 -0.025 18003
11431 1 19 . 1 1 22 22 VAL CA C 23 66.142 66.142 65.988 0.154 18003
11432 1 19 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.185 -0.219 18003
11433 1 19 . 1 1 22 22 VAL H H 23 8.442 8.442 8.021 0.421 18003
11434 1 19 . 1 1 23 23 ALA N N 24 121.400 121.400 122.203 -0.803 18003
11435 1 19 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.909 0.187 18003
11436 1 19 . 1 1 23 23 ALA C C 24 178.758 178.758 179.735 -0.977 18003
11437 1 19 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.491 0.424 18003
11438 1 19 . 1 1 23 23 ALA CB C 24 16.650 16.650 17.978 -1.328 18003
11439 1 19 . 1 1 23 23 ALA H H 24 8.495 8.495 8.539 -0.044 18003
11440 1 19 . 1 1 24 24 SER N N 25 112.138 112.138 113.770 -1.632 18003
11441 1 19 . 1 1 24 24 SER HA H 25 4.093 4.093 4.126 -0.033 18003
11442 1 19 . 1 1 24 24 SER C C 25 177.271 177.271 176.746 0.525 18003
11443 1 19 . 1 1 24 24 SER CA C 25 62.166 62.166 61.662 0.504 18003
11444 1 19 . 1 1 24 24 SER CB C 25 63.032 63.032 63.065 -0.032 18003
11445 1 19 . 1 1 24 24 SER H H 25 7.936 7.936 8.265 -0.329 18003
11446 1 19 . 1 1 25 25 THR N N 26 119.701 119.701 119.769 -0.068 18003
11447 1 19 . 1 1 25 25 THR HA H 26 4.380 4.380 3.951 0.429 18003
11448 1 19 . 1 1 25 25 THR C C 26 175.456 175.456 176.546 -1.090 18003
11449 1 19 . 1 1 25 25 THR CA C 26 67.129 67.129 67.024 0.105 18003
11450 1 19 . 1 1 25 25 THR CB C 26 68.800 68.800 68.868 -0.067 18003
11451 1 19 . 1 1 25 25 THR H H 26 7.775 7.775 7.616 0.159 18003
11452 1 19 . 1 1 26 26 LEU N N 27 119.270 119.270 120.069 -0.799 18003
11453 1 19 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.073 -0.510 18003
11454 1 19 . 1 1 26 26 LEU C C 27 178.390 178.390 178.834 -0.444 18003
11455 1 19 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.464 0.205 18003
11456 1 19 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.100 0.930 18003
11457 1 19 . 1 1 26 26 LEU H H 27 8.006 8.006 8.312 -0.306 18003
11458 1 19 . 1 1 27 27 GLN N N 28 115.843 115.843 119.676 -3.833 18003
11459 1 19 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.078 -0.274 18003
11460 1 19 . 1 1 27 27 GLN C C 28 178.657 178.657 177.901 0.756 18003
11461 1 19 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.616 0.096 18003
11462 1 19 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.886 -0.857 18003
11463 1 19 . 1 1 27 27 GLN H H 28 8.485 8.485 8.019 0.466 18003
11464 1 19 . 1 1 28 28 ALA N N 29 118.779 118.779 122.357 -3.578 18003
11465 1 19 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.041 -0.033 18003
11466 1 19 . 1 1 28 28 ALA C C 29 178.259 178.259 179.887 -1.628 18003
11467 1 19 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.751 -0.789 18003
11468 1 19 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.746 -0.008 18003
11469 1 19 . 1 1 28 28 ALA H H 29 7.432 7.432 8.027 -0.595 18003
11470 1 19 . 1 1 29 29 LEU N N 30 113.442 113.442 117.651 -4.209 18003
11471 1 19 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.949 0.047 18003
11472 1 19 . 1 1 29 29 LEU C C 30 175.924 175.924 177.475 -1.551 18003
11473 1 19 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.971 -1.407 18003
11474 1 19 . 1 1 29 29 LEU CB C 30 42.266 42.266 40.743 1.523 18003
11475 1 19 . 1 1 29 29 LEU H H 30 7.311 7.311 7.904 -0.593 18003
11476 1 19 . 1 1 30 30 ALA N N 31 119.563 119.563 118.855 0.708 18003
11477 1 19 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.127 0.045 18003
11478 1 19 . 1 1 30 30 ALA C C 31 176.316 176.316 176.478 -0.162 18003
11479 1 19 . 1 1 30 30 ALA CA C 31 51.656 51.656 52.880 -1.224 18003
11480 1 19 . 1 1 30 30 ALA CB C 31 18.077 18.077 19.378 -1.300 18003
11481 1 19 . 1 1 30 30 ALA H H 31 7.223 7.223 7.057 0.166 18003
11482 1 19 . 1 1 31 31 THR N N 32 114.613 114.613 111.026 3.587 18003
11483 1 19 . 1 1 31 31 THR HA H 32 4.950 4.950 4.114 0.836 18003
11484 1 19 . 1 1 31 31 THR CA C 32 58.129 58.129 61.713 -3.584 18003
11485 1 19 . 1 1 31 31 THR CB C 32 69.098 69.098 68.458 0.640 18003
11486 1 19 . 1 1 31 31 THR H H 32 8.399 8.399 8.258 0.141 18003
11487 1 19 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.143 0.295 18003
11488 1 19 . 1 1 32 32 PRO C C 33 178.207 178.207 178.543 -0.336 18003
11489 1 19 . 1 1 32 32 PRO CA C 33 66.905 66.905 66.136 0.769 18003
11490 1 19 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.454 -0.190 18003
11491 1 19 . 1 1 33 33 SER N N 34 110.767 110.767 113.459 -2.692 18003
11492 1 19 . 1 1 33 33 SER HA H 34 4.026 4.026 4.131 -0.105 18003
11493 1 19 . 1 1 33 33 SER C C 34 176.742 176.742 176.672 0.070 18003
11494 1 19 . 1 1 33 33 SER CA C 34 61.782 61.782 61.907 -0.125 18003
11495 1 19 . 1 1 33 33 SER CB C 34 62.432 62.432 62.634 -0.202 18003
11496 1 19 . 1 1 33 33 SER H H 34 8.407 8.407 8.450 -0.043 18003
11497 1 19 . 1 1 34 34 ARG N N 35 120.135 120.135 121.586 -1.451 18003
11498 1 19 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.080 -0.026 18003
11499 1 19 . 1 1 34 34 ARG C C 35 178.283 178.283 178.568 -0.285 18003
11500 1 19 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.951 1.581 18003
11501 1 19 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.867 -0.914 18003
11502 1 19 . 1 1 34 34 ARG H H 35 7.341 7.341 7.544 -0.203 18003
11503 1 19 . 1 1 35 35 LEU N N 36 118.454 118.454 122.984 -4.530 18003
11504 1 19 . 1 1 35 35 LEU HA H 36 4.054 4.054 4.096 -0.042 18003
11505 1 19 . 1 1 35 35 LEU C C 36 180.643 180.643 178.886 1.757 18003
11506 1 19 . 1 1 35 35 LEU CA C 36 57.809 57.809 57.896 -0.087 18003
11507 1 19 . 1 1 35 35 LEU CB C 36 41.778 41.778 41.425 0.353 18003
11508 1 19 . 1 1 35 35 LEU H H 36 8.226 8.226 8.645 -0.419 18003
11509 1 19 . 1 1 36 36 MET N N 37 121.073 121.073 119.008 2.065 18003
11510 1 19 . 1 1 36 36 MET HA H 37 3.928 3.928 4.063 -0.135 18003
11511 1 19 . 1 1 36 36 MET C C 37 177.671 177.671 178.642 -0.971 18003
11512 1 19 . 1 1 36 36 MET CA C 37 60.613 60.613 59.521 1.092 18003
11513 1 19 . 1 1 36 36 MET CB C 37 33.128 33.128 32.667 0.461 18003
11514 1 19 . 1 1 36 36 MET H H 37 8.447 8.447 8.281 0.166 18003
11515 1 19 . 1 1 37 37 ILE N N 38 118.239 118.239 120.357 -2.118 18003
11516 1 19 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.601 -0.161 18003
11517 1 19 . 1 1 37 37 ILE C C 38 177.092 177.092 178.261 -1.169 18003
11518 1 19 . 1 1 37 37 ILE CA C 38 65.675 65.675 65.575 0.100 18003
11519 1 19 . 1 1 37 37 ILE CB C 38 38.255 38.255 37.824 0.431 18003
11520 1 19 . 1 1 37 37 ILE H H 38 7.763 7.763 7.967 -0.204 18003
11521 1 19 . 1 1 38 38 LEU N N 39 116.073 116.073 120.034 -3.961 18003
11522 1 19 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.894 -0.068 18003
11523 1 19 . 1 1 38 38 LEU C C 39 178.941 178.941 179.043 -0.102 18003
11524 1 19 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.312 -0.281 18003
11525 1 19 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.525 0.255 18003
11526 1 19 . 1 1 38 38 LEU H H 39 8.538 8.538 8.602 -0.064 18003
11527 1 19 . 1 1 39 39 THR N N 40 106.678 106.678 115.419 -8.741 18003
11528 1 19 . 1 1 39 39 THR HA H 40 3.932 3.932 3.872 0.060 18003
11529 1 19 . 1 1 39 39 THR C C 40 177.747 177.747 176.530 1.217 18003
11530 1 19 . 1 1 39 39 THR CA C 40 65.536 65.536 66.990 -1.454 18003
11531 1 19 . 1 1 39 39 THR CB C 40 68.360 68.360 68.256 0.104 18003
11532 1 19 . 1 1 39 39 THR H H 40 8.086 8.086 8.237 -0.151 18003
11533 1 19 . 1 1 40 40 GLN N N 41 122.344 122.344 121.866 0.478 18003
11534 1 19 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.032 -0.026 18003
11535 1 19 . 1 1 40 40 GLN C C 41 178.348 178.348 177.982 0.366 18003
11536 1 19 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.723 -0.798 18003
11537 1 19 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.109 -0.589 18003
11538 1 19 . 1 1 40 40 GLN H H 41 7.593 7.593 7.772 -0.179 18003
11539 1 19 . 1 1 41 41 LEU N N 42 116.302 116.302 118.545 -2.243 18003
11540 1 19 . 1 1 41 41 LEU C C 42 178.418 178.418 179.961 -1.543 18003
11541 1 19 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.290 -1.759 18003
11542 1 19 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.751 -0.402 18003
11543 1 19 . 1 1 41 41 LEU H H 42 7.570 7.570 7.793 -0.223 18003
11544 1 19 . 1 1 42 42 ARG N N 43 119.954 119.954 119.882 0.072 18003
11545 1 19 . 1 1 42 42 ARG HA H 43 3.915 3.915 4.059 -0.144 18003
11546 1 19 . 1 1 42 42 ARG C C 43 177.205 177.205 176.926 0.279 18003
11547 1 19 . 1 1 42 42 ARG CA C 43 58.704 58.704 58.994 -0.290 18003
11548 1 19 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.787 -1.344 18003
11549 1 19 . 1 1 42 42 ARG H H 43 7.612 7.612 8.127 -0.515 18003
11550 1 19 . 1 1 43 43 ASN N N 44 114.682 114.682 117.351 -2.669 18003
11551 1 19 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.825 -0.065 18003
11552 1 19 . 1 1 43 43 ASN C C 44 174.507 174.507 173.700 0.807 18003
11553 1 19 . 1 1 43 43 ASN CA C 44 53.953 53.953 52.817 1.136 18003
11554 1 19 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.591 -0.561 18003
11555 1 19 . 1 1 43 43 ASN H H 44 7.567 7.567 7.922 -0.355 18003
11556 1 19 . 1 1 44 44 GLY N N 45 109.113 109.113 109.452 -0.339 18003
11557 1 19 . 1 1 44 44 GLY CA C 45 44.268 44.268 45.310 -1.042 18003
11558 1 19 . 1 1 44 44 GLY H H 45 7.361 7.361 7.515 -0.154 18003
11559 1 19 . 1 1 45 45 PRO C C 46 178.412 178.412 175.793 2.619 18003
11560 1 19 . 1 1 45 45 PRO CA C 46 62.580 62.580 62.386 0.194 18003
11561 1 19 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.544 1.585 18003
11562 1 19 . 1 1 46 46 LEU N N 47 120.363 120.363 123.082 -2.719 18003
11563 1 19 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.829 0.202 18003
11564 1 19 . 1 1 46 46 LEU CA C 47 52.550 52.550 51.127 1.423 18003
11565 1 19 . 1 1 46 46 LEU CB C 47 48.210 48.210 42.216 5.994 18003
11566 1 19 . 1 1 46 46 LEU H H 47 8.252 8.252 7.644 0.608 18003
11567 1 19 . 1 1 47 47 PRO C C 48 177.313 177.313 178.033 -0.720 18003
11568 1 19 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.690 -0.855 18003
11569 1 19 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.571 -0.188 18003
11570 1 19 . 1 1 48 48 VAL N N 49 119.384 119.384 115.703 3.681 18003
11571 1 19 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.741 -0.134 18003
11572 1 19 . 1 1 48 48 VAL C C 49 176.710 176.710 177.614 -0.904 18003
11573 1 19 . 1 1 48 48 VAL CA C 49 66.188 66.188 66.255 -0.067 18003
11574 1 19 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.556 0.025 18003
11575 1 19 . 1 1 48 48 VAL H H 49 9.074 9.074 8.581 0.493 18003
11576 1 19 . 1 1 49 49 THR N N 50 111.293 111.293 113.766 -2.473 18003
