data_25541
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25541
_Entry.PDB_ID 2N0Z
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 25541
_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 10 10 THR N N 10 114.351 114.351 115.027 -0.676 25541
2 1 1 . 1 1 10 10 THR HA H 10 4.241 4.241 4.418 -0.177 25541
3 1 1 . 1 1 10 10 THR C C 10 171.741 171.741 172.619 -0.878 25541
4 1 1 . 1 1 10 10 THR CA C 10 62.002 62.002 62.445 -0.443 25541
5 1 1 . 1 1 10 10 THR CB C 10 69.796 69.796 70.086 -0.290 25541
6 1 1 . 1 1 10 10 THR H H 10 8.114 8.114 8.179 -0.065 25541
7 1 1 . 1 1 11 11 LYS N N 11 124.677 124.677 127.936 -3.259 25541
8 1 1 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.401 -0.237 25541
9 1 1 . 1 1 11 11 LYS C C 11 172.964 172.964 174.877 -1.913 25541
10 1 1 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.662 -0.540 25541
11 1 1 . 1 1 11 11 LYS CB C 11 32.819 32.819 33.701 -0.882 25541
12 1 1 . 1 1 11 11 LYS H H 11 8.436 8.436 8.438 -0.002 25541
13 1 1 . 1 1 12 12 LYS N N 12 123.337 123.337 122.485 0.852 25541
14 1 1 . 1 1 12 12 LYS HA H 12 4.093 4.093 4.300 -0.207 25541
15 1 1 . 1 1 12 12 LYS C C 12 173.147 173.147 175.122 -1.975 25541
16 1 1 . 1 1 12 12 LYS CA C 12 56.327 56.327 55.531 0.796 25541
17 1 1 . 1 1 12 12 LYS CB C 12 33.223 33.223 33.132 0.091 25541
18 1 1 . 1 1 12 12 LYS H H 12 8.239 8.239 7.873 0.366 25541
19 1 1 . 1 1 13 13 TYR N N 13 119.233 119.233 117.402 1.831 25541
20 1 1 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.639 -0.238 25541
21 1 1 . 1 1 13 13 TYR C C 13 172.016 172.016 174.333 -2.317 25541
22 1 1 . 1 1 13 13 TYR CA C 13 57.325 57.325 56.902 0.423 25541
23 1 1 . 1 1 13 13 TYR CB C 13 39.864 39.864 40.611 -0.747 25541
24 1 1 . 1 1 13 13 TYR H H 13 8.274 8.274 8.075 0.199 25541
25 1 1 . 1 1 14 14 ASP N N 14 120.486 120.486 122.878 -2.392 25541
26 1 1 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.960 -0.283 25541
27 1 1 . 1 1 14 14 ASP C C 14 173.276 173.276 176.299 -3.023 25541
28 1 1 . 1 1 14 14 ASP CA C 14 52.719 52.719 53.863 -1.144 25541
29 1 1 . 1 1 14 14 ASP CB C 14 40.205 40.205 40.837 -0.632 25541
30 1 1 . 1 1 14 14 ASP H H 14 8.603 8.603 8.708 -0.105 25541
31 1 1 . 1 1 15 15 LEU N N 15 126.405 126.405 127.338 -0.933 25541
32 1 1 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.041 -1.276 25541
33 1 1 . 1 1 15 15 LEU C C 15 175.592 175.592 177.001 -1.409 25541
34 1 1 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.145 -0.890 25541
35 1 1 . 1 1 15 15 LEU CB C 15 39.967 39.967 40.867 -0.900 25541
36 1 1 . 1 1 15 15 LEU H H 15 8.901 8.901 8.625 0.276 25541
37 1 1 . 1 1 16 16 SER N N 16 116.540 116.540 115.807 0.733 25541
38 1 1 . 1 1 16 16 SER HA H 16 4.100 4.100 4.214 -0.114 25541
39 1 1 . 1 1 16 16 SER C C 16 173.247 173.247 174.664 -1.417 25541
40 1 1 . 1 1 16 16 SER CA C 16 61.720 61.720 60.758 0.962 25541
41 1 1 . 1 1 16 16 SER CB C 16 62.797 62.797 63.580 -0.783 25541
42 1 1 . 1 1 16 16 SER H H 16 8.112 8.112 7.989 0.123 25541
43 1 1 . 1 1 17 17 LYS N N 17 118.008 118.008 120.365 -2.357 25541
44 1 1 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.624 -0.123 25541
45 1 1 . 1 1 17 17 LYS C C 17 175.079 175.079 175.178 -0.099 25541
46 1 1 . 1 1 17 17 LYS CA C 17 55.267 55.267 56.095 -0.828 25541
47 1 1 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.276 -2.299 25541
48 1 1 . 1 1 17 17 LYS H H 17 8.521 8.521 8.215 0.306 25541
49 1 1 . 1 1 18 18 TRP N N 18 122.041 122.041 122.576 -0.535 25541
50 1 1 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.831 -0.253 25541
51 1 1 . 1 1 18 18 TRP C C 18 174.862 174.862 174.886 -0.024 25541
52 1 1 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.094 1.277 25541