11577 1 19 . 1 1 49 49 THR HA H 50 4.181 4.181 3.926 0.255 18003
11578 1 19 . 1 1 49 49 THR C C 50 176.717 176.717 176.140 0.577 18003
11579 1 19 . 1 1 49 49 THR CA C 50 65.063 65.063 66.746 -1.683 18003
11580 1 19 . 1 1 49 49 THR CB C 50 68.032 68.032 68.363 -0.331 18003
11581 1 19 . 1 1 49 49 THR H H 50 7.848 7.848 8.058 -0.210 18003
11582 1 19 . 1 1 50 50 ASP N N 51 120.138 120.138 120.864 -0.726 18003
11583 1 19 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.415 -0.210 18003
11584 1 19 . 1 1 50 50 ASP C C 51 174.723 174.723 178.415 -3.692 18003
11585 1 19 . 1 1 50 50 ASP CA C 51 56.781 56.781 56.822 -0.042 18003
11586 1 19 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.222 0.889 18003
11587 1 19 . 1 1 50 50 ASP H H 51 7.108 7.108 8.560 -1.452 18003
11588 1 19 . 1 1 51 51 LEU N N 52 121.089 121.089 120.687 0.402 18003
11589 1 19 . 1 1 51 51 LEU HA H 52 3.985 3.985 4.043 -0.058 18003
11590 1 19 . 1 1 51 51 LEU C C 52 177.089 177.089 178.092 -1.003 18003
11591 1 19 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.869 0.292 18003
11592 1 19 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.704 0.076 18003
11593 1 19 . 1 1 51 51 LEU H H 52 7.943 7.943 7.764 0.179 18003
11594 1 19 . 1 1 52 52 ALA N N 53 119.237 119.237 121.026 -1.789 18003
11595 1 19 . 1 1 52 52 ALA HA H 53 3.872 3.872 4.067 -0.195 18003
11596 1 19 . 1 1 52 52 ALA C C 53 179.466 179.466 180.158 -0.692 18003
11597 1 19 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.046 0.617 18003
11598 1 19 . 1 1 52 52 ALA CB C 53 17.619 17.619 17.845 -0.226 18003
11599 1 19 . 1 1 52 52 ALA H H 53 8.480 8.480 8.163 0.317 18003
11600 1 19 . 1 1 53 53 GLU N N 54 115.655 115.655 119.611 -3.956 18003
11601 1 19 . 1 1 53 53 GLU HA H 54 4.054 4.054 4.051 0.003 18003
11602 1 19 . 1 1 53 53 GLU C C 54 179.073 179.073 178.244 0.829 18003
11603 1 19 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.735 0.092 18003
11604 1 19 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.670 -0.270 18003
11605 1 19 . 1 1 53 53 GLU H H 54 7.705 7.705 8.065 -0.360 18003
11606 1 19 . 1 1 54 54 ALA N N 55 120.276 120.276 121.413 -1.137 18003
11607 1 19 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.208 -0.071 18003
11608 1 19 . 1 1 54 54 ALA C C 55 179.771 179.771 177.814 1.957 18003
11609 1 19 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.221 0.440 18003
11610 1 19 . 1 1 54 54 ALA CB C 55 18.235 18.235 20.260 -2.025 18003
11611 1 19 . 1 1 54 54 ALA H H 55 7.928 7.928 7.769 0.159 18003
11612 1 19 . 1 1 55 55 ILE N N 56 107.195 107.195 116.239 -9.044 18003
11613 1 19 . 1 1 55 55 ILE C C 56 176.053 176.053 173.711 2.342 18003
11614 1 19 . 1 1 55 55 ILE CA C 56 60.551 60.551 61.511 -0.960 18003
11615 1 19 . 1 1 55 55 ILE CB C 56 38.497 38.497 37.980 0.517 18003
11616 1 19 . 1 1 55 55 ILE H H 56 7.507 7.507 8.226 -0.719 18003
11617 1 19 . 1 1 56 56 GLY N N 57 111.108 111.108 112.683 -1.575 18003
11618 1 19 . 1 1 56 56 GLY C C 57 174.421 174.421 174.335 0.086 18003
11619 1 19 . 1 1 56 56 GLY CA C 57 46.960 46.960 46.203 0.757 18003
11620 1 19 . 1 1 56 56 GLY H H 57 7.757 7.757 8.002 -0.245 18003
11621 1 19 . 1 1 57 57 MET N N 58 118.089 118.089 118.620 -0.531 18003
11622 1 19 . 1 1 57 57 MET HA H 58 3.933 3.933 3.993 -0.060 18003
11623 1 19 . 1 1 57 57 MET C C 58 174.157 174.157 174.839 -0.682 18003
11624 1 19 . 1 1 57 57 MET CA C 58 54.091 54.091 56.867 -2.776 18003
11625 1 19 . 1 1 57 57 MET CB C 58 38.062 38.062 31.308 6.754 18003
11626 1 19 . 1 1 57 57 MET H H 58 7.659 7.659 7.757 -0.098 18003
11627 1 19 . 1 1 58 58 GLU N N 59 121.656 121.656 115.122 6.534 18003
11628 1 19 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.470 -0.130 18003
11629 1 19 . 1 1 58 58 GLU C C 59 178.355 178.355 176.891 1.464 18003
11630 1 19 . 1 1 58 58 GLU CA C 59 56.643 56.643 55.524 1.119 18003
11631 1 19 . 1 1 58 58 GLU CB C 59 30.029 30.029 29.362 0.667 18003
11632 1 19 . 1 1 58 58 GLU H H 59 8.523 8.523 8.203 0.320 18003
11633 1 19 . 1 1 59 59 GLN N N 60 123.686 123.686 121.029 2.657 18003
11634 1 19 . 1 1 59 59 GLN HA H 60 4.214 4.214 3.862 0.352 18003
11635 1 19 . 1 1 59 59 GLN C C 60 177.961 177.961 177.260 0.701 18003
11636 1 19 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.662 1.954 18003
11637 1 19 . 1 1 59 59 GLN CB C 60 29.015 29.015 27.740 1.275 18003
11638 1 19 . 1 1 59 59 GLN H H 60 9.009 9.009 8.698 0.311 18003
11639 1 19 . 1 1 60 60 SER N N 61 115.101 115.101 114.939 0.162 18003
11640 1 19 . 1 1 60 60 SER C C 61 176.801 176.801 175.687 1.114 18003
11641 1 19 . 1 1 60 60 SER CA C 61 61.213 61.213 60.149 1.064 18003
11642 1 19 . 1 1 60 60 SER H H 61 8.964 8.964 8.144 0.820 18003
11643 1 19 . 1 1 61 61 ALA N N 62 126.069 126.069 123.735 2.334 18003
11644 1 19 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.370 -0.019 18003
11645 1 19 . 1 1 61 61 ALA C C 62 180.635 180.635 179.399 1.236 18003
11646 1 19 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.425 -0.167 18003
11647 1 19 . 1 1 61 61 ALA CB C 62 18.623 18.623 19.154 -0.531 18003
11648 1 19 . 1 1 61 61 ALA H H 62 7.103 7.103 8.174 -1.071 18003
11649 1 19 . 1 1 62 62 VAL N N 63 119.252 119.252 119.564 -0.312 18003
11650 1 19 . 1 1 62 62 VAL C C 63 177.842 177.842 178.290 -0.448 18003
11651 1 19 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.289 0.509 18003
11652 1 19 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.642 -0.378 18003
11653 1 19 . 1 1 62 62 VAL H H 63 7.971 7.971 7.535 0.436 18003
11654 1 19 . 1 1 63 63 SER N N 64 115.494 115.494 116.080 -0.586 18003
11655 1 19 . 1 1 63 63 SER HA H 64 4.034 4.034 3.900 0.134 18003
11656 1 19 . 1 1 63 63 SER C C 64 176.835 176.835 176.989 -0.154 18003
11657 1 19 . 1 1 63 63 SER CA C 64 62.400 62.400 62.279 0.121 18003
11658 1 19 . 1 1 63 63 SER CB C 64 62.752 62.752 62.580 0.172 18003
11659 1 19 . 1 1 63 63 SER H H 64 8.743 8.743 8.038 0.705 18003
11660 1 19 . 1 1 64 64 HIS N N 65 120.010 120.010 121.233 -1.223 18003
11661 1 19 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.236 0.124 18003
11662 1 19 . 1 1 64 64 HIS C C 65 177.731 177.731 177.953 -0.222 18003
11663 1 19 . 1 1 64 64 HIS CA C 65 59.998 59.998 59.903 0.095 18003
11664 1 19 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.694 0.240 18003
11665 1 19 . 1 1 64 64 HIS H H 65 7.804 7.804 7.849 -0.045 18003
11666 1 19 . 1 1 65 65 GLN N N 66 115.590 115.590 119.227 -3.637 18003
11667 1 19 . 1 1 65 65 GLN HA H 66 4.035 4.035 3.997 0.038 18003
11668 1 19 . 1 1 65 65 GLN C C 66 179.055 179.055 178.402 0.653 18003
11669 1 19 . 1 1 65 65 GLN CA C 66 57.530 57.530 59.007 -1.477 18003
11670 1 19 . 1 1 65 65 GLN H H 66 7.751 7.751 8.294 -0.543 18003
11671 1 19 . 1 1 66 66 LEU N N 67 118.746 118.746 121.395 -2.649 18003
11672 1 19 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.912 0.035 18003
11673 1 19 . 1 1 66 66 LEU C C 67 178.334 178.334 178.636 -0.302 18003
11674 1 19 . 1 1 66 66 LEU CA C 67 57.846 57.846 58.175 -0.329 18003
11675 1 19 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.773 -0.670 18003
11676 1 19 . 1 1 66 66 LEU H H 67 8.648 8.648 8.575 0.073 18003
11677 1 19 . 1 1 67 67 ARG N N 68 119.610 119.610 118.265 1.345 18003
11678 1 19 . 1 1 67 67 ARG HA H 68 3.943 3.943 4.000 -0.057 18003
11679 1 19 . 1 1 67 67 ARG C C 68 178.807 178.807 178.928 -0.121 18003
11680 1 19 . 1 1 67 67 ARG CA C 68 59.377 59.377 58.861 0.516 18003
11681 1 19 . 1 1 67 67 ARG CB C 68 29.475 29.475 29.611 -0.136 18003
11682 1 19 . 1 1 67 67 ARG H H 68 7.607 7.607 8.111 -0.504 18003
11683 1 19 . 1 1 68 68 VAL N N 69 119.719 119.719 120.503 -0.784 18003
11684 1 19 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.729 -0.096 18003
11685 1 19 . 1 1 68 68 VAL C C 69 178.690 178.690 178.193 0.497 18003
11686 1 19 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.623 -0.169 18003
11687 1 19 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.487 0.292 18003
11688 1 19 . 1 1 68 68 VAL H H 69 7.259 7.259 7.876 -0.617 18003
11689 1 19 . 1 1 69 69 LEU N N 70 117.532 117.532 118.972 -1.440 18003
11690 1 19 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.911 0.037 18003
11691 1 19 . 1 1 69 69 LEU C C 70 179.144 179.144 178.930 0.214 18003
11692 1 19 . 1 1 69 69 LEU CA C 70 57.750 57.750 57.973 -0.223 18003
11693 1 19 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.294 0.566 18003
11694 1 19 . 1 1 69 69 LEU H H 70 8.375 8.375 8.285 0.090 18003
11695 1 19 . 1 1 70 70 ARG N N 71 122.498 122.498 119.928 2.570 18003
11696 1 19 . 1 1 70 70 ARG HA H 71 3.931 3.931 3.993 -0.062 18003
11697 1 19 . 1 1 70 70 ARG C C 71 180.499 180.499 178.796 1.703 18003
11698 1 19 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.565 -0.787 18003
11699 1 19 . 1 1 70 70 ARG CB C 71 30.155 30.155 30.043 0.112 18003
11700 1 19 . 1 1 70 70 ARG H H 71 8.822 8.822 8.536 0.286 18003
11701 1 19 . 1 1 71 71 ASN N N 72 121.816 121.816 118.152 3.664 18003
11702 1 19 . 1 1 71 71 ASN C C 72 177.170 177.170 177.479 -0.309 18003
11703 1 19 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.638 0.139 18003
11704 1 19 . 1 1 71 71 ASN CB C 72 37.734 37.734 37.924 -0.190 18003
11705 1 19 . 1 1 71 71 ASN H H 72 8.144 8.144 7.857 0.287 18003
11706 1 19 . 1 1 72 72 LEU N N 73 117.044 117.044 118.654 -1.610 18003
11707 1 19 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.291 0.054 18003
11708 1 19 . 1 1 72 72 LEU C C 73 176.984 176.984 177.804 -0.820 18003
11709 1 19 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.377 -1.252 18003
11710 1 19 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.426 0.843 18003
11711 1 19 . 1 1 72 72 LEU H H 73 7.804 7.804 7.615 0.189 18003
11712 1 19 . 1 1 73 73 GLY N N 74 106.621 106.621 107.020 -0.399 18003
11713 1 19 . 1 1 73 73 GLY C C 74 173.266 173.266 173.301 -0.035 18003
11714 1 19 . 1 1 73 73 GLY CA C 74 46.022 46.022 45.081 0.941 18003
11715 1 19 . 1 1 73 73 GLY H H 74 7.851 7.851 8.345 -0.494 18003
11716 1 19 . 1 1 74 74 LEU N N 75 114.582 114.582 121.984 -7.402 18003
11717 1 19 . 1 1 74 74 LEU C C 75 177.562 177.562 174.785 2.777 18003
11718 1 19 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.655 0.376 18003
11719 1 19 . 1 1 74 74 LEU CB C 75 44.444 44.444 44.273 0.171 18003
11720 1 19 . 1 1 74 74 LEU H H 75 7.808 7.808 8.186 -0.378 18003
11721 1 19 . 1 1 75 75 VAL N N 76 110.980 110.980 114.393 -3.413 18003
11722 1 19 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.716 -0.189 18003
11723 1 19 . 1 1 75 75 VAL C C 76 173.922 173.922 173.797 0.125 18003
11724 1 19 . 1 1 75 75 VAL CA C 76 57.943 57.943 59.780 -1.837 18003
11725 1 19 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.386 0.643 18003
11726 1 19 . 1 1 75 75 VAL H H 76 7.079 7.079 7.433 -0.354 18003
11727 1 19 . 1 1 76 76 VAL N N 77 118.619 118.619 119.933 -1.314 18003
11728 1 19 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.428 0.874 18003
11729 1 19 . 1 1 76 76 VAL C C 77 174.041 174.041 174.200 -0.159 18003
11730 1 19 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.769 -0.770 18003
11731 1 19 . 1 1 76 76 VAL H H 77 9.024 9.024 9.108 -0.084 18003
11732 1 19 . 1 1 77 77 GLY N N 78 109.451 109.451 109.664 -0.213 18003
11733 1 19 . 1 1 77 77 GLY C C 78 172.225 172.225 172.740 -0.515 18003
11734 1 19 . 1 1 77 77 GLY CA C 78 44.462 44.462 44.341 0.121 18003
11735 1 19 . 1 1 77 77 GLY H H 78 8.265 8.265 8.320 -0.055 18003
11736 1 19 . 1 1 78 78 ASP N N 79 122.826 122.826 123.109 -0.283 18003
11737 1 19 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.988 -0.242 18003
11738 1 19 . 1 1 78 78 ASP C C 79 174.817 174.817 175.216 -0.399 18003
11739 1 19 . 1 1 78 78 ASP CA C 79 53.111 53.111 52.969 0.142 18003
11740 1 19 . 1 1 78 78 ASP CB C 79 43.655 43.655 44.116 -0.461 18003
11741 1 19 . 1 1 78 78 ASP H H 79 8.479 8.479 8.613 -0.134 18003
11742 1 19 . 1 1 79 79 ARG N N 80 122.613 122.613 120.640 1.973 18003
11743 1 19 . 1 1 79 79 ARG HA H 80 4.412 4.412 5.037 -0.625 18003
11744 1 19 . 1 1 79 79 ARG C C 80 175.546 175.546 174.670 0.876 18003
11745 1 19 . 1 1 79 79 ARG CA C 80 56.318 56.318 54.818 1.500 18003
11746 1 19 . 1 1 79 79 ARG CB C 80 30.376 30.376 32.371 -1.995 18003
11747 1 19 . 1 1 79 79 ARG H H 80 8.580 8.580 8.442 0.138 18003
11748 1 19 . 1 1 80 80 ALA N N 81 129.263 129.263 126.310 2.953 18003
11749 1 19 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.551 -0.099 18003
11750 1 19 . 1 1 80 80 ALA C C 81 177.126 177.126 177.331 -0.205 18003
11751 1 19 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.417 0.203 18003
11752 1 19 . 1 1 80 80 ALA CB C 81 19.260 19.260 20.468 -1.208 18003
11753 1 19 . 1 1 80 80 ALA H H 81 8.396 8.396 8.044 0.352 18003
11754 1 19 . 1 1 81 81 GLY N N 82 112.739 112.739 108.808 3.931 18003
11755 1 19 . 1 1 81 81 GLY C C 82 174.856 174.856 175.672 -0.816 18003
11756 1 19 . 1 1 81 81 GLY CA C 82 46.392 46.392 46.463 -0.071 18003
11757 1 19 . 1 1 81 81 GLY H H 82 8.641 8.641 8.626 0.015 18003
11758 1 19 . 1 1 82 82 ARG N N 83 124.780 124.780 118.589 6.191 18003
11759 1 19 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.363 -0.040 18003
11760 1 19 . 1 1 82 82 ARG C C 83 176.339 176.339 176.065 0.274 18003
11761 1 19 . 1 1 82 82 ARG CA C 83 56.690 56.690 57.232 -0.542 18003
11762 1 19 . 1 1 82 82 ARG CB C 83 30.221 30.221 30.726 -0.505 18003
11763 1 19 . 1 1 82 82 ARG H H 83 8.728 8.728 8.259 0.469 18003
11764 1 19 . 1 1 83 83 SER N N 84 114.678 114.678 109.550 5.128 18003
11765 1 19 . 1 1 83 83 SER C C 84 172.869 172.869 172.210 0.659 18003
11766 1 19 . 1 1 83 83 SER CA C 84 56.834 56.834 57.632 -0.798 18003
11767 1 19 . 1 1 83 83 SER CB C 84 65.191 65.191 65.177 0.014 18003
11768 1 19 . 1 1 83 83 SER H H 84 7.821 7.821 7.338 0.483 18003
11769 1 19 . 1 1 84 84 ILE N N 85 122.996 122.996 118.008 4.988 18003
11770 1 19 . 1 1 84 84 ILE C C 85 175.521 175.521 174.405 1.116 18003
11771 1 19 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.284 0.951 18003
11772 1 19 . 1 1 84 84 ILE CB C 85 38.136 38.136 40.820 -2.684 18003
11773 1 19 . 1 1 84 84 ILE H H 85 8.232 8.232 8.188 0.044 18003
11774 1 19 . 1 1 85 85 VAL N N 86 121.845 121.845 123.349 -1.504 18003
11775 1 19 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.303 0.007 18003
11776 1 19 . 1 1 85 85 VAL C C 86 174.818 174.818 174.244 0.574 18003
11777 1 19 . 1 1 85 85 VAL CA C 86 59.738 59.738 60.877 -1.139 18003
11778 1 19 . 1 1 85 85 VAL CB C 86 34.221 34.221 35.978 -1.757 18003
11779 1 19 . 1 1 85 85 VAL H H 86 8.495 8.495 8.743 -0.248 18003
11780 1 19 . 1 1 86 86 TYR N N 87 125.020 125.020 126.280 -1.260 18003
11781 1 19 . 1 1 86 86 TYR HA H 87 4.319 4.319 4.800 -0.481 18003
11782 1 19 . 1 1 86 86 TYR C C 87 173.808 173.808 175.217 -1.409 18003
11783 1 19 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.718 -0.253 18003
11784 1 19 . 1 1 86 86 TYR CB C 87 41.480 41.480 39.813 1.667 18003
11785 1 19 . 1 1 86 86 TYR H H 87 8.488 8.488 8.736 -0.248 18003
11786 1 19 . 1 1 87 87 SER N N 88 110.681 110.681 114.833 -4.152 18003
11787 1 19 . 1 1 87 87 SER HA H 88 5.414 5.414 4.922 0.492 18003
11788 1 19 . 1 1 87 87 SER C C 88 174.693 174.693 172.908 1.785 18003
11789 1 19 . 1 1 87 87 SER CA C 88 56.113 56.113 55.938 0.175 18003
11790 1 19 . 1 1 87 87 SER CB C 88 66.309 66.309 65.281 1.028 18003
11791 1 19 . 1 1 87 87 SER H H 88 8.718 8.718 9.096 -0.378 18003
11792 1 19 . 1 1 88 88 LEU N N 89 119.612 119.612 123.527 -3.915 18003
11793 1 19 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.228 0.699 18003
11794 1 19 . 1 1 88 88 LEU C C 89 179.031 179.031 177.491 1.540 18003
11795 1 19 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.592 -0.267 18003
11796 1 19 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.467 -0.747 18003
11797 1 19 . 1 1 88 88 LEU H H 89 9.034 9.034 8.587 0.447 18003
11798 1 19 . 1 1 89 89 TYR N N 90 120.540 120.540 123.264 -2.724 18003
11799 1 19 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.179 0.443 18003
11800 1 19 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.824 0.888 18003
11801 1 19 . 1 1 89 89 TYR H H 90 8.075 8.075 8.345 -0.271 18003
11802 1 19 . 1 1 92 92 HIS C C 93 177.850 177.850 177.046 0.804 18003
11803 1 19 . 1 1 93 93 VAL N N 94 120.211 120.211 114.911 5.300 18003
11804 1 19 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.563 -0.062 18003
11805 1 19 . 1 1 93 93 VAL C C 94 176.785 176.785 177.124 -0.339 18003
11806 1 19 . 1 1 93 93 VAL CA C 94 66.666 66.666 65.057 1.609 18003
11807 1 19 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.181 0.456 18003
11808 1 19 . 1 1 93 93 VAL H H 94 8.164 8.164 8.117 0.047 18003
11809 1 19 . 1 1 94 94 ALA N N 95 119.221 119.221 122.918 -3.697 18003
11810 1 19 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.914 -0.124 18003
11811 1 19 . 1 1 94 94 ALA C C 95 177.979 177.979 179.807 -1.828 18003
11812 1 19 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.264 0.215 18003
11813 1 19 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.049 0.061 18003
11814 1 19 . 1 1 94 94 ALA H H 95 6.942 6.942 8.232 -1.290 18003
11815 1 19 . 1 1 95 95 GLN N N 96 115.416 115.416 117.855 -2.439 18003
11816 1 19 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.028 0.007 18003
11817 1 19 . 1 1 95 95 GLN C C 96 177.993 177.993 178.617 -0.624 18003
11818 1 19 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.471 0.371 18003
11819 1 19 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.453 -0.425 18003
11820 1 19 . 1 1 95 95 GLN H H 96 7.795 7.795 8.409 -0.614 18003
11821 1 19 . 1 1 96 96 LEU N N 97 120.758 120.758 121.924 -1.166 18003
11822 1 19 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.017 -0.168 18003
11823 1 19 . 1 1 96 96 LEU C C 97 177.974 177.974 178.706 -0.732 18003
11824 1 19 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.143 1.139 18003
11825 1 19 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.864 -0.818 18003
11826 1 19 . 1 1 96 96 LEU H H 97 8.197 8.197 8.006 0.191 18003
11827 1 19 . 1 1 97 97 LEU N N 98 117.567 117.567 118.958 -1.391 18003
11828 1 19 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.827 0.003 18003
11829 1 19 . 1 1 97 97 LEU C C 98 178.219 178.219 178.872 -0.653 18003
11830 1 19 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.350 -0.620 18003
11831 1 19 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.173 0.689 18003
11832 1 19 . 1 1 97 97 LEU H H 98 7.660 7.660 8.682 -1.022 18003
11833 1 19 . 1 1 98 98 ASP N N 99 118.607 118.607 119.600 -0.993 18003
11834 1 19 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.343 -0.234 18003
11835 1 19 . 1 1 98 98 ASP C C 99 179.382 179.382 178.588 0.794 18003
11836 1 19 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.647 0.388 18003
11837 1 19 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.328 -0.488 18003
11838 1 19 . 1 1 98 98 ASP H H 99 8.295 8.295 8.214 0.081 18003
11839 1 19 . 1 1 99 99 GLU N N 100 117.542 117.542 119.380 -1.838 18003
11840 1 19 . 1 1 99 99 GLU HA H 100 3.849 3.849 3.654 0.195 18003
11841 1 19 . 1 1 99 99 GLU C C 100 179.389 179.389 178.600 0.789 18003
11842 1 19 . 1 1 99 99 GLU CA C 100 58.023 58.023 58.912 -0.889 18003
11843 1 19 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.140 -0.111 18003
11844 1 19 . 1 1 99 99 GLU H H 100 8.334 8.334 7.938 0.396 18003
11845 1 19 . 1 1 100 100 ALA N N 101 122.890 122.890 123.311 -0.421 18003
11846 1 19 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.089 -0.091 18003
11847 1 19 . 1 1 100 100 ALA C C 101 180.184 180.184 179.866 0.318 18003
11848 1 19 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.077 0.443 18003
11849 1 19 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.506 -0.888 18003
11850 1 19 . 1 1 100 100 ALA H H 101 8.550 8.550 7.980 0.570 18003
11851 1 19 . 1 1 101 101 ILE N N 102 119.952 119.952 119.417 0.535 18003
11852 1 19 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.737 -0.148 18003
11853 1 19 . 1 1 101 101 ILE C C 102 178.114 178.114 178.351 -0.237 18003
11854 1 19 . 1 1 101 101 ILE CA C 102 65.376 65.376 65.338 0.038 18003
11855 1 19 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.166 0.863 18003
11856 1 19 . 1 1 101 101 ILE H H 102 8.493 8.493 8.671 -0.178 18003
11857 1 19 . 1 1 102 102 TYR N N 103 120.625 120.625 119.827 0.798 18003
11858 1 19 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.284 -0.113 18003
11859 1 19 . 1 1 102 102 TYR C C 103 179.772 179.772 179.264 0.508 18003
11860 1 19 . 1 1 102 102 TYR CA C 103 60.724 60.724 61.400 -0.676 18003
11861 1 19 . 1 1 102 102 TYR CB C 103 37.500 37.500 37.676 -0.176 18003
11862 1 19 . 1 1 102 102 TYR H H 103 8.520 8.520 8.563 -0.043 18003
11863 1 19 . 1 1 103 103 HIS N N 104 117.456 117.456 117.849 -0.393 18003
11864 1 19 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.222 0.203 18003
11865 1 19 . 1 1 103 103 HIS C C 104 176.377 176.377 177.828 -1.451 18003
11866 1 19 . 1 1 103 103 HIS CA C 104 60.043 60.043 58.981 1.062 18003
11867 1 19 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.975 -0.946 18003
11868 1 19 . 1 1 103 103 HIS H H 104 8.622 8.622 8.605 0.017 18003
11869 1 19 . 1 1 104 104 SER N N 105 113.596 113.596 114.334 -0.738 18003
11870 1 19 . 1 1 104 104 SER C C 105 176.712 176.712 176.324 0.388 18003