53 1 1 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.394 -3.850 25541
54 1 1 . 1 1 18 18 TRP H H 18 7.853 7.853 8.572 -0.719 25541
55 1 1 . 1 1 19 19 LYS N N 19 123.185 123.185 121.419 1.766 25541
56 1 1 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.758 -0.223 25541
57 1 1 . 1 1 19 19 LYS C C 19 175.094 175.094 176.886 -1.792 25541
58 1 1 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.869 0.558 25541
59 1 1 . 1 1 19 19 LYS CB C 19 33.120 33.120 34.269 -1.149 25541
60 1 1 . 1 1 19 19 LYS H H 19 9.544 9.544 8.560 0.984 25541
61 1 1 . 1 1 20 20 TYR N N 20 124.291 124.291 126.119 -1.828 25541
62 1 1 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.099 -0.074 25541
63 1 1 . 1 1 20 20 TYR C C 20 174.531 174.531 177.259 -2.728 25541
64 1 1 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.999 0.150 25541
65 1 1 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.444 -0.291 25541
66 1 1 . 1 1 20 20 TYR H H 20 9.266 9.266 9.228 0.038 25541
67 1 1 . 1 1 21 21 ALA N N 21 117.781 117.781 120.186 -2.405 25541
68 1 1 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.184 -0.311 25541
69 1 1 . 1 1 21 21 ALA C C 21 176.314 176.314 179.598 -3.284 25541
70 1 1 . 1 1 21 21 ALA CA C 21 55.335 55.335 55.202 0.133 25541
71 1 1 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.975 0.728 25541
72 1 1 . 1 1 21 21 ALA H H 21 8.986 8.986 8.516 0.470 25541
73 1 1 . 1 1 22 22 GLU N N 22 115.218 115.218 119.510 -4.292 25541
74 1 1 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.163 -0.044 25541
75 1 1 . 1 1 22 22 GLU C C 22 177.380 177.380 179.179 -1.799 25541
76 1 1 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.380 -0.901 25541
77 1 1 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.132 0.738 25541
78 1 1 . 1 1 22 22 GLU H H 22 6.854 6.854 7.628 -0.774 25541
79 1 1 . 1 1 23 23 LEU N N 23 122.132 122.132 120.567 1.565 25541
80 1 1 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.139 0.017 25541
81 1 1 . 1 1 23 23 LEU C C 23 174.830 174.830 179.894 -5.064 25541
82 1 1 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.241 0.281 25541
83 1 1 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.839 1.280 25541
84 1 1 . 1 1 23 23 LEU H H 23 7.909 7.909 8.959 -1.050 25541
85 1 1 . 1 1 24 24 ARG N N 24 118.051 118.051 119.024 -0.973 25541
86 1 1 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.854 -0.217 25541
87 1 1 . 1 1 24 24 ARG C C 24 175.240 175.240 178.404 -3.164 25541
88 1 1 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.729 0.247 25541
89 1 1 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.767 0.095 25541
90 1 1 . 1 1 24 24 ARG H H 24 8.250 8.250 8.283 -0.033 25541
91 1 1 . 1 1 25 25 ASP N N 25 118.179 118.179 119.654 -1.475 25541
92 1 1 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.480 -0.095 25541
93 1 1 . 1 1 25 25 ASP C C 25 176.554 176.554 178.277 -1.723 25541
94 1 1 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.295 0.061 25541
95 1 1 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.335 -0.293 25541
96 1 1 . 1 1 25 25 ASP H H 25 8.507 8.507 8.225 0.282 25541
97 1 1 . 1 1 26 26 THR N N 26 118.299 118.299 116.917 1.382 25541
98 1 1 . 1 1 26 26 THR HA H 26 3.891 3.891 4.029 -0.138 25541
99 1 1 . 1 1 26 26 THR C C 26 173.365 173.365 176.725 -3.360 25541
100 1 1 . 1 1 26 26 THR CA C 26 67.787 67.787 66.816 0.971 25541
101 1 1 . 1 1 26 26 THR CB C 26 68.120 68.120 68.824 -0.704 25541
102 1 1 . 1 1 26 26 THR H H 26 7.918 7.918 8.458 -0.540 25541
103 1 1 . 1 1 27 27 ILE N N 27 122.576 122.576 117.712 4.864 25541
104 1 1 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.880 -0.255 25541
105 1 1 . 1 1 27 27 ILE C C 27 174.485 174.485 175.934 -1.449 25541