11871 1 19 . 1 1 104 104 SER CA C 105 61.852 61.852 61.519 0.333 18003
11872 1 19 . 1 1 104 104 SER CB C 105 63.550 63.550 63.311 0.239 18003
11873 1 19 . 1 1 104 104 SER H H 105 7.900 7.900 8.471 -0.571 18003
11874 1 19 . 1 1 105 105 GLU N N 106 119.022 119.022 122.279 -3.257 18003
11875 1 19 . 1 1 105 105 GLU HA H 106 4.013 4.013 4.152 -0.139 18003
11876 1 19 . 1 1 105 105 GLU C C 106 177.902 177.902 178.708 -0.806 18003
11877 1 19 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.849 -0.818 18003
11878 1 19 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.573 -0.294 18003
11879 1 19 . 1 1 105 105 GLU H H 106 8.181 8.181 8.434 -0.253 18003
11880 1 19 . 1 1 106 106 HIS N N 107 116.482 116.482 118.962 -2.480 18003
11881 1 19 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.317 0.090 18003
11882 1 19 . 1 1 106 106 HIS C C 107 175.575 175.575 176.932 -1.357 18003
11883 1 19 . 1 1 106 106 HIS CA C 107 57.343 57.343 59.144 -1.801 18003
11884 1 19 . 1 1 106 106 HIS CB C 107 28.580 28.580 29.839 -1.259 18003
11885 1 19 . 1 1 106 106 HIS H H 107 7.770 7.770 8.097 -0.327 18003
11886 1 19 . 1 1 107 107 LEU N N 108 120.346 120.346 118.296 2.050 18003
11887 1 19 . 1 1 107 107 LEU HA H 108 4.054 4.054 3.994 0.060 18003
11888 1 19 . 1 1 107 107 LEU C C 108 177.404 177.404 176.212 1.192 18003
11889 1 19 . 1 1 107 107 LEU CA C 108 55.991 55.991 56.165 -0.174 18003
11890 1 19 . 1 1 107 107 LEU CB C 108 42.030 42.030 43.097 -1.067 18003
11891 1 19 . 1 1 107 107 LEU H H 108 7.682 7.682 8.097 -0.415 18003
11892 1 19 . 1 1 108 108 HIS N N 109 117.222 117.222 114.714 2.508 18003
11893 1 19 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.173 -0.119 18003
11894 1 19 . 1 1 108 108 HIS C C 109 174.606 174.606 176.517 -1.911 18003
11895 1 19 . 1 1 108 108 HIS CA C 109 56.029 56.029 56.800 -0.771 18003
11896 1 19 . 1 1 108 108 HIS CB C 109 28.517 28.517 28.944 -0.427 18003
11897 1 19 . 1 1 108 108 HIS H H 109 8.030 8.030 7.905 0.125 18003
11898 1 19 . 1 1 109 109 LEU N N 110 121.114 121.114 123.385 -2.271 18003
11899 1 19 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.080 0.218 18003
11900 1 19 . 1 1 109 109 LEU C C 110 178.028 178.028 177.220 0.808 18003
11901 1 19 . 1 1 109 109 LEU CA C 110 55.574 55.574 55.686 -0.112 18003
11902 1 19 . 1 1 109 109 LEU CB C 110 42.076 42.076 42.215 -0.139 18003
11903 1 19 . 1 1 109 109 LEU H H 110 7.973 7.973 7.799 0.174 18003
11904 1 19 . 1 1 110 110 GLY N N 111 108.631 108.631 106.180 2.451 18003
11905 1 19 . 1 1 110 110 GLY C C 111 174.606 174.606 175.197 -0.591 18003
11906 1 19 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.392 1.188 18003
11907 1 19 . 1 1 110 110 GLY H H 111 8.255 8.255 7.715 0.540 18003
11908 1 19 . 1 1 111 111 LEU N N 112 121.022 121.022 120.003 1.019 18003
11909 1 19 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.251 0.108 18003
11910 1 19 . 1 1 111 111 LEU C C 112 177.701 177.701 177.700 0.001 18003
11911 1 19 . 1 1 111 111 LEU CA C 112 55.476 55.476 56.013 -0.537 18003
11912 1 19 . 1 1 111 111 LEU CB C 112 41.899 41.899 41.675 0.224 18003
11913 1 19 . 1 1 111 111 LEU H H 112 7.981 7.981 8.562 -0.581 18003
11914 1 19 . 1 1 112 112 SER N N 113 115.471 115.471 112.866 2.605 18003
11915 1 19 . 1 1 112 112 SER HA H 113 4.432 4.432 4.346 0.086 18003
11916 1 19 . 1 1 112 112 SER C C 113 174.381 174.381 173.513 0.868 18003
11917 1 19 . 1 1 112 112 SER CA C 113 58.527 58.527 58.521 0.006 18003
11918 1 19 . 1 1 112 112 SER CB C 113 63.593 63.593 64.414 -0.821 18003
11919 1 19 . 1 1 112 112 SER H H 113 8.215 8.215 7.641 0.574 18003
11920 1 19 . 1 1 113 113 ASP N N 114 121.696 121.696 123.660 -1.964 18003
11921 1 19 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.599 -0.172 18003
11922 1 19 . 1 1 113 113 ASP C C 114 175.958 175.958 174.990 0.968 18003
11923 1 19 . 1 1 113 113 ASP CA C 114 54.213 54.213 54.550 -0.337 18003
11924 1 19 . 1 1 113 113 ASP CB C 114 41.030 41.030 41.037 -0.007 18003
11925 1 19 . 1 1 113 113 ASP H H 114 8.203 8.203 8.439 -0.236 18003
11926 1 19 . 1 1 114 114 ARG N N 115 120.088 120.088 121.842 -1.754 18003
11927 1 19 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.368 -0.096 18003
11928 1 19 . 1 1 114 114 ARG C C 115 175.792 175.792 176.191 -0.399 18003
11929 1 19 . 1 1 114 114 ARG CA C 115 55.735 55.735 56.408 -0.673 18003
11930 1 19 . 1 1 114 114 ARG CB C 115 30.586 30.586 30.448 0.138 18003
11931 1 19 . 1 1 114 114 ARG H H 115 8.016 8.016 8.365 -0.349 18003
11932 1 19 . 1 1 115 115 HIS N N 116 120.597 120.597 119.632 0.965 18003
11933 1 19 . 1 1 115 115 HIS CA C 116 53.697 53.697 55.601 -1.904 18003
11934 1 19 . 1 1 115 115 HIS CB C 116 29.299 29.299 28.610 0.689 18003
11935 1 19 . 1 1 115 115 HIS H H 116 8.385 8.385 8.958 -0.573 18003
11936 1 19 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.362 0.120 18003
11937 1 19 . 1 1 116 116 PRO C C 117 177.090 177.090 177.586 -0.496 18003
11938 1 19 . 1 1 116 116 PRO CA C 117 63.177 63.177 64.061 -0.884 18003
11939 1 19 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.363 -0.543 18003
11940 1 19 . 1 1 117 117 SER N N 118 116.220 116.220 115.048 1.172 18003
11941 1 19 . 1 1 117 117 SER HA H 118 4.465 4.465 4.566 -0.101 18003
11942 1 19 . 1 1 117 117 SER C C 118 174.287 174.287 173.649 0.638 18003
11943 1 19 . 1 1 117 117 SER CA C 118 58.110 58.110 58.422 -0.312 18003
11944 1 19 . 1 1 117 117 SER CB C 118 63.750 63.750 63.975 -0.225 18003
11945 1 19 . 1 1 117 117 SER H H 118 8.487 8.487 7.948 0.539 18003
11946 1 19 . 1 1 118 118 ALA N N 119 126.082 126.082 124.556 1.526 18003
11947 1 19 . 1 1 118 118 ALA HA H 119 4.439 4.439 5.153 -0.714 18003
11948 1 19 . 1 1 118 118 ALA C C 119 176.879 176.879 175.977 0.902 18003
11949 1 19 . 1 1 118 118 ALA CA C 119 52.449 52.449 51.283 1.166 18003
11950 1 19 . 1 1 118 118 ALA CB C 119 19.483 19.483 21.393 -1.910 18003
11951 1 19 . 1 1 118 118 ALA H H 119 8.295 8.295 8.763 -0.468 18003
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 107 2.756 0.736 2.669 18003
2 1 1 "Average Difference" HA 108 0.276 -0.023 0.276 18003
3 1 1 "Average Difference" C 108 1.060 0.038 1.064 18003
4 1 1 "Average Difference" CA 114 1.115 0.108 1.115 18003
5 1 1 "Average Difference" CB 101 1.160 -0.117 1.160 18003
6 1 1 "Average Difference" HN 107 0.440 0.131 0.422 18003
7 1 2 "Average Difference" N 107 2.652 0.508 2.615 18003
8 1 2 "Average Difference" HA 108 0.279 -0.037 0.278 18003
9 1 2 "Average Difference" C 108 1.152 0.095 1.154 18003
10 1 2 "Average Difference" CA 114 1.164 0.233 1.146 18003
11 1 2 "Average Difference" CB 101 1.143 -0.044 1.148 18003
12 1 2 "Average Difference" HN 107 0.405 0.055 0.403 18003
13 1 3 "Average Difference" N 107 2.716 0.565 2.669 18003
14 1 3 "Average Difference" HA 108 0.267 0.012 0.268 18003
15 1 3 "Average Difference" C 108 1.079 0.007 1.084 18003
16 1 3 "Average Difference" CA 114 1.136 0.194 1.124 18003
17 1 3 "Average Difference" CB 101 1.263 0.012 1.269 18003
18 1 3 "Average Difference" HN 107 0.406 0.071 0.402 18003
19 1 4 "Average Difference" N 107 2.768 0.693 2.692 18003
20 1 4 "Average Difference" HA 108 0.233 -0.026 0.233 18003
21 1 4 "Average Difference" C 108 1.007 -0.084 1.009 18003
22 1 4 "Average Difference" CA 114 1.117 0.137 1.114 18003
23 1 4 "Average Difference" CB 101 1.190 -0.121 1.190 18003
24 1 4 "Average Difference" HN 107 0.419 0.060 0.416 18003
25 1 5 "Average Difference" N 107 2.972 0.782 2.880 18003
26 1 5 "Average Difference" HA 108 0.249 -0.012 0.250 18003
27 1 5 "Average Difference" C 108 1.091 -0.057 1.095 18003
28 1 5 "Average Difference" CA 114 1.068 0.161 1.061 18003
29 1 5 "Average Difference" CB 101 1.278 -0.065 1.282 18003
30 1 5 "Average Difference" HN 107 0.401 0.070 0.397 18003
31 1 6 "Average Difference" N 107 3.117 0.404 3.105 18003
32 1 6 "Average Difference" HA 108 0.267 -0.025 0.267 18003
33 1 6 "Average Difference" C 108 1.058 -0.044 1.062 18003
34 1 6 "Average Difference" CA 114 1.162 0.188 1.152 18003
35 1 6 "Average Difference" CB 101 1.390 -0.100 1.393 18003
36 1 6 "Average Difference" HN 107 0.423 0.046 0.422 18003
37 1 7 "Average Difference" N 107 2.955 0.572 2.913 18003
38 1 7 "Average Difference" HA 108 0.246 -0.030 0.246 18003
39 1 7 "Average Difference" C 108 1.036 -0.027 1.040 18003
40 1 7 "Average Difference" CA 114 1.101 0.144 1.097 18003
41 1 7 "Average Difference" CB 101 1.175 -0.028 1.181 18003
42 1 7 "Average Difference" HN 107 0.401 0.070 0.397 18003
43 1 8 "Average Difference" N 107 2.672 0.523 2.633 18003
44 1 8 "Average Difference" HA 108 0.252 -0.041 0.250 18003
45 1 8 "Average Difference" C 108 1.141 0.001 1.147 18003
46 1 8 "Average Difference" CA 114 1.157 0.171 1.149 18003
47 1 8 "Average Difference" CB 101 1.309 -0.047 1.314 18003
48 1 8 "Average Difference" HN 107 0.399 0.052 0.398 18003
49 1 9 "Average Difference" N 107 2.978 0.773 2.890 18003
50 1 9 "Average Difference" HA 108 0.265 -0.055 0.260 18003
51 1 9 "Average Difference" C 108 1.055 -0.002 1.059 18003
52 1 9 "Average Difference" CA 114 1.176 0.234 1.158 18003
53 1 9 "Average Difference" CB 101 1.296 -0.157 1.293 18003
54 1 9 "Average Difference" HN 107 0.386 0.068 0.382 18003
55 1 10 "Average Difference" N 107 2.887 0.358 2.878 18003
56 1 10 "Average Difference" HA 108 0.243 -0.035 0.242 18003
57 1 10 "Average Difference" C 108 1.005 0.004 1.009 18003
58 1 10 "Average Difference" CA 114 1.124 0.170 1.116 18003
59 1 10 "Average Difference" CB 101 1.092 -0.052 1.096 18003
60 1 10 "Average Difference" HN 107 0.426 0.046 0.426 18003
61 1 11 "Average Difference" N 107 2.767 0.701 2.690 18003
62 1 11 "Average Difference" HA 108 0.250 -0.048 0.247 18003
63 1 11 "Average Difference" C 108 1.073 -0.000 1.078 18003
64 1 11 "Average Difference" CA 114 1.193 0.260 1.170 18003
65 1 11 "Average Difference" CB 101 1.131 -0.078 1.134 18003
66 1 11 "Average Difference" HN 107 0.417 0.066 0.413 18003
67 1 12 "Average Difference" N 107 3.004 0.689 2.938 18003
68 1 12 "Average Difference" HA 108 0.231 -0.034 0.229 18003
69 1 12 "Average Difference" C 108 1.037 -0.006 1.042 18003
70 1 12 "Average Difference" CA 114 1.146 0.096 1.147 18003
71 1 12 "Average Difference" CB 101 1.219 -0.045 1.224 18003
72 1 12 "Average Difference" HN 107 0.453 0.086 0.447 18003
73 1 13 "Average Difference" N 107 2.927 0.799 2.829 18003
74 1 13 "Average Difference" HA 108 0.249 -0.032 0.248 18003
75 1 13 "Average Difference" C 108 1.078 -0.041 1.082 18003
76 1 13 "Average Difference" CA 114 1.152 0.229 1.134 18003
77 1 13 "Average Difference" CB 101 1.216 -0.100 1.218 18003
78 1 13 "Average Difference" HN 107 0.394 0.061 0.391 18003
79 1 14 "Average Difference" N 107 2.873 0.419 2.856 18003
80 1 14 "Average Difference" HA 108 0.278 0.000 0.279 18003
81 1 14 "Average Difference" C 108 1.100 -0.075 1.102 18003
82 1 14 "Average Difference" CA 114 1.106 0.081 1.108 18003
83 1 14 "Average Difference" CB 101 1.216 0.085 1.219 18003
84 1 14 "Average Difference" HN 107 0.409 0.065 0.405 18003
85 1 15 "Average Difference" N 107 2.897 0.571 2.853 18003
86 1 15 "Average Difference" HA 108 0.272 -0.057 0.267 18003
87 1 15 "Average Difference" C 108 1.011 0.025 1.015 18003
88 1 15 "Average Difference" CA 114 1.071 0.205 1.056 18003
89 1 15 "Average Difference" CB 101 1.209 -0.124 1.209 18003
90 1 15 "Average Difference" HN 107 0.407 0.077 0.402 18003
91 1 16 "Average Difference" N 107 2.746 0.562 2.700 18003
92 1 16 "Average Difference" HA 108 0.252 -0.055 0.247 18003
93 1 16 "Average Difference" C 108 1.095 0.119 1.093 18003
94 1 16 "Average Difference" CA 114 1.111 0.282 1.080 18003
95 1 16 "Average Difference" CB 101 1.237 -0.136 1.235 18003
96 1 16 "Average Difference" HN 107 0.408 0.058 0.406 18003
97 1 17 "Average Difference" N 107 2.908 0.825 2.802 18003
98 1 17 "Average Difference" HA 108 0.247 -0.015 0.248 18003
99 1 17 "Average Difference" C 108 1.006 -0.008 1.011 18003
100 1 17 "Average Difference" CA 114 1.113 0.038 1.117 18003
101 1 17 "Average Difference" CB 101 1.314 -0.151 1.312 18003
102 1 17 "Average Difference" HN 107 0.422 0.058 0.420 18003
103 1 18 "Average Difference" N 107 2.866 0.506 2.834 18003
104 1 18 "Average Difference" HA 108 0.274 -0.035 0.273 18003
105 1 18 "Average Difference" C 108 1.019 -0.011 1.024 18003
106 1 18 "Average Difference" CA 114 1.121 0.177 1.111 18003
107 1 18 "Average Difference" CB 101 1.271 -0.111 1.272 18003
108 1 18 "Average Difference" HN 107 0.437 0.096 0.428 18003
109 1 19 "Average Difference" N 107 2.848 0.380 2.836 18003
110 1 19 "Average Difference" HA 108 0.256 -0.028 0.255 18003
111 1 19 "Average Difference" C 108 1.048 -0.053 1.052 18003
112 1 19 "Average Difference" CA 114 1.118 0.228 1.099 18003
113 1 19 "Average Difference" CB 101 1.253 -0.067 1.257 18003
114 1 19 "Average Difference" HN 107 0.451 0.086 0.445 18003
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 18003
_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 HIS C C 3 175.176 175.176 175.760 -0.584 18003
2 1 . 1 1 2 2 HIS CA C 3 55.900 55.900 56.160 -0.260 18003
3 1 . 1 1 2 2 HIS CB C 3 30.029 30.029 30.274 -0.245 18003
4 1 . 1 1 3 3 GLY N N 4 110.613 110.613 109.119 1.494 18003
5 1 . 1 1 3 3 GLY C C 4 174.068 174.068 174.042 0.026 18003
6 1 . 1 1 3 3 GLY CA C 4 45.141 45.141 44.986 0.155 18003
7 1 . 1 1 3 3 GLY H H 4 8.500 8.500 8.410 0.090 18003
8 1 . 1 1 4 4 VAL N N 5 119.318 119.318 119.157 0.161 18003
9 1 . 1 1 4 4 VAL HA H 5 4.128 4.128 4.197 -0.069 18003
10 1 . 1 1 4 4 VAL C C 5 176.361 176.361 175.625 0.736 18003
11 1 . 1 1 4 4 VAL CA C 5 61.987 61.987 62.101 -0.114 18003
12 1 . 1 1 4 4 VAL CB C 5 32.635 32.635 32.995 -0.360 18003
13 1 . 1 1 4 4 VAL H H 5 8.094 8.094 7.950 0.144 18003
14 1 . 1 1 5 5 GLU N N 6 124.369 124.369 122.889 1.480 18003
15 1 . 1 1 5 5 GLU HA H 6 4.288 4.288 4.306 -0.018 18003
16 1 . 1 1 5 5 GLU C C 6 177.012 177.012 176.483 0.529 18003
17 1 . 1 1 5 5 GLU CA C 6 56.699 56.699 56.403 0.296 18003
18 1 . 1 1 5 5 GLU CB C 6 30.029 30.029 30.178 -0.149 18003
19 1 . 1 1 5 5 GLU H H 6 8.545 8.545 8.416 0.129 18003
20 1 . 1 1 6 6 GLY N N 7 109.747 109.747 109.406 0.341 18003
21 1 . 1 1 6 6 GLY C C 7 174.117 174.117 174.098 0.019 18003
22 1 . 1 1 6 6 GLY CA C 7 45.568 45.568 44.945 0.623 18003
23 1 . 1 1 6 6 GLY H H 7 8.352 8.352 8.271 0.081 18003
24 1 . 1 1 7 7 ARG N N 8 120.059 120.059 120.859 -0.800 18003
25 1 . 1 1 7 7 ARG HA H 8 4.342 4.342 4.249 0.093 18003
26 1 . 1 1 7 7 ARG C C 8 176.016 176.016 175.396 0.620 18003
27 1 . 1 1 7 7 ARG CA C 8 55.833 55.833 56.301 -0.467 18003
28 1 . 1 1 7 7 ARG CB C 8 30.444 30.444 30.498 -0.054 18003
29 1 . 1 1 7 7 ARG H H 8 8.084 8.084 8.287 -0.203 18003
30 1 . 1 1 8 8 ASN N N 9 119.379 119.379 119.224 0.155 18003
31 1 . 1 1 8 8 ASN HA H 9 4.332 4.332 4.696 -0.364 18003
32 1 . 1 1 8 8 ASN C C 9 174.667 174.667 174.652 0.015 18003
33 1 . 1 1 8 8 ASN CA C 9 53.441 53.441 53.154 0.287 18003
34 1 . 1 1 8 8 ASN CB C 9 38.480 38.480 39.061 -0.581 18003
35 1 . 1 1 8 8 ASN H H 9 8.411 8.411 8.394 0.017 18003
36 1 . 1 1 9 9 ARG N N 10 121.700 121.700 119.815 1.885 18003
37 1 . 1 1 9 9 ARG HA H 10 4.649 4.649 4.372 0.277 18003
38 1 . 1 1 9 9 ARG CA C 10 53.147 53.147 55.371 -2.224 18003
39 1 . 1 1 9 9 ARG CB C 10 30.197 30.197 29.429 0.768 18003
40 1 . 1 1 9 9 ARG H H 10 8.138 8.138 8.344 -0.206 18003
41 1 . 1 1 10 10 PRO HA H 11 4.443 4.443 4.508 -0.065 18003
42 1 . 1 1 10 10 PRO C C 11 176.815 176.815 176.337 0.478 18003
43 1 . 1 1 10 10 PRO CA C 11 63.177 63.177 63.039 0.138 18003
44 1 . 1 1 10 10 PRO CB C 11 31.820 31.820 32.125 -0.305 18003
45 1 . 1 1 11 11 SER N N 12 116.291 116.291 116.790 -0.499 18003
46 1 . 1 1 11 11 SER HA H 12 4.418 4.418 4.415 0.003 18003
47 1 . 1 1 11 11 SER C C 12 173.702 173.702 173.623 0.079 18003
48 1 . 1 1 11 11 SER CA C 12 58.031 58.031 58.524 -0.493 18003
49 1 . 1 1 11 11 SER CB C 12 64.032 64.032 63.663 0.369 18003
50 1 . 1 1 11 11 SER H H 12 8.325 8.325 8.272 0.053 18003
51 1 . 1 1 12 12 ALA N N 13 126.862 126.862 125.817 1.045 18003
52 1 . 1 1 12 12 ALA HA H 13 4.388 4.388 4.436 -0.048 18003
53 1 . 1 1 12 12 ALA CA C 13 50.458 50.458 51.784 -1.326 18003
54 1 . 1 1 12 12 ALA CB C 13 18.257 18.257 18.622 -0.365 18003
55 1 . 1 1 12 12 ALA H H 13 8.166 8.166 8.262 -0.096 18003
56 1 . 1 1 13 13 PRO C C 14 176.368 176.368 176.540 -0.172 18003
57 1 . 1 1 13 13 PRO CA C 14 62.937 62.937 62.792 0.145 18003
58 1 . 1 1 13 13 PRO CB C 14 32.022 32.022 31.754 0.268 18003
59 1 . 1 1 14 14 LEU N N 15 120.969 120.969 122.164 -1.195 18003
60 1 . 1 1 14 14 LEU HA H 15 4.258 4.258 4.420 -0.162 18003
61 1 . 1 1 14 14 LEU C C 15 176.124 176.124 177.691 -1.567 18003
62 1 . 1 1 14 14 LEU CA C 15 54.527 54.527 55.053 -0.526 18003
63 1 . 1 1 14 14 LEU CB C 15 43.418 43.418 41.728 1.690 18003
64 1 . 1 1 14 14 LEU H H 15 7.875 7.875 8.114 -0.238 18003
65 1 . 1 1 15 15 ASP N N 16 121.780 121.780 121.253 0.527 18003
66 1 . 1 1 15 15 ASP HA H 16 4.593 4.593 4.443 0.150 18003
67 1 . 1 1 15 15 ASP C C 16 176.208 176.208 178.135 -1.927 18003
68 1 . 1 1 15 15 ASP CA C 16 52.468 52.468 56.954 -4.486 18003
69 1 . 1 1 15 15 ASP CB C 16 41.629 41.629 40.483 1.146 18003
70 1 . 1 1 15 15 ASP H H 16 7.850 7.850 8.645 -0.795 18003
71 1 . 1 1 16 16 SER N N 17 114.435 114.435 115.188 -0.753 18003
72 1 . 1 1 16 16 SER HA H 17 4.120 4.120 4.090 0.030 18003
73 1 . 1 1 16 16 SER C C 17 177.207 177.207 176.530 0.677 18003
74 1 . 1 1 16 16 SER CA C 17 62.322 62.322 61.290 1.032 18003
75 1 . 1 1 16 16 SER H H 17 8.658 8.658 8.255 0.403 18003
76 1 . 1 1 17 17 GLN N N 18 122.403 122.403 120.629 1.774 18003
77 1 . 1 1 17 17 GLN HA H 18 4.197 4.197 4.064 0.133 18003
78 1 . 1 1 17 17 GLN C C 18 178.715 178.715 177.962 0.753 18003
79 1 . 1 1 17 17 GLN CA C 18 58.113 58.113 58.635 -0.522 18003
80 1 . 1 1 17 17 GLN CB C 18 28.040 28.040 28.255 -0.215 18003
81 1 . 1 1 17 17 GLN H H 18 8.140 8.140 8.319 -0.179 18003
82 1 . 1 1 18 18 ALA N N 19 124.743 124.743 122.131 2.612 18003
83 1 . 1 1 18 18 ALA HA H 19 4.176 4.176 4.054 0.122 18003
84 1 . 1 1 18 18 ALA C C 19 180.616 180.616 179.437 1.179 18003
85 1 . 1 1 18 18 ALA CA C 19 54.605 54.605 54.766 -0.161 18003
86 1 . 1 1 18 18 ALA CB C 19 19.028 19.028 18.030 0.998 18003
87 1 . 1 1 18 18 ALA H H 19 8.455 8.455 7.946 0.509 18003
88 1 . 1 1 19 19 ALA N N 20 119.089 119.089 121.025 -1.936 18003
89 1 . 1 1 19 19 ALA HA H 20 4.179 4.179 4.022 0.157 18003
90 1 . 1 1 19 19 ALA C C 20 179.239 179.239 179.384 -0.145 18003
91 1 . 1 1 19 19 ALA CA C 20 55.271 55.271 54.894 0.377 18003
92 1 . 1 1 19 19 ALA CB C 20 18.192 18.192 18.326 -0.134 18003
93 1 . 1 1 19 19 ALA H H 20 8.993 8.993 8.037 0.956 18003
94 1 . 1 1 20 20 ALA N N 21 119.226 119.226 121.130 -1.904 18003
95 1 . 1 1 20 20 ALA HA H 21 4.060 4.060 3.918 0.142 18003
96 1 . 1 1 20 20 ALA C C 21 180.230 180.230 179.779 0.451 18003
97 1 . 1 1 20 20 ALA CA C 21 55.143 55.143 55.105 0.038 18003
98 1 . 1 1 20 20 ALA CB C 21 18.028 18.028 18.083 -0.055 18003
99 1 . 1 1 20 20 ALA H H 21 7.724 7.724 7.985 -0.261 18003
100 1 . 1 1 21 21 GLN N N 22 119.310 119.310 118.532 0.778 18003
101 1 . 1 1 21 21 GLN HA H 22 4.129 4.129 3.998 0.131 18003
102 1 . 1 1 21 21 GLN C C 22 179.319 179.319 178.575 0.744 18003
103 1 . 1 1 21 21 GLN CA C 22 58.762 58.762 58.899 -0.137 18003
104 1 . 1 1 21 21 GLN CB C 22 28.029 28.029 28.623 -0.594 18003
105 1 . 1 1 21 21 GLN H H 22 7.638 7.638 8.344 -0.706 18003
106 1 . 1 1 22 22 VAL N N 23 121.565 121.565 119.990 1.575 18003
107 1 . 1 1 22 22 VAL HA H 23 3.966 3.966 3.676 0.291 18003
108 1 . 1 1 22 22 VAL C C 23 178.026 178.026 177.951 0.075 18003
109 1 . 1 1 22 22 VAL CA C 23 66.142 66.142 66.049 0.093 18003
110 1 . 1 1 22 22 VAL CB C 23 30.966 30.966 31.283 -0.317 18003
111 1 . 1 1 22 22 VAL H H 23 8.442 8.442 8.024 0.418 18003
112 1 . 1 1 23 23 ALA N N 24 121.400 121.400 122.184 -0.784 18003
113 1 . 1 1 23 23 ALA HA H 24 4.096 4.096 3.904 0.192 18003
114 1 . 1 1 23 23 ALA C C 24 178.758 178.758 179.746 -0.988 18003
115 1 . 1 1 23 23 ALA CA C 24 55.915 55.915 55.500 0.415 18003
116 1 . 1 1 23 23 ALA CB C 24 16.650 16.650 18.002 -1.352 18003
117 1 . 1 1 23 23 ALA H H 24 8.495 8.495 8.512 -0.017 18003
118 1 . 1 1 24 24 SER N N 25 112.138 112.138 113.916 -1.778 18003
119 1 . 1 1 24 24 SER HA H 25 4.093 4.093 4.124 -0.031 18003
120 1 . 1 1 24 24 SER C C 25 177.271 177.271 176.731 0.540 18003
121 1 . 1 1 24 24 SER CA C 25 62.166 62.166 61.825 0.341 18003
122 1 . 1 1 24 24 SER CB C 25 63.032 63.032 63.008 0.024 18003
123 1 . 1 1 24 24 SER H H 25 7.936 7.936 8.257 -0.321 18003
124 1 . 1 1 25 25 THR N N 26 119.701 119.701 118.894 0.807 18003
125 1 . 1 1 25 25 THR HA H 26 4.380 4.380 4.010 0.370 18003
126 1 . 1 1 25 25 THR C C 26 175.456 175.456 176.526 -1.070 18003
127 1 . 1 1 25 25 THR CA C 26 67.129 67.129 66.689 0.440 18003
128 1 . 1 1 25 25 THR CB C 26 68.800 68.800 68.688 0.112 18003
129 1 . 1 1 25 25 THR H H 26 7.775 7.775 7.692 0.083 18003
130 1 . 1 1 26 26 LEU N N 27 119.270 119.270 120.771 -1.501 18003
131 1 . 1 1 26 26 LEU HA H 27 3.563 3.563 4.064 -0.501 18003
132 1 . 1 1 26 26 LEU C C 27 178.390 178.390 179.121 -0.731 18003
133 1 . 1 1 26 26 LEU CA C 27 57.669 57.669 57.386 0.283 18003
134 1 . 1 1 26 26 LEU CB C 27 42.030 42.030 41.229 0.801 18003