106 1 1 . 1 1 27 27 ILE CA C 27 64.711 64.711 63.481 1.230 25541
107 1 1 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.741 -0.214 25541
108 1 1 . 1 1 27 27 ILE H H 27 8.159 8.159 7.331 0.828 25541
109 1 1 . 1 1 28 28 ASN N N 28 115.118 115.118 115.992 -0.874 25541
110 1 1 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.791 -0.176 25541
111 1 1 . 1 1 28 28 ASN C C 28 173.902 173.902 175.292 -1.390 25541
112 1 1 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.861 0.599 25541
113 1 1 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.552 -0.322 25541
114 1 1 . 1 1 28 28 ASN H H 28 7.713 7.713 7.607 0.106 25541
115 1 1 . 1 1 29 29 THR N N 29 107.730 107.730 109.638 -1.908 25541
116 1 1 . 1 1 29 29 THR HA H 29 4.600 4.600 4.479 0.121 25541
117 1 1 . 1 1 29 29 THR C C 29 172.290 172.290 174.805 -2.515 25541
118 1 1 . 1 1 29 29 THR CA C 29 62.595 62.595 62.485 0.110 25541
119 1 1 . 1 1 29 29 THR CB C 29 72.291 72.291 69.956 2.336 25541
120 1 1 . 1 1 29 29 THR H H 29 7.587 7.587 7.765 -0.178 25541
121 1 1 . 1 1 30 30 SER N N 30 117.784 117.784 117.699 0.085 25541
122 1 1 . 1 1 30 30 SER HA H 30 4.296 4.296 4.573 -0.277 25541
123 1 1 . 1 1 30 30 SER C C 30 172.473 172.473 173.088 -0.615 25541
124 1 1 . 1 1 30 30 SER CA C 30 59.618 59.618 58.249 1.369 25541
125 1 1 . 1 1 30 30 SER CB C 30 64.402 64.402 64.503 -0.101 25541
126 1 1 . 1 1 30 30 SER H H 30 8.698 8.698 8.062 0.636 25541
127 1 1 . 1 1 31 31 CYS N N 31 121.196 121.196 119.415 1.781 25541
128 1 1 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.608 0.179 25541
129 1 1 . 1 1 31 31 CYS C C 31 170.861 170.861 172.462 -1.601 25541
130 1 1 . 1 1 31 31 CYS CA C 31 57.372 57.372 58.952 -1.580 25541
131 1 1 . 1 1 31 31 CYS CB C 31 28.364 28.364 28.868 -0.504 25541
132 1 1 . 1 1 31 31 CYS H H 31 8.713 8.713 8.397 0.316 25541
133 1 1 . 1 1 32 32 ASP N N 32 124.610 124.610 126.398 -1.788 25541
134 1 1 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.683 -0.070 25541
135 1 1 . 1 1 32 32 ASP C C 32 172.541 172.541 175.745 -3.204 25541
136 1 1 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.075 -0.890 25541
137 1 1 . 1 1 32 32 ASP CB C 32 41.137 41.137 42.892 -1.755 25541
138 1 1 . 1 1 32 32 ASP H H 32 8.542 8.542 8.131 0.411 25541
139 1 1 . 1 1 33 33 ILE N N 33 125.134 125.134 121.358 3.776 25541
140 1 1 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.105 -0.419 25541
141 1 1 . 1 1 33 33 ILE C C 33 175.743 175.743 176.277 -0.534 25541
142 1 1 . 1 1 33 33 ILE CA C 33 64.710 64.710 62.010 2.700 25541
143 1 1 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.282 0.533 25541
144 1 1 . 1 1 33 33 ILE H H 33 8.459 8.459 8.547 -0.088 25541
145 1 1 . 1 1 34 34 GLU N N 34 121.097 121.097 120.147 0.950 25541
146 1 1 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.346 -0.215 25541
147 1 1 . 1 1 34 34 GLU C C 34 176.406 176.406 178.195 -1.789 25541
148 1 1 . 1 1 34 34 GLU CA C 34 59.333 59.333 57.998 1.335 25541
149 1 1 . 1 1 34 34 GLU CB C 34 29.675 29.675 30.172 -0.497 25541
150 1 1 . 1 1 34 34 GLU H H 34 8.177 8.177 7.804 0.373 25541
151 1 1 . 1 1 35 35 LEU N N 35 124.890 124.890 120.587 4.303 25541
152 1 1 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.705 -0.094 25541
153 1 1 . 1 1 35 35 LEU C C 35 176.399 176.399 178.787 -2.388 25541
154 1 1 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.694 -0.626 25541
155 1 1 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.673 -0.763 25541
156 1 1 . 1 1 35 35 LEU H H 35 7.831 7.831 7.623 0.208 25541
157 1 1 . 1 1 36 36 LEU N N 36 120.493 120.493 118.713 1.780 25541
158 1 1 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.717 -0.058 25541
159 1 1 . 1 1 36 36 LEU C C 36 176.280 176.280 178.888 -2.608 25541