135 1 . 1 1 26 26 LEU H H 27 8.006 8.006 8.441 -0.435 18003
136 1 . 1 1 27 27 GLN N N 28 115.843 115.843 119.804 -3.961 18003
137 1 . 1 1 27 27 GLN HA H 28 3.804 3.804 4.056 -0.252 18003
138 1 . 1 1 27 27 GLN C C 28 178.657 178.657 177.822 0.835 18003
139 1 . 1 1 27 27 GLN CA C 28 58.712 58.712 58.735 -0.023 18003
140 1 . 1 1 27 27 GLN CB C 28 28.029 28.029 28.882 -0.853 18003
141 1 . 1 1 27 27 GLN H H 28 8.485 8.485 8.103 0.382 18003
142 1 . 1 1 28 28 ALA N N 29 118.779 118.779 122.480 -3.701 18003
143 1 . 1 1 28 28 ALA HA H 29 4.008 4.008 4.045 -0.037 18003
144 1 . 1 1 28 28 ALA C C 29 178.259 178.259 179.849 -1.590 18003
145 1 . 1 1 28 28 ALA CA C 29 53.962 53.962 54.812 -0.850 18003
146 1 . 1 1 28 28 ALA CB C 29 18.738 18.738 18.605 0.133 18003
147 1 . 1 1 28 28 ALA H H 29 7.432 7.432 7.927 -0.495 18003
148 1 . 1 1 29 29 LEU N N 30 113.442 113.442 117.819 -4.377 18003
149 1 . 1 1 29 29 LEU HA H 30 3.996 3.996 3.930 0.066 18003
150 1 . 1 1 29 29 LEU C C 30 175.924 175.924 177.544 -1.620 18003
151 1 . 1 1 29 29 LEU CA C 30 55.564 55.564 56.997 -1.433 18003
152 1 . 1 1 29 29 LEU CB C 30 42.266 42.266 41.235 1.031 18003
153 1 . 1 1 29 29 LEU H H 30 7.311 7.311 7.888 -0.577 18003
154 1 . 1 1 30 30 ALA N N 31 119.563 119.563 118.943 0.620 18003
155 1 . 1 1 30 30 ALA HA H 31 4.172 4.172 4.133 0.039 18003
156 1 . 1 1 30 30 ALA C C 31 176.316 176.316 176.724 -0.408 18003
157 1 . 1 1 30 30 ALA CA C 31 51.656 51.656 53.328 -1.672 18003
158 1 . 1 1 30 30 ALA CB C 31 18.077 18.077 19.035 -0.958 18003
159 1 . 1 1 30 30 ALA H H 31 7.223 7.223 7.228 -0.005 18003
160 1 . 1 1 31 31 THR N N 32 114.613 114.613 110.487 4.126 18003
161 1 . 1 1 31 31 THR HA H 32 4.950 4.950 4.120 0.830 18003
162 1 . 1 1 31 31 THR CA C 32 58.129 58.129 62.328 -4.199 18003
163 1 . 1 1 31 31 THR CB C 32 69.098 69.098 67.837 1.261 18003
164 1 . 1 1 31 31 THR H H 32 8.399 8.399 8.108 0.291 18003
165 1 . 1 1 32 32 PRO HA H 33 4.438 4.438 4.155 0.283 18003
166 1 . 1 1 32 32 PRO C C 33 178.207 178.207 178.807 -0.600 18003
167 1 . 1 1 32 32 PRO CA C 33 66.905 66.905 66.020 0.885 18003
168 1 . 1 1 32 32 PRO CB C 33 31.264 31.264 31.578 -0.314 18003
169 1 . 1 1 33 33 SER N N 34 110.767 110.767 113.065 -2.298 18003
170 1 . 1 1 33 33 SER HA H 34 4.026 4.026 4.158 -0.132 18003
171 1 . 1 1 33 33 SER C C 34 176.742 176.742 176.701 0.041 18003
172 1 . 1 1 33 33 SER CA C 34 61.782 61.782 61.791 -0.009 18003
173 1 . 1 1 33 33 SER CB C 34 62.432 62.432 62.612 -0.180 18003
174 1 . 1 1 33 33 SER H H 34 8.407 8.407 8.395 0.012 18003
175 1 . 1 1 34 34 ARG N N 35 120.135 120.135 121.648 -1.513 18003
176 1 . 1 1 34 34 ARG HA H 35 4.054 4.054 4.114 -0.060 18003
177 1 . 1 1 34 34 ARG C C 35 178.283 178.283 178.672 -0.389 18003
178 1 . 1 1 34 34 ARG CA C 35 60.532 60.532 58.854 1.678 18003
179 1 . 1 1 34 34 ARG CB C 35 28.953 28.953 29.810 -0.857 18003
180 1 . 1 1 34 34 ARG H H 35 7.341 7.341 7.839 -0.498 18003
181 1 . 1 1 35 35 LEU N N 36 118.454 118.454 121.619 -3.165 18003
182 1 . 1 1 35 35 LEU HA H 36 4.054 4.054 4.012 0.042 18003
183 1 . 1 1 35 35 LEU C C 36 180.643 180.643 178.950 1.693 18003
184 1 . 1 1 35 35 LEU CA C 36 57.809 57.809 58.171 -0.362 18003
185 1 . 1 1 35 35 LEU CB C 36 41.778 41.778 41.690 0.088 18003
186 1 . 1 1 35 35 LEU H H 36 8.226 8.226 8.389 -0.163 18003
187 1 . 1 1 36 36 MET N N 37 121.073 121.073 119.131 1.942 18003
188 1 . 1 1 36 36 MET HA H 37 3.928 3.928 4.069 -0.141 18003
189 1 . 1 1 36 36 MET C C 37 177.671 177.671 178.696 -1.025 18003
190 1 . 1 1 36 36 MET CA C 37 60.613 60.613 58.816 1.797 18003
191 1 . 1 1 36 36 MET CB C 37 33.128 33.128 32.377 0.751 18003
192 1 . 1 1 36 36 MET H H 37 8.447 8.447 8.192 0.255 18003
193 1 . 1 1 37 37 ILE N N 38 118.239 118.239 119.702 -1.463 18003
194 1 . 1 1 37 37 ILE HA H 38 3.440 3.440 3.706 -0.266 18003
195 1 . 1 1 37 37 ILE C C 38 177.092 177.092 178.250 -1.158 18003
196 1 . 1 1 37 37 ILE CA C 38 65.675 65.675 64.752 0.923 18003
197 1 . 1 1 37 37 ILE CB C 38 38.255 38.255 37.255 1.000 18003
198 1 . 1 1 37 37 ILE H H 38 7.763 7.763 7.971 -0.208 18003
199 1 . 1 1 38 38 LEU N N 39 116.073 116.073 120.718 -4.645 18003
200 1 . 1 1 38 38 LEU HA H 39 3.826 3.826 3.956 -0.130 18003
201 1 . 1 1 38 38 LEU C C 39 178.941 178.941 179.027 -0.086 18003
202 1 . 1 1 38 38 LEU CA C 39 58.031 58.031 58.470 -0.439 18003
203 1 . 1 1 38 38 LEU CB C 39 41.780 41.780 41.382 0.398 18003
204 1 . 1 1 38 38 LEU H H 39 8.538 8.538 8.542 -0.004 18003
205 1 . 1 1 39 39 THR N N 40 106.678 106.678 114.752 -8.074 18003
206 1 . 1 1 39 39 THR HA H 40 3.932 3.932 3.898 0.034 18003
207 1 . 1 1 39 39 THR C C 40 177.747 177.747 176.785 0.962 18003
208 1 . 1 1 39 39 THR CA C 40 65.536 65.536 66.717 -1.181 18003
209 1 . 1 1 39 39 THR CB C 40 68.360 68.360 68.373 -0.013 18003
210 1 . 1 1 39 39 THR H H 40 8.086 8.086 8.496 -0.410 18003
211 1 . 1 1 40 40 GLN N N 41 122.344 122.344 120.970 1.374 18003
212 1 . 1 1 40 40 GLN HA H 41 4.006 4.006 4.071 -0.065 18003
213 1 . 1 1 40 40 GLN C C 41 178.348 178.348 178.595 -0.247 18003
214 1 . 1 1 40 40 GLN CA C 41 57.925 57.925 58.759 -0.834 18003
215 1 . 1 1 40 40 GLN CB C 41 27.520 27.520 28.361 -0.841 18003
216 1 . 1 1 40 40 GLN H H 41 7.593 7.593 7.704 -0.111 18003
217 1 . 1 1 41 41 LEU N N 42 116.302 116.302 119.830 -3.528 18003
218 1 . 1 1 41 41 LEU C C 42 178.418 178.418 179.277 -0.859 18003
219 1 . 1 1 41 41 LEU CA C 42 55.531 55.531 57.265 -1.734 18003
220 1 . 1 1 41 41 LEU CB C 42 41.349 41.349 41.764 -0.415 18003
221 1 . 1 1 41 41 LEU H H 42 7.570 7.570 7.855 -0.285 18003
222 1 . 1 1 42 42 ARG N N 43 119.954 119.954 118.449 1.505 18003
223 1 . 1 1 42 42 ARG HA H 43 3.915 3.915 3.977 -0.062 18003
224 1 . 1 1 42 42 ARG C C 43 177.205 177.205 177.957 -0.752 18003
225 1 . 1 1 42 42 ARG CA C 43 58.704 58.704 58.914 -0.210 18003
226 1 . 1 1 42 42 ARG CB C 43 29.443 29.443 30.124 -0.681 18003
227 1 . 1 1 42 42 ARG H H 43 7.612 7.612 8.260 -0.648 18003
228 1 . 1 1 43 43 ASN N N 44 114.682 114.682 116.550 -1.868 18003
229 1 . 1 1 43 43 ASN HA H 44 4.760 4.760 4.635 0.125 18003
230 1 . 1 1 43 43 ASN C C 44 174.507 174.507 175.338 -0.831 18003
231 1 . 1 1 43 43 ASN CA C 44 53.953 53.953 54.480 -0.527 18003
232 1 . 1 1 43 43 ASN CB C 44 39.030 39.030 39.403 -0.373 18003
233 1 . 1 1 43 43 ASN H H 44 7.567 7.567 7.798 -0.231 18003
234 1 . 1 1 44 44 GLY N N 45 109.113 109.113 106.855 2.258 18003
235 1 . 1 1 44 44 GLY CA C 45 44.268 44.268 44.871 -0.603 18003
236 1 . 1 1 44 44 GLY H H 45 7.361 7.361 7.759 -0.398 18003
237 1 . 1 1 45 45 PRO C C 46 178.412 178.412 176.033 2.379 18003
238 1 . 1 1 45 45 PRO CA C 46 62.580 62.580 63.005 -0.424 18003
239 1 . 1 1 45 45 PRO CB C 46 33.129 33.129 31.782 1.347 18003
240 1 . 1 1 46 46 LEU N N 47 120.363 120.363 120.632 -0.269 18003
241 1 . 1 1 46 46 LEU HA H 47 5.031 5.031 4.773 0.258 18003
242 1 . 1 1 46 46 LEU CA C 47 52.550 52.550 52.402 0.148 18003
243 1 . 1 1 46 46 LEU CB C 47 48.210 48.210 42.272 5.938 18003
244 1 . 1 1 46 46 LEU H H 47 8.252 8.252 8.030 0.222 18003
245 1 . 1 1 47 47 PRO C C 48 177.313 177.313 178.170 -0.857 18003
246 1 . 1 1 47 47 PRO CA C 48 61.835 61.835 62.393 -0.558 18003
247 1 . 1 1 47 47 PRO CB C 48 32.383 32.383 32.502 -0.119 18003
248 1 . 1 1 48 48 VAL N N 49 119.384 119.384 119.010 0.374 18003
249 1 . 1 1 48 48 VAL HA H 49 3.607 3.607 3.735 -0.128 18003
250 1 . 1 1 48 48 VAL C C 49 176.710 176.710 177.982 -1.272 18003
251 1 . 1 1 48 48 VAL CA C 49 66.188 66.188 66.740 -0.552 18003
252 1 . 1 1 48 48 VAL CB C 49 31.581 31.581 31.372 0.209 18003
253 1 . 1 1 48 48 VAL H H 49 9.074 9.074 8.686 0.388 18003
254 1 . 1 1 49 49 THR N N 50 111.293 111.293 113.722 -2.429 18003
255 1 . 1 1 49 49 THR HA H 50 4.181 4.181 4.044 0.137 18003
256 1 . 1 1 49 49 THR C C 50 176.717 176.717 176.222 0.495 18003
257 1 . 1 1 49 49 THR CA C 50 65.063 65.063 66.652 -1.589 18003
258 1 . 1 1 49 49 THR CB C 50 68.032 68.032 68.143 -0.111 18003
259 1 . 1 1 49 49 THR H H 50 7.848 7.848 8.211 -0.363 18003
260 1 . 1 1 50 50 ASP N N 51 120.138 120.138 121.768 -1.630 18003
261 1 . 1 1 50 50 ASP HA H 51 4.205 4.205 4.471 -0.266 18003
262 1 . 1 1 50 50 ASP C C 51 174.723 174.723 178.476 -3.753 18003
263 1 . 1 1 50 50 ASP CA C 51 56.781 56.781 57.226 -0.445 18003
264 1 . 1 1 50 50 ASP CB C 51 41.111 41.111 40.354 0.757 18003
265 1 . 1 1 50 50 ASP H H 51 7.108 7.108 8.283 -1.175 18003
266 1 . 1 1 51 51 LEU N N 52 121.089 121.089 120.949 0.140 18003
267 1 . 1 1 51 51 LEU HA H 52 3.985 3.985 4.020 -0.035 18003
268 1 . 1 1 51 51 LEU C C 52 177.089 177.089 178.468 -1.379 18003
269 1 . 1 1 51 51 LEU CA C 52 58.161 58.161 57.814 0.346 18003
270 1 . 1 1 51 51 LEU CB C 52 41.780 41.780 41.485 0.295 18003
271 1 . 1 1 51 51 LEU H H 52 7.943 7.943 8.185 -0.242 18003
272 1 . 1 1 52 52 ALA N N 53 119.237 119.237 121.441 -2.204 18003
273 1 . 1 1 52 52 ALA HA H 53 3.872 3.872 3.956 -0.084 18003
274 1 . 1 1 52 52 ALA C C 53 179.466 179.466 179.717 -0.251 18003
275 1 . 1 1 52 52 ALA CA C 53 55.663 55.663 55.202 0.461 18003
276 1 . 1 1 52 52 ALA CB C 53 17.619 17.619 18.067 -0.448 18003
277 1 . 1 1 52 52 ALA H H 53 8.480 8.480 8.249 0.231 18003
278 1 . 1 1 53 53 GLU N N 54 115.655 115.655 118.989 -3.334 18003
279 1 . 1 1 53 53 GLU HA H 54 4.054 4.054 4.011 0.043 18003
280 1 . 1 1 53 53 GLU C C 54 179.073 179.073 178.438 0.635 18003
281 1 . 1 1 53 53 GLU CA C 54 58.827 58.827 58.801 0.026 18003
282 1 . 1 1 53 53 GLU CB C 54 29.400 29.400 29.495 -0.094 18003
283 1 . 1 1 53 53 GLU H H 54 7.705 7.705 7.918 -0.213 18003
284 1 . 1 1 54 54 ALA N N 55 120.276 120.276 121.134 -0.858 18003
285 1 . 1 1 54 54 ALA HA H 55 4.137 4.137 4.145 -0.008 18003
286 1 . 1 1 54 54 ALA C C 55 179.771 179.771 178.757 1.014 18003
287 1 . 1 1 54 54 ALA CA C 55 54.661 54.661 54.425 0.236 18003
288 1 . 1 1 54 54 ALA CB C 55 18.235 18.235 19.344 -1.109 18003
289 1 . 1 1 54 54 ALA H H 55 7.928 7.928 7.770 0.158 18003
290 1 . 1 1 55 55 ILE N N 56 107.195 107.195 115.995 -8.800 18003
291 1 . 1 1 55 55 ILE C C 56 176.053 176.053 176.335 -0.282 18003
292 1 . 1 1 55 55 ILE CA C 56 60.551 60.551 62.446 -1.895 18003
293 1 . 1 1 55 55 ILE CB C 56 38.497 38.497 38.911 -0.413 18003
294 1 . 1 1 55 55 ILE H H 56 7.507 7.507 7.959 -0.452 18003
295 1 . 1 1 56 56 GLY N N 57 111.108 111.108 108.691 2.417 18003
296 1 . 1 1 56 56 GLY C C 57 174.421 174.421 174.155 0.266 18003
297 1 . 1 1 56 56 GLY CA C 57 46.960 46.960 45.223 1.737 18003
298 1 . 1 1 56 56 GLY H H 57 7.757 7.757 8.015 -0.258 18003
299 1 . 1 1 57 57 MET N N 58 118.089 118.089 118.959 -0.870 18003
300 1 . 1 1 57 57 MET HA H 58 3.933 3.933 4.048 -0.115 18003
301 1 . 1 1 57 57 MET C C 58 174.157 174.157 175.009 -0.852 18003
302 1 . 1 1 57 57 MET CA C 58 54.091 54.091 56.641 -2.550 18003
303 1 . 1 1 57 57 MET CB C 58 38.062 38.062 31.852 6.210 18003
304 1 . 1 1 57 57 MET H H 58 7.659 7.659 7.920 -0.261 18003
305 1 . 1 1 58 58 GLU N N 59 121.656 121.656 119.626 2.030 18003
306 1 . 1 1 58 58 GLU HA H 59 4.340 4.340 4.384 -0.044 18003
307 1 . 1 1 58 58 GLU C C 59 178.355 178.355 176.333 2.022 18003
308 1 . 1 1 58 58 GLU CA C 59 56.643 56.643 56.495 0.148 18003
309 1 . 1 1 58 58 GLU CB C 59 30.029 30.029 30.012 0.017 18003
310 1 . 1 1 58 58 GLU H H 59 8.523 8.523 8.378 0.145 18003
311 1 . 1 1 59 59 GLN N N 60 123.686 123.686 120.257 3.429 18003
312 1 . 1 1 59 59 GLN HA H 60 4.214 4.214 4.017 0.197 18003
313 1 . 1 1 59 59 GLN C C 60 177.961 177.961 177.467 0.494 18003
314 1 . 1 1 59 59 GLN CA C 60 60.616 60.616 58.658 1.958 18003
315 1 . 1 1 59 59 GLN CB C 60 29.015 29.015 28.350 0.665 18003
316 1 . 1 1 59 59 GLN H H 60 9.009 9.009 8.655 0.354 18003
317 1 . 1 1 60 60 SER N N 61 115.101 115.101 115.432 -0.331 18003
318 1 . 1 1 60 60 SER C C 61 176.801 176.801 176.092 0.709 18003
319 1 . 1 1 60 60 SER CA C 61 61.213 61.213 61.002 0.211 18003
320 1 . 1 1 60 60 SER H H 61 8.964 8.964 8.361 0.603 18003
321 1 . 1 1 61 61 ALA N N 62 126.069 126.069 123.998 2.071 18003
322 1 . 1 1 61 61 ALA HA H 62 4.351 4.351 4.144 0.207 18003
323 1 . 1 1 61 61 ALA C C 62 180.635 180.635 179.596 1.039 18003
324 1 . 1 1 61 61 ALA CA C 62 54.258 54.258 54.756 -0.498 18003
325 1 . 1 1 61 61 ALA CB C 62 18.623 18.623 18.294 0.329 18003
326 1 . 1 1 61 61 ALA H H 62 7.103 7.103 7.967 -0.864 18003
327 1 . 1 1 62 62 VAL N N 63 119.252 119.252 119.116 0.136 18003
328 1 . 1 1 62 62 VAL C C 63 177.842 177.842 177.883 -0.041 18003
329 1 . 1 1 62 62 VAL CA C 63 66.798 66.798 66.179 0.619 18003
330 1 . 1 1 62 62 VAL CB C 63 31.264 31.264 31.350 -0.086 18003
331 1 . 1 1 62 62 VAL H H 63 7.971 7.971 7.613 0.358 18003
332 1 . 1 1 63 63 SER N N 64 115.494 115.494 115.704 -0.210 18003
333 1 . 1 1 63 63 SER HA H 64 4.034 4.034 3.931 0.103 18003
334 1 . 1 1 63 63 SER C C 64 176.835 176.835 176.746 0.089 18003
335 1 . 1 1 63 63 SER CA C 64 62.400 62.400 62.028 0.372 18003
336 1 . 1 1 63 63 SER CB C 64 62.752 62.752 62.801 -0.049 18003
337 1 . 1 1 63 63 SER H H 64 8.743 8.743 8.165 0.578 18003
338 1 . 1 1 64 64 HIS N N 65 120.010 120.010 121.174 -1.164 18003
339 1 . 1 1 64 64 HIS HA H 65 4.360 4.360 4.289 0.071 18003
340 1 . 1 1 64 64 HIS C C 65 177.731 177.731 177.572 0.159 18003
341 1 . 1 1 64 64 HIS CA C 65 59.998 59.998 59.685 0.313 18003
342 1 . 1 1 64 64 HIS CB C 65 29.934 29.934 29.803 0.131 18003
343 1 . 1 1 64 64 HIS H H 65 7.804 7.804 8.108 -0.304 18003
344 1 . 1 1 65 65 GLN N N 66 115.590 115.590 119.086 -3.496 18003
345 1 . 1 1 65 65 GLN HA H 66 4.035 4.035 3.993 0.042 18003
346 1 . 1 1 65 65 GLN C C 66 179.055 179.055 178.470 0.585 18003
347 1 . 1 1 65 65 GLN CA C 66 57.530 57.530 58.770 -1.240 18003
348 1 . 1 1 65 65 GLN H H 66 7.751 7.751 8.061 -0.310 18003
349 1 . 1 1 66 66 LEU N N 67 118.746 118.746 120.717 -1.971 18003
350 1 . 1 1 66 66 LEU HA H 67 3.947 3.947 3.935 0.012 18003
351 1 . 1 1 66 66 LEU C C 67 178.334 178.334 178.685 -0.351 18003
352 1 . 1 1 66 66 LEU CA C 67 57.846 57.846 58.042 -0.196 18003
353 1 . 1 1 66 66 LEU CB C 67 41.103 41.103 41.474 -0.371 18003
354 1 . 1 1 66 66 LEU H H 67 8.648 8.648 8.526 0.122 18003
355 1 . 1 1 67 67 ARG N N 68 119.610 119.610 119.072 0.538 18003
356 1 . 1 1 67 67 ARG HA H 68 3.943 3.943 3.936 0.007 18003
357 1 . 1 1 67 67 ARG C C 68 178.807 178.807 178.787 0.020 18003
358 1 . 1 1 67 67 ARG CA C 68 59.377 59.377 59.430 -0.053 18003
359 1 . 1 1 67 67 ARG CB C 68 29.475 29.475 29.904 -0.429 18003
360 1 . 1 1 67 67 ARG H H 68 7.607 7.607 7.952 -0.345 18003
361 1 . 1 1 68 68 VAL N N 69 119.719 119.719 120.031 -0.312 18003
362 1 . 1 1 68 68 VAL HA H 69 3.633 3.633 3.671 -0.038 18003
363 1 . 1 1 68 68 VAL C C 69 178.690 178.690 178.072 0.618 18003
364 1 . 1 1 68 68 VAL CA C 69 66.454 66.454 66.391 0.063 18003
365 1 . 1 1 68 68 VAL CB C 69 31.779 31.779 31.454 0.325 18003
366 1 . 1 1 68 68 VAL H H 69 7.259 7.259 7.769 -0.510 18003
367 1 . 1 1 69 69 LEU N N 70 117.532 117.532 119.502 -1.970 18003
368 1 . 1 1 69 69 LEU HA H 70 3.948 3.948 3.924 0.024 18003
369 1 . 1 1 69 69 LEU C C 70 179.144 179.144 178.944 0.200 18003
370 1 . 1 1 69 69 LEU CA C 70 57.750 57.750 57.993 -0.243 18003
371 1 . 1 1 69 69 LEU CB C 70 41.860 41.860 41.223 0.637 18003
372 1 . 1 1 69 69 LEU H H 70 8.375 8.375 8.229 0.146 18003
373 1 . 1 1 70 70 ARG N N 71 122.498 122.498 119.417 3.081 18003
374 1 . 1 1 70 70 ARG HA H 71 3.931 3.931 3.978 -0.047 18003
375 1 . 1 1 70 70 ARG C C 71 180.499 180.499 178.722 1.777 18003
376 1 . 1 1 70 70 ARG CA C 71 58.777 58.777 59.330 -0.553 18003
377 1 . 1 1 70 70 ARG CB C 71 30.155 30.155 29.953 0.202 18003
378 1 . 1 1 70 70 ARG H H 71 8.822 8.822 8.509 0.313 18003
379 1 . 1 1 71 71 ASN N N 72 121.816 121.816 117.656 4.160 18003
380 1 . 1 1 71 71 ASN C C 72 177.170 177.170 177.537 -0.367 18003
381 1 . 1 1 71 71 ASN CA C 72 55.777 55.777 55.574 0.203 18003
382 1 . 1 1 71 71 ASN CB C 72 37.734 37.734 38.227 -0.493 18003
383 1 . 1 1 71 71 ASN H H 72 8.144 8.144 7.843 0.301 18003
384 1 . 1 1 72 72 LEU N N 73 117.044 117.044 117.809 -0.765 18003
385 1 . 1 1 72 72 LEU HA H 73 4.345 4.345 4.261 0.084 18003
386 1 . 1 1 72 72 LEU C C 73 176.984 176.984 177.902 -0.918 18003
387 1 . 1 1 72 72 LEU CA C 73 55.125 55.125 56.114 -0.989 18003
388 1 . 1 1 72 72 LEU CB C 73 43.269 43.269 42.311 0.958 18003
389 1 . 1 1 72 72 LEU H H 73 7.804 7.804 7.642 0.162 18003
390 1 . 1 1 73 73 GLY N N 74 106.621 106.621 105.887 0.734 18003
391 1 . 1 1 73 73 GLY C C 74 173.266 173.266 174.132 -0.866 18003
392 1 . 1 1 73 73 GLY CA C 74 46.022 46.022 45.070 0.952 18003
393 1 . 1 1 73 73 GLY H H 74 7.851 7.851 8.228 -0.377 18003
394 1 . 1 1 74 74 LEU N N 75 114.582 114.582 120.003 -5.421 18003
395 1 . 1 1 74 74 LEU C C 75 177.562 177.562 175.716 1.846 18003
396 1 . 1 1 74 74 LEU CA C 75 56.031 56.031 55.423 0.608 18003
397 1 . 1 1 74 74 LEU CB C 75 44.444 44.444 43.053 1.391 18003
398 1 . 1 1 74 74 LEU H H 75 7.808 7.808 7.993 -0.185 18003
399 1 . 1 1 75 75 VAL N N 76 110.980 110.980 112.834 -1.854 18003
400 1 . 1 1 75 75 VAL HA H 76 4.527 4.527 4.719 -0.192 18003
401 1 . 1 1 75 75 VAL C C 76 173.922 173.922 174.131 -0.209 18003
402 1 . 1 1 75 75 VAL CA C 76 57.943 57.943 60.285 -2.342 18003
403 1 . 1 1 75 75 VAL CB C 76 36.029 36.029 35.530 0.499 18003
404 1 . 1 1 75 75 VAL H H 76 7.079 7.079 7.399 -0.320 18003
405 1 . 1 1 76 76 VAL N N 77 118.619 118.619 120.181 -1.562 18003
406 1 . 1 1 76 76 VAL HA H 77 5.302 5.302 4.534 0.768 18003
407 1 . 1 1 76 76 VAL C C 77 174.041 174.041 174.503 -0.462 18003
408 1 . 1 1 76 76 VAL CA C 77 59.999 59.999 60.748 -0.749 18003
409 1 . 1 1 76 76 VAL H H 77 9.024 9.024 9.199 -0.175 18003
410 1 . 1 1 77 77 GLY N N 78 109.451 109.451 109.855 -0.404 18003
411 1 . 1 1 77 77 GLY C C 78 172.225 172.225 172.697 -0.472 18003
412 1 . 1 1 77 77 GLY CA C 78 44.462 44.462 44.354 0.108 18003
413 1 . 1 1 77 77 GLY H H 78 8.265 8.265 8.367 -0.102 18003
414 1 . 1 1 78 78 ASP N N 79 122.826 122.826 122.646 0.180 18003
415 1 . 1 1 78 78 ASP HA H 79 4.746 4.746 4.824 -0.078 18003
416 1 . 1 1 78 78 ASP C C 79 174.817 174.817 175.178 -0.361 18003
417 1 . 1 1 78 78 ASP CA C 79 53.111 53.111 52.839 0.272 18003
418 1 . 1 1 78 78 ASP CB C 79 43.655 43.655 43.204 0.451 18003
419 1 . 1 1 78 78 ASP H H 79 8.479 8.479 8.401 0.078 18003
420 1 . 1 1 79 79 ARG N N 80 122.613 122.613 124.714 -2.101 18003
421 1 . 1 1 79 79 ARG HA H 80 4.412 4.412 4.342 0.070 18003
422 1 . 1 1 79 79 ARG C C 80 175.546 175.546 175.096 0.450 18003
423 1 . 1 1 79 79 ARG CA C 80 56.318 56.318 56.053 0.266 18003
424 1 . 1 1 79 79 ARG CB C 80 30.376 30.376 31.105 -0.729 18003
425 1 . 1 1 79 79 ARG H H 80 8.580 8.580 8.606 -0.026 18003
426 1 . 1 1 80 80 ALA N N 81 129.263 129.263 128.486 0.777 18003
427 1 . 1 1 80 80 ALA HA H 81 4.452 4.452 4.585 -0.133 18003
428 1 . 1 1 80 80 ALA C C 81 177.126 177.126 176.905 0.221 18003
429 1 . 1 1 80 80 ALA CA C 81 51.620 51.620 51.412 0.208 18003
430 1 . 1 1 80 80 ALA CB C 81 19.260 19.260 20.680 -1.420 18003
431 1 . 1 1 80 80 ALA H H 81 8.396 8.396 8.508 -0.112 18003
432 1 . 1 1 81 81 GLY N N 82 112.739 112.739 111.120 1.619 18003
433 1 . 1 1 81 81 GLY C C 82 174.856 174.856 175.056 -0.200 18003
434 1 . 1 1 81 81 GLY CA C 82 46.392 46.392 46.658 -0.266 18003
435 1 . 1 1 81 81 GLY H H 82 8.641 8.641 8.651 -0.010 18003
436 1 . 1 1 82 82 ARG N N 83 124.780 124.780 120.988 3.792 18003
437 1 . 1 1 82 82 ARG HA H 83 4.323 4.323 4.401 -0.078 18003
438 1 . 1 1 82 82 ARG C C 83 176.339 176.339 175.448 0.891 18003
439 1 . 1 1 82 82 ARG CA C 83 56.690 56.690 56.230 0.460 18003
440 1 . 1 1 82 82 ARG CB C 83 30.221 30.221 30.632 -0.411 18003
441 1 . 1 1 82 82 ARG H H 83 8.728 8.728 8.391 0.337 18003
442 1 . 1 1 83 83 SER N N 84 114.678 114.678 113.498 1.180 18003
443 1 . 1 1 83 83 SER C C 84 172.869 172.869 172.313 0.556 18003
444 1 . 1 1 83 83 SER CA C 84 56.834 56.834 57.495 -0.661 18003
445 1 . 1 1 83 83 SER CB C 84 65.191 65.191 65.642 -0.451 18003
446 1 . 1 1 83 83 SER H H 84 7.821 7.821 7.957 -0.136 18003
447 1 . 1 1 84 84 ILE N N 85 122.996 122.996 122.059 0.937 18003
448 1 . 1 1 84 84 ILE C C 85 175.521 175.521 174.030 1.491 18003
449 1 . 1 1 84 84 ILE CA C 85 60.235 60.235 59.389 0.846 18003
450 1 . 1 1 84 84 ILE CB C 85 38.136 38.136 40.630 -2.494 18003
451 1 . 1 1 84 84 ILE H H 85 8.232 8.232 8.308 -0.076 18003
452 1 . 1 1 85 85 VAL N N 86 121.845 121.845 124.629 -2.784 18003
453 1 . 1 1 85 85 VAL HA H 86 4.310 4.310 4.265 0.045 18003
454 1 . 1 1 85 85 VAL C C 86 174.818 174.818 174.215 0.603 18003
455 1 . 1 1 85 85 VAL CA C 86 59.738 59.738 60.427 -0.689 18003
456 1 . 1 1 85 85 VAL CB C 86 34.221 34.221 34.300 -0.079 18003
457 1 . 1 1 85 85 VAL H H 86 8.495 8.495 8.326 0.169 18003
458 1 . 1 1 86 86 TYR N N 87 125.020 125.020 125.721 -0.701 18003
459 1 . 1 1 86 86 TYR HA H 87 4.319 4.319 4.962 -0.643 18003
460 1 . 1 1 86 86 TYR C C 87 173.808 173.808 175.516 -1.708 18003
461 1 . 1 1 86 86 TYR CA C 87 57.465 57.465 57.526 -0.061 18003
462 1 . 1 1 86 86 TYR CB C 87 41.480 41.480 39.898 1.582 18003
463 1 . 1 1 86 86 TYR H H 87 8.488 8.488 8.621 -0.133 18003
464 1 . 1 1 87 87 SER N N 88 110.681 110.681 115.190 -4.509 18003
465 1 . 1 1 87 87 SER HA H 88 5.414 5.414 4.880 0.534 18003
466 1 . 1 1 87 87 SER C C 88 174.693 174.693 173.111 1.582 18003
467 1 . 1 1 87 87 SER CA C 88 56.113 56.113 56.572 -0.459 18003