160 1 1 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.080 0.535 25541
161 1 1 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.935 1.534 25541
162 1 1 . 1 1 36 36 LEU H H 36 8.843 8.843 7.449 1.394 25541
163 1 1 . 1 1 37 37 ALA N N 37 119.956 119.956 120.484 -0.528 25541
164 1 1 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.862 0.135 25541
165 1 1 . 1 1 37 37 ALA C C 37 177.606 177.606 179.049 -1.443 25541
166 1 1 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.650 0.519 25541
167 1 1 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.848 -0.228 25541
168 1 1 . 1 1 37 37 ALA H H 37 7.610 7.610 8.282 -0.672 25541
169 1 1 . 1 1 38 38 ALA N N 38 121.594 121.594 120.913 0.681 25541
170 1 1 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.058 0.045 25541
171 1 1 . 1 1 38 38 ALA C C 38 178.452 178.452 178.856 -0.404 25541
172 1 1 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.693 0.162 25541
173 1 1 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.217 -0.157 25541
174 1 1 . 1 1 38 38 ALA H H 38 7.665 7.665 8.178 -0.513 25541
175 1 1 . 1 1 39 39 CYS N N 39 119.263 119.263 118.385 0.878 25541
176 1 1 . 1 1 39 39 CYS HA H 39 3.731 3.731 4.162 -0.431 25541
177 1 1 . 1 1 39 39 CYS C C 39 173.860 173.860 177.038 -3.178 25541
178 1 1 . 1 1 39 39 CYS CA C 39 63.823 63.823 61.917 1.906 25541
179 1 1 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.515 -0.290 25541
180 1 1 . 1 1 39 39 CYS H H 39 8.766 8.766 8.587 0.179 25541
181 1 1 . 1 1 40 40 ARG N N 40 119.658 119.658 119.205 0.453 25541
182 1 1 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.913 -0.015 25541
183 1 1 . 1 1 40 40 ARG C C 40 176.108 176.108 178.650 -2.542 25541
184 1 1 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.896 0.586 25541
185 1 1 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.766 0.098 25541
186 1 1 . 1 1 40 40 ARG H H 40 8.327 8.327 8.405 -0.078 25541
187 1 1 . 1 1 41 41 GLU N N 41 119.358 119.358 118.260 1.098 25541
188 1 1 . 1 1 41 41 GLU HA H 41 4.099 4.099 3.750 0.349 25541
189 1 1 . 1 1 41 41 GLU C C 41 171.786 171.786 178.850 -7.064 25541
190 1 1 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.141 0.072 25541
191 1 1 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.339 -0.062 25541
192 1 1 . 1 1 41 41 GLU H H 41 7.929 7.929 7.603 0.326 25541
193 1 1 . 1 1 42 42 GLU N N 42 121.281 121.281 118.285 2.996 25541
194 1 1 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.108 0.115 25541
195 1 1 . 1 1 42 42 GLU C C 42 173.408 173.408 178.897 -5.489 25541
196 1 1 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.268 0.051 25541
197 1 1 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.280 -1.065 25541
198 1 1 . 1 1 42 42 GLU H H 42 7.945 7.945 7.580 0.365 25541
199 1 1 . 1 1 43 43 PHE N N 43 119.271 119.271 121.931 -2.660 25541
200 1 1 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.084 -0.007 25541
201 1 1 . 1 1 43 43 PHE C C 43 175.299 175.299 177.341 -2.042 25541
202 1 1 . 1 1 43 43 PHE CA C 43 61.549 61.549 62.026 -0.477 25541
203 1 1 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.282 -0.148 25541
204 1 1 . 1 1 43 43 PHE H H 43 8.624 8.624 8.615 0.009 25541
205 1 1 . 1 1 44 44 HIS N N 44 116.374 116.374 116.312 0.062 25541
206 1 1 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.284 -0.018 25541
207 1 1 . 1 1 44 44 HIS C C 44 174.771 174.771 177.813 -3.042 25541
208 1 1 . 1 1 44 44 HIS CA C 44 59.343 59.343 58.849 0.493 25541
209 1 1 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.750 -0.262 25541
210 1 1 . 1 1 44 44 HIS H H 44 7.976 7.976 8.294 -0.318 25541
211 1 1 . 1 1 45 45 ARG N N 45 120.170 120.170 118.528 1.642 25541