468 1 . 1 1 87 87 SER CB C 88 66.309 66.309 66.464 -0.155 18003
469 1 . 1 1 87 87 SER H H 88 8.718 8.718 9.171 -0.453 18003
470 1 . 1 1 88 88 LEU N N 89 119.612 119.612 122.485 -2.873 18003
471 1 . 1 1 88 88 LEU HA H 89 4.927 4.927 4.290 0.637 18003
472 1 . 1 1 88 88 LEU C C 89 179.031 179.031 177.709 1.322 18003
473 1 . 1 1 88 88 LEU CA C 89 55.325 55.325 55.358 -0.033 18003
474 1 . 1 1 88 88 LEU CB C 89 41.720 41.720 42.024 -0.304 18003
475 1 . 1 1 88 88 LEU H H 89 9.034 9.034 8.538 0.496 18003
476 1 . 1 1 89 89 TYR N N 90 120.540 120.540 123.994 -3.454 18003
477 1 . 1 1 89 89 TYR HA H 90 4.622 4.622 4.164 0.458 18003
478 1 . 1 1 89 89 TYR CA C 90 61.712 61.712 60.859 0.853 18003
479 1 . 1 1 89 89 TYR H H 90 8.075 8.075 8.486 -0.411 18003
480 1 . 1 1 92 92 HIS C C 93 177.850 177.850 177.417 0.433 18003
481 1 . 1 1 93 93 VAL N N 94 120.211 120.211 118.094 2.117 18003
482 1 . 1 1 93 93 VAL HA H 94 3.501 3.501 3.680 -0.179 18003
483 1 . 1 1 93 93 VAL C C 94 176.785 176.785 177.455 -0.670 18003
484 1 . 1 1 93 93 VAL CA C 94 66.666 66.666 65.893 0.773 18003
485 1 . 1 1 93 93 VAL CB C 94 31.637 31.637 31.136 0.501 18003
486 1 . 1 1 93 93 VAL H H 94 8.164 8.164 8.110 0.054 18003
487 1 . 1 1 94 94 ALA N N 95 119.221 119.221 120.990 -1.769 18003
488 1 . 1 1 94 94 ALA HA H 95 3.790 3.790 3.965 -0.175 18003
489 1 . 1 1 94 94 ALA C C 95 177.979 177.979 179.655 -1.676 18003
490 1 . 1 1 94 94 ALA CA C 95 55.479 55.479 55.175 0.304 18003
491 1 . 1 1 94 94 ALA CB C 95 18.110 18.110 18.098 0.012 18003
492 1 . 1 1 94 94 ALA H H 95 6.942 6.942 7.825 -0.883 18003
493 1 . 1 1 95 95 GLN N N 96 115.416 115.416 119.152 -3.736 18003
494 1 . 1 1 95 95 GLN HA H 96 4.035 4.035 4.079 -0.044 18003
495 1 . 1 1 95 95 GLN C C 96 177.993 177.993 178.441 -0.448 18003
496 1 . 1 1 95 95 GLN CA C 96 58.842 58.842 58.589 0.253 18003
497 1 . 1 1 95 95 GLN CB C 96 28.029 28.029 28.494 -0.465 18003
498 1 . 1 1 95 95 GLN H H 96 7.795 7.795 8.044 -0.249 18003
499 1 . 1 1 96 96 LEU N N 97 120.758 120.758 120.818 -0.060 18003
500 1 . 1 1 96 96 LEU HA H 97 3.849 3.849 4.066 -0.217 18003
501 1 . 1 1 96 96 LEU C C 97 177.974 177.974 178.949 -0.975 18003
502 1 . 1 1 96 96 LEU CA C 97 59.282 59.282 58.154 1.128 18003
503 1 . 1 1 96 96 LEU CB C 97 41.046 41.046 41.662 -0.616 18003
504 1 . 1 1 96 96 LEU H H 97 8.197 8.197 7.998 0.199 18003
505 1 . 1 1 97 97 LEU N N 98 117.567 117.567 119.651 -2.084 18003
506 1 . 1 1 97 97 LEU HA H 98 3.830 3.830 3.908 -0.078 18003
507 1 . 1 1 97 97 LEU C C 98 178.219 178.219 178.847 -0.628 18003
508 1 . 1 1 97 97 LEU CA C 98 57.730 57.730 58.331 -0.601 18003
509 1 . 1 1 97 97 LEU CB C 98 41.862 41.862 41.150 0.712 18003
510 1 . 1 1 97 97 LEU H H 98 7.660 7.660 8.221 -0.561 18003
511 1 . 1 1 98 98 ASP N N 99 118.607 118.607 119.853 -1.246 18003
512 1 . 1 1 98 98 ASP HA H 99 4.109 4.109 4.350 -0.241 18003
513 1 . 1 1 98 98 ASP C C 99 179.382 179.382 178.975 0.407 18003
514 1 . 1 1 98 98 ASP CA C 99 58.035 58.035 57.741 0.294 18003
515 1 . 1 1 98 98 ASP CB C 99 39.839 39.839 40.274 -0.435 18003
516 1 . 1 1 98 98 ASP H H 99 8.295 8.295 8.358 -0.063 18003
517 1 . 1 1 99 99 GLU N N 100 117.542 117.542 119.826 -2.284 18003
518 1 . 1 1 99 99 GLU HA H 100 3.849 3.849 4.064 -0.215 18003
519 1 . 1 1 99 99 GLU C C 100 179.389 179.389 178.972 0.417 18003
520 1 . 1 1 99 99 GLU CA C 100 58.023 58.023 59.140 -1.117 18003
521 1 . 1 1 99 99 GLU CB C 100 29.029 29.029 29.444 -0.415 18003
522 1 . 1 1 99 99 GLU H H 100 8.334 8.334 7.974 0.360 18003
523 1 . 1 1 100 100 ALA N N 101 122.890 122.890 123.324 -0.434 18003
524 1 . 1 1 100 100 ALA HA H 101 3.998 3.998 4.106 -0.108 18003
525 1 . 1 1 100 100 ALA C C 101 180.184 180.184 179.823 0.361 18003
526 1 . 1 1 100 100 ALA CA C 101 55.520 55.520 55.359 0.161 18003
527 1 . 1 1 100 100 ALA CB C 101 17.619 17.619 18.449 -0.831 18003
528 1 . 1 1 100 100 ALA H H 101 8.550 8.550 8.249 0.301 18003
529 1 . 1 1 101 101 ILE N N 102 119.952 119.952 119.079 0.873 18003
530 1 . 1 1 101 101 ILE HA H 102 3.589 3.589 3.760 -0.171 18003
531 1 . 1 1 101 101 ILE C C 102 178.114 178.114 177.765 0.349 18003
532 1 . 1 1 101 101 ILE CA C 102 65.376 65.376 64.768 0.608 18003
533 1 . 1 1 101 101 ILE CB C 102 38.029 38.029 37.161 0.868 18003
534 1 . 1 1 101 101 ILE H H 102 8.493 8.493 8.592 -0.099 18003
535 1 . 1 1 102 102 TYR N N 103 120.625 120.625 120.766 -0.141 18003
536 1 . 1 1 102 102 TYR HA H 103 4.171 4.171 4.067 0.104 18003
537 1 . 1 1 102 102 TYR C C 103 179.772 179.772 178.029 1.743 18003
538 1 . 1 1 102 102 TYR CA C 103 60.724 60.724 61.761 -1.037 18003
539 1 . 1 1 102 102 TYR CB C 103 37.500 37.500 37.999 -0.499 18003
540 1 . 1 1 102 102 TYR H H 103 8.520 8.520 8.335 0.185 18003
541 1 . 1 1 103 103 HIS N N 104 117.456 117.456 118.342 -0.886 18003
542 1 . 1 1 103 103 HIS HA H 104 4.425 4.425 4.244 0.181 18003
543 1 . 1 1 103 103 HIS C C 104 176.377 176.377 177.559 -1.182 18003
544 1 . 1 1 103 103 HIS CA C 104 60.043 60.043 59.249 0.794 18003
545 1 . 1 1 103 103 HIS CB C 104 29.029 29.029 29.767 -0.738 18003
546 1 . 1 1 103 103 HIS H H 104 8.622 8.622 8.703 -0.081 18003
547 1 . 1 1 104 104 SER N N 105 113.596 113.596 114.264 -0.668 18003
548 1 . 1 1 104 104 SER C C 105 176.712 176.712 176.342 0.370 18003
549 1 . 1 1 104 104 SER CA C 105 61.852 61.852 61.057 0.795 18003
550 1 . 1 1 104 104 SER CB C 105 63.550 63.550 63.328 0.222 18003
551 1 . 1 1 104 104 SER H H 105 7.900 7.900 8.161 -0.261 18003
552 1 . 1 1 105 105 GLU N N 106 119.022 119.022 120.754 -1.732 18003
553 1 . 1 1 105 105 GLU HA H 106 4.013 4.013 4.015 -0.002 18003
554 1 . 1 1 105 105 GLU C C 106 177.902 177.902 178.170 -0.268 18003
555 1 . 1 1 105 105 GLU CA C 106 58.031 58.031 58.478 -0.447 18003
556 1 . 1 1 105 105 GLU CB C 106 29.279 29.279 29.680 -0.401 18003
557 1 . 1 1 105 105 GLU H H 106 8.181 8.181 8.125 0.056 18003
558 1 . 1 1 106 106 HIS N N 107 116.482 116.482 117.420 -0.938 18003
559 1 . 1 1 106 106 HIS HA H 107 4.407 4.407 4.192 0.215 18003
560 1 . 1 1 106 106 HIS C C 107 175.575 175.575 175.894 -0.319 18003
561 1 . 1 1 106 106 HIS CA C 107 57.343 57.343 58.113 -0.771 18003
562 1 . 1 1 106 106 HIS CB C 107 28.580 28.580 30.004 -1.424 18003
563 1 . 1 1 106 106 HIS H H 107 7.770 7.770 7.823 -0.053 18003
564 1 . 1 1 107 107 LEU N N 108 120.346 120.346 118.556 1.790 18003
565 1 . 1 1 107 107 LEU HA H 108 4.054 4.054 4.227 -0.173 18003
566 1 . 1 1 107 107 LEU C C 108 177.404 177.404 175.804 1.600 18003
567 1 . 1 1 107 107 LEU CA C 108 55.991 55.991 55.046 0.945 18003
568 1 . 1 1 107 107 LEU CB C 108 42.030 42.030 42.392 -0.362 18003
569 1 . 1 1 107 107 LEU H H 108 7.682 7.682 7.624 0.058 18003
570 1 . 1 1 108 108 HIS N N 109 117.222 117.222 119.301 -2.079 18003
571 1 . 1 1 108 108 HIS HA H 109 4.054 4.054 4.476 -0.422 18003
572 1 . 1 1 108 108 HIS C C 109 174.606 174.606 175.438 -0.832 18003
573 1 . 1 1 108 108 HIS CA C 109 56.029 56.029 56.002 0.027 18003
574 1 . 1 1 108 108 HIS CB C 109 28.517 28.517 29.766 -1.249 18003
575 1 . 1 1 108 108 HIS H H 109 8.030 8.030 8.045 -0.014 18003
576 1 . 1 1 109 109 LEU N N 110 121.114 121.114 122.162 -1.048 18003
577 1 . 1 1 109 109 LEU HA H 110 4.298 4.298 4.128 0.170 18003
578 1 . 1 1 109 109 LEU C C 110 178.028 178.028 177.635 0.393 18003
579 1 . 1 1 109 109 LEU CA C 110 55.574 55.574 55.896 -0.322 18003
580 1 . 1 1 109 109 LEU CB C 110 42.076 42.076 41.847 0.229 18003
581 1 . 1 1 109 109 LEU H H 110 7.973 7.973 8.279 -0.306 18003
582 1 . 1 1 110 110 GLY N N 111 108.631 108.631 106.312 2.319 18003
583 1 . 1 1 110 110 GLY C C 111 174.606 174.606 174.441 0.165 18003
584 1 . 1 1 110 110 GLY CA C 111 45.580 45.580 44.792 0.788 18003
585 1 . 1 1 110 110 GLY H H 111 8.255 8.255 7.880 0.375 18003
586 1 . 1 1 111 111 LEU N N 112 121.022 121.022 120.770 0.252 18003
587 1 . 1 1 111 111 LEU HA H 112 4.359 4.359 4.475 -0.116 18003
588 1 . 1 1 111 111 LEU C C 112 177.701 177.701 176.836 0.865 18003
589 1 . 1 1 111 111 LEU CA C 112 55.476 55.476 54.572 0.904 18003
590 1 . 1 1 111 111 LEU CB C 112 41.899 41.899 42.267 -0.368 18003
591 1 . 1 1 111 111 LEU H H 112 7.981 7.981 8.045 -0.064 18003
592 1 . 1 1 112 112 SER N N 113 115.471 115.471 117.046 -1.575 18003
593 1 . 1 1 112 112 SER HA H 113 4.432 4.432 4.375 0.057 18003
594 1 . 1 1 112 112 SER C C 113 174.381 174.381 173.968 0.413 18003
595 1 . 1 1 112 112 SER CA C 113 58.527 58.527 58.626 -0.099 18003
596 1 . 1 1 112 112 SER CB C 113 63.593 63.593 63.747 -0.154 18003
597 1 . 1 1 112 112 SER H H 113 8.215 8.215 8.274 -0.059 18003
598 1 . 1 1 113 113 ASP N N 114 121.696 121.696 122.166 -0.470 18003
599 1 . 1 1 113 113 ASP HA H 114 4.427 4.427 4.625 -0.198 18003
600 1 . 1 1 113 113 ASP C C 114 175.958 175.958 175.788 0.170 18003
601 1 . 1 1 113 113 ASP CA C 114 54.213 54.213 54.172 0.041 18003
602 1 . 1 1 113 113 ASP CB C 114 41.030 41.030 41.123 -0.093 18003
603 1 . 1 1 113 113 ASP H H 114 8.203 8.203 8.436 -0.233 18003
604 1 . 1 1 114 114 ARG N N 115 120.088 120.088 120.354 -0.266 18003
605 1 . 1 1 114 114 ARG HA H 115 4.272 4.272 4.260 0.012 18003
606 1 . 1 1 114 114 ARG C C 115 175.792 175.792 175.685 0.107 18003
607 1 . 1 1 114 114 ARG CA C 115 55.735 55.735 56.347 -0.612 18003
608 1 . 1 1 114 114 ARG CB C 115 30.586 30.586 30.537 0.049 18003
609 1 . 1 1 114 114 ARG H H 115 8.016 8.016 8.240 -0.224 18003
610 1 . 1 1 115 115 HIS N N 116 120.597 120.597 120.317 0.280 18003
611 1 . 1 1 115 115 HIS CA C 116 53.697 53.697 55.117 -1.420 18003
612 1 . 1 1 115 115 HIS CB C 116 29.299 29.299 29.279 0.020 18003
613 1 . 1 1 115 115 HIS H H 116 8.385 8.385 8.314 0.071 18003
614 1 . 1 1 116 116 PRO HA H 117 4.482 4.482 4.370 0.112 18003
615 1 . 1 1 116 116 PRO C C 117 177.090 177.090 176.796 0.294 18003
616 1 . 1 1 116 116 PRO CA C 117 63.177 63.177 63.466 -0.289 18003
617 1 . 1 1 116 116 PRO CB C 117 31.820 31.820 32.277 -0.457 18003
618 1 . 1 1 117 117 SER N N 118 116.220 116.220 115.948 0.272 18003
619 1 . 1 1 117 117 SER HA H 118 4.465 4.465 4.347 0.118 18003
620 1 . 1 1 117 117 SER C C 118 174.287 174.287 174.601 -0.314 18003
621 1 . 1 1 117 117 SER CA C 118 58.110 58.110 58.708 -0.598 18003
622 1 . 1 1 117 117 SER CB C 118 63.750 63.750 63.603 0.147 18003
623 1 . 1 1 117 117 SER H H 118 8.487 8.487 8.174 0.313 18003
624 1 . 1 1 118 118 ALA N N 119 126.082 126.082 124.593 1.489 18003
625 1 . 1 1 118 118 ALA HA H 119 4.439 4.439 4.315 0.124 18003
626 1 . 1 1 118 118 ALA C C 119 176.879 176.879 177.547 -0.668 18003
627 1 . 1 1 118 118 ALA CA C 119 52.449 52.449 52.483 -0.034 18003
628 1 . 1 1 118 118 ALA CB C 119 19.483 19.483 18.851 0.632 18003
629 1 . 1 1 118 118 ALA H H 119 8.295 8.295 8.238 0.057 18003
stop_
save_