212 1 1 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.132 -0.186 25541
213 1 1 . 1 1 45 45 ARG C C 45 176.310 176.310 178.365 -2.055 25541
214 1 1 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.465 -0.259 25541
215 1 1 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.994 0.394 25541
216 1 1 . 1 1 45 45 ARG H H 45 8.166 8.166 7.918 0.248 25541
217 1 1 . 1 1 46 46 ARG N N 46 116.229 116.229 117.979 -1.750 25541
218 1 1 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.203 -0.138 25541
219 1 1 . 1 1 46 46 ARG C C 46 176.046 176.046 177.573 -1.527 25541
220 1 1 . 1 1 46 46 ARG CA C 46 57.691 57.691 58.052 -0.361 25541
221 1 1 . 1 1 46 46 ARG CB C 46 30.248 30.248 28.947 1.301 25541
222 1 1 . 1 1 46 46 ARG H H 46 7.764 7.764 7.304 0.460 25541
223 1 1 . 1 1 47 47 LEU N N 47 119.010 119.010 118.413 0.597 25541
224 1 1 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.082 0.053 25541
225 1 1 . 1 1 47 47 LEU CA C 47 55.957 55.957 57.193 -1.236 25541
226 1 1 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.503 0.521 25541
227 1 1 . 1 1 47 47 LEU H H 47 7.557 7.557 7.272 0.285 25541
228 1 1 . 1 1 48 48 LYS N N 48 119.277 119.277 118.708 0.569 25541
229 1 1 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.343 -0.268 25541
230 1 1 . 1 1 48 48 LYS C C 48 176.354 176.354 177.545 -1.191 25541
231 1 1 . 1 1 48 48 LYS CA C 48 56.655 56.655 57.980 -1.325 25541
232 1 1 . 1 1 48 48 LYS CB C 48 32.410 32.410 33.477 -1.067 25541
233 1 1 . 1 1 48 48 LYS H H 48 7.662 7.662 7.604 0.058 25541
234 1 1 . 1 1 49 49 VAL N N 49 119.095 119.095 120.480 -1.385 25541
235 1 1 . 1 1 49 49 VAL HA H 49 3.972 3.972 4.013 -0.041 25541
236 1 1 . 1 1 49 49 VAL C C 49 174.195 174.195 174.147 0.048 25541
237 1 1 . 1 1 49 49 VAL CA C 49 62.214 62.214 62.349 -0.135 25541
238 1 1 . 1 1 49 49 VAL CB C 49 32.747 32.747 32.295 0.452 25541
239 1 1 . 1 1 49 49 VAL H H 49 7.688 7.688 8.263 -0.575 25541
240 1 1 . 1 1 50 50 TYR N N 50 123.606 123.606 122.363 1.243 25541
241 1 1 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.729 -0.247 25541
242 1 1 . 1 1 50 50 TYR CA C 50 57.855 57.855 55.332 2.523 25541
243 1 1 . 1 1 50 50 TYR CB C 50 38.721 38.721 39.759 -1.038 25541
244 1 1 . 1 1 50 50 TYR H H 50 8.164 8.164 7.705 0.459 25541
245 1 2 . 1 1 10 10 THR N N 10 114.351 114.351 113.240 1.111 25541
246 1 2 . 1 1 10 10 THR HA H 10 4.241 4.241 4.368 -0.127 25541
247 1 2 . 1 1 10 10 THR C C 10 171.741 171.741 174.721 -2.980 25541
248 1 2 . 1 1 10 10 THR CA C 10 62.002 62.002 62.099 -0.097 25541
249 1 2 . 1 1 10 10 THR CB C 10 69.796 69.796 69.447 0.349 25541
250 1 2 . 1 1 10 10 THR H H 10 8.114 8.114 8.436 -0.322 25541
251 1 2 . 1 1 11 11 LYS N N 11 124.677 124.677 124.646 0.031 25541
252 1 2 . 1 1 11 11 LYS HA H 11 4.164 4.164 3.894 0.270 25541
253 1 2 . 1 1 11 11 LYS C C 11 172.964 172.964 175.227 -2.263 25541
254 1 2 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.707 -0.585 25541
255 1 2 . 1 1 11 11 LYS CB C 11 32.819 32.819 33.101 -0.282 25541
256 1 2 . 1 1 11 11 LYS H H 11 8.436 8.436 8.467 -0.031 25541
257 1 2 . 1 1 12 12 LYS N N 12 123.337 123.337 121.858 1.479 25541
258 1 2 . 1 1 12 12 LYS HA H 12 4.093 4.093 3.849 0.244 25541
259 1 2 . 1 1 12 12 LYS C C 12 173.147 173.147 175.209 -2.062 25541
260 1 2 . 1 1 12 12 LYS CA C 12 56.327 56.327 55.261 1.066 25541
261 1 2 . 1 1 12 12 LYS CB C 12 33.223 33.223 33.017 0.206 25541
262 1 2 . 1 1 12 12 LYS H H 12 8.239 8.239 7.865 0.374 25541
263 1 2 . 1 1 13 13 TYR N N 13 119.233 119.233 118.100 1.133 25541
264 1 2 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.748 -0.347 25541
265 1 2 . 1 1 13 13 TYR C C 13 172.016 172.016 175.217 -3.201 25541
266 1 2 . 1 1 13 13 TYR CA C 13 57.325 57.325 57.387 -0.062 25541
267 1 2 . 1 1 13 13 TYR CB C 13 39.864 39.864 40.050 -0.186 25541
268 1 2 . 1 1 13 13 TYR H H 13 8.274 8.274 8.089 0.185 25541
269 1 2 . 1 1 14 14 ASP N N 14 120.486 120.486 123.179 -2.693 25541
270 1 2 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.933 -0.256 25541
271 1 2 . 1 1 14 14 ASP C C 14 173.276 173.276 176.566 -3.290 25541
272 1 2 . 1 1 14 14 ASP CA C 14 52.719 52.719 54.013 -1.294 25541
273 1 2 . 1 1 14 14 ASP CB C 14 40.205 40.205 41.089 -0.884 25541
274 1 2 . 1 1 14 14 ASP H H 14 8.603 8.603 8.770 -0.167 25541
275 1 2 . 1 1 15 15 LEU N N 15 126.405 126.405 125.708 0.697 25541
276 1 2 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.087 -1.322 25541
277 1 2 . 1 1 15 15 LEU C C 15 175.592 175.592 176.680 -1.088 25541
278 1 2 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.369 -1.114 25541
279 1 2 . 1 1 15 15 LEU CB C 15 39.967 39.967 41.333 -1.366 25541
280 1 2 . 1 1 15 15 LEU H H 15 8.901 8.901 8.558 0.343 25541
281 1 2 . 1 1 16 16 SER N N 16 116.540 116.540 116.176 0.364 25541
282 1 2 . 1 1 16 16 SER HA H 16 4.100 4.100 4.259 -0.159 25541
283 1 2 . 1 1 16 16 SER C C 16 173.247 173.247 174.754 -1.507 25541
284 1 2 . 1 1 16 16 SER CA C 16 61.720 61.720 60.543 1.177 25541
285 1 2 . 1 1 16 16 SER CB C 16 62.797 62.797 63.252 -0.455 25541
286 1 2 . 1 1 16 16 SER H H 16 8.112 8.112 8.185 -0.073 25541
287 1 2 . 1 1 17 17 LYS N N 17 118.008 118.008 120.041 -2.033 25541
288 1 2 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.663 -0.162 25541
289 1 2 . 1 1 17 17 LYS C C 17 175.079 175.079 175.144 -0.065 25541
290 1 2 . 1 1 17 17 LYS CA C 17 55.267 55.267 55.890 -0.623 25541
291 1 2 . 1 1 17 17 LYS CB C 17 31.977 31.977 33.865 -1.889 25541
292 1 2 . 1 1 17 17 LYS H H 17 8.521 8.521 8.313 0.208 25541
293 1 2 . 1 1 18 18 TRP N N 18 122.041 122.041 122.386 -0.345 25541
294 1 2 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.749 -0.171 25541
295 1 2 . 1 1 18 18 TRP C C 18 174.862 174.862 174.801 0.061 25541
296 1 2 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.069 1.302 25541
297 1 2 . 1 1 18 18 TRP CB C 18 28.544 28.544 31.984 -3.440 25541
298 1 2 . 1 1 18 18 TRP H H 18 7.853 7.853 8.442 -0.589 25541
299 1 2 . 1 1 19 19 LYS N N 19 123.185 123.185 121.258 1.927 25541
300 1 2 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.674 -0.139 25541
301 1 2 . 1 1 19 19 LYS C C 19 175.094 175.094 177.234 -2.140 25541
302 1 2 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.766 0.661 25541
303 1 2 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.311 -0.191 25541
304 1 2 . 1 1 19 19 LYS H H 19 9.544 9.544 8.493 1.051 25541
305 1 2 . 1 1 20 20 TYR N N 20 124.291 124.291 126.088 -1.797 25541
306 1 2 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.025 -0.000 25541
307 1 2 . 1 1 20 20 TYR C C 20 174.531 174.531 177.104 -2.573 25541
308 1 2 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.654 0.495 25541
309 1 2 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.527 -0.374 25541
310 1 2 . 1 1 20 20 TYR H H 20 9.266 9.266 9.259 0.007 25541
311 1 2 . 1 1 21 21 ALA N N 21 117.781 117.781 121.428 -3.647 25541
312 1 2 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.333 -0.460 25541
313 1 2 . 1 1 21 21 ALA C C 21 176.314 176.314 179.511 -3.197 25541
314 1 2 . 1 1 21 21 ALA CA C 21 55.335 55.335 54.970 0.365 25541
315 1 2 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.909 0.794 25541
316 1 2 . 1 1 21 21 ALA H H 21 8.986 8.986 8.511 0.475 25541
317 1 2 . 1 1 22 22 GLU N N 22 115.218 115.218 119.480 -4.262 25541
318 1 2 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.117 0.002 25541
319 1 2 . 1 1 22 22 GLU C C 22 177.380 177.380 179.484 -2.104 25541
320 1 2 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.725 -1.246 25541
321 1 2 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.342 0.528 25541
322 1 2 . 1 1 22 22 GLU H H 22 6.854 6.854 8.490 -1.636 25541
323 1 2 . 1 1 23 23 LEU N N 23 122.132 122.132 119.604 2.528 25541
324 1 2 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.096 0.060 25541
325 1 2 . 1 1 23 23 LEU C C 23 174.830 174.830 179.686 -4.856 25541
326 1 2 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.283 0.239 25541
327 1 2 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.712 1.407 25541
328 1 2 . 1 1 23 23 LEU H H 23 7.909 7.909 8.952 -1.043 25541
329 1 2 . 1 1 24 24 ARG N N 24 118.051 118.051 118.616 -0.565 25541
330 1 2 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.989 -0.352 25541
331 1 2 . 1 1 24 24 ARG C C 24 175.240 175.240 178.482 -3.242 25541
332 1 2 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.645 0.331 25541
333 1 2 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.818 0.044 25541
334 1 2 . 1 1 24 24 ARG H H 24 8.250 8.250 7.550 0.700 25541
335 1 2 . 1 1 25 25 ASP N N 25 118.179 118.179 119.241 -1.062 25541
336 1 2 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.537 -0.152 25541
337 1 2 . 1 1 25 25 ASP C C 25 176.554 176.554 178.336 -1.782 25541
338 1 2 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.069 0.287 25541
339 1 2 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.883 -0.841 25541
340 1 2 . 1 1 25 25 ASP H H 25 8.507 8.507 8.513 -0.006 25541
341 1 2 . 1 1 26 26 THR N N 26 118.299 118.299 116.477 1.822 25541
342 1 2 . 1 1 26 26 THR HA H 26 3.891 3.891 4.007 -0.116 25541
343 1 2 . 1 1 26 26 THR C C 26 173.365 173.365 176.474 -3.109 25541
344 1 2 . 1 1 26 26 THR CA C 26 67.787 67.787 66.166 1.621 25541
345 1 2 . 1 1 26 26 THR CB C 26 68.120 68.120 69.022 -0.901 25541
346 1 2 . 1 1 26 26 THR H H 26 7.918 7.918 8.404 -0.486 25541
347 1 2 . 1 1 27 27 ILE N N 27 122.576 122.576 119.452 3.124 25541
348 1 2 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.879 -0.254 25541
349 1 2 . 1 1 27 27 ILE C C 27 174.485 174.485 176.394 -1.909 25541
350 1 2 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.151 0.560 25541
351 1 2 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.920 -0.393 25541
352 1 2 . 1 1 27 27 ILE H H 27 8.159 8.159 7.390 0.769 25541
353 1 2 . 1 1 28 28 ASN N N 28 115.118 115.118 116.503 -1.385 25541
354 1 2 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.740 -0.125 25541
355 1 2 . 1 1 28 28 ASN C C 28 173.902 173.902 174.916 -1.014 25541
356 1 2 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.828 0.632 25541
357 1 2 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.284 -0.054 25541
358 1 2 . 1 1 28 28 ASN H H 28 7.713 7.713 7.862 -0.149 25541
359 1 2 . 1 1 29 29 THR N N 29 107.730 107.730 109.036 -1.306 25541
360 1 2 . 1 1 29 29 THR HA H 29 4.600 4.600 4.392 0.208 25541
361 1 2 . 1 1 29 29 THR C C 29 172.290 172.290 174.711 -2.421 25541
362 1 2 . 1 1 29 29 THR CA C 29 62.595 62.595 62.777 -0.182 25541
363 1 2 . 1 1 29 29 THR CB C 29 72.291 72.291 70.045 2.246 25541
364 1 2 . 1 1 29 29 THR H H 29 7.587 7.587 7.519 0.068 25541
365 1 2 . 1 1 30 30 SER N N 30 117.784 117.784 118.427 -0.643 25541
366 1 2 . 1 1 30 30 SER HA H 30 4.296 4.296 4.609 -0.313 25541
367 1 2 . 1 1 30 30 SER C C 30 172.473 172.473 173.323 -0.850 25541
368 1 2 . 1 1 30 30 SER CA C 30 59.618 59.618 58.370 1.248 25541
369 1 2 . 1 1 30 30 SER CB C 30 64.402 64.402 64.296 0.105 25541
370 1 2 . 1 1 30 30 SER H H 30 8.698 8.698 8.164 0.534 25541
371 1 2 . 1 1 31 31 CYS N N 31 121.196 121.196 117.192 4.004 25541
372 1 2 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.745 0.042 25541
373 1 2 . 1 1 31 31 CYS C C 31 170.861 170.861 172.383 -1.522 25541
374 1 2 . 1 1 31 31 CYS CA C 31 57.372 57.372 58.385 -1.013 25541
375 1 2 . 1 1 31 31 CYS CB C 31 28.364 28.364 30.192 -1.828 25541
376 1 2 . 1 1 31 31 CYS H H 31 8.713 8.713 8.214 0.498 25541
377 1 2 . 1 1 32 32 ASP N N 32 124.610 124.610 124.040 0.570 25541
378 1 2 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.716 -0.103 25541
379 1 2 . 1 1 32 32 ASP C C 32 172.541 172.541 175.523 -2.982 25541
380 1 2 . 1 1 32 32 ASP CA C 32 53.185 53.185 53.625 -0.440 25541
381 1 2 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.517 -2.380 25541
382 1 2 . 1 1 32 32 ASP H H 32 8.542 8.542 8.400 0.142 25541
383 1 2 . 1 1 33 33 ILE N N 33 125.134 125.134 122.585 2.549 25541
384 1 2 . 1 1 33 33 ILE HA H 33 3.686 3.686 3.985 -0.299 25541
385 1 2 . 1 1 33 33 ILE C C 33 175.743 175.743 176.022 -0.279 25541
386 1 2 . 1 1 33 33 ILE CA C 33 64.710 64.710 63.004 1.706 25541
387 1 2 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.910 -0.095 25541
388 1 2 . 1 1 33 33 ILE H H 33 8.459 8.459 8.495 -0.036 25541
389 1 2 . 1 1 34 34 GLU N N 34 121.097 121.097 118.918 2.179 25541
390 1 2 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.323 -0.192 25541
391 1 2 . 1 1 34 34 GLU C C 34 176.406 176.406 178.036 -1.630 25541
392 1 2 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.252 1.081 25541
393 1 2 . 1 1 34 34 GLU CB C 34 29.675 29.675 29.254 0.421 25541
394 1 2 . 1 1 34 34 GLU H H 34 8.177 8.177 8.073 0.104 25541
395 1 2 . 1 1 35 35 LEU N N 35 124.890 124.890 121.699 3.191 25541
396 1 2 . 1 1 35 35 LEU HA H 35 3.611 3.611 4.036 -0.425 25541
397 1 2 . 1 1 35 35 LEU C C 35 176.399 176.399 179.126 -2.727 25541
398 1 2 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.812 -0.744 25541
399 1 2 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.712 -0.802 25541
400 1 2 . 1 1 35 35 LEU H H 35 7.831 7.831 8.141 -0.310 25541
401 1 2 . 1 1 36 36 LEU N N 36 120.493 120.493 118.493 2.000 25541
402 1 2 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.768 -0.109 25541
403 1 2 . 1 1 36 36 LEU C C 36 176.280 176.280 178.970 -2.690 25541
404 1 2 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.129 0.486 25541
405 1 2 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.980 1.489 25541
406 1 2 . 1 1 36 36 LEU H H 36 8.843 8.843 7.555 1.288 25541
407 1 2 . 1 1 37 37 ALA N N 37 119.956 119.956 120.729 -0.773 25541
408 1 2 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.928 0.069 25541
409 1 2 . 1 1 37 37 ALA C C 37 177.606 177.606 179.534 -1.928 25541
410 1 2 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.822 0.347 25541
411 1 2 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.888 -0.268 25541
412 1 2 . 1 1 37 37 ALA H H 37 7.610 7.610 8.213 -0.603 25541
413 1 2 . 1 1 38 38 ALA N N 38 121.594 121.594 120.630 0.964 25541
414 1 2 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.039 0.064 25541
415 1 2 . 1 1 38 38 ALA C C 38 178.452 178.452 178.716 -0.264 25541
416 1 2 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.481 0.374 25541
417 1 2 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.458 -0.398 25541
418 1 2 . 1 1 38 38 ALA H H 38 7.665 7.665 8.455 -0.790 25541
419 1 2 . 1 1 39 39 CYS N N 39 119.263 119.263 118.389 0.874 25541
420 1 2 . 1 1 39 39 CYS HA H 39 3.731 3.731 4.018 -0.287 25541
421 1 2 . 1 1 39 39 CYS C C 39 173.860 173.860 176.790 -2.930 25541
422 1 2 . 1 1 39 39 CYS CA C 39 63.823 63.823 61.204 2.619 25541
423 1 2 . 1 1 39 39 CYS CB C 39 27.225 27.225 26.532 0.694 25541
424 1 2 . 1 1 39 39 CYS H H 39 8.766 8.766 8.486 0.280 25541
425 1 2 . 1 1 40 40 ARG N N 40 119.658 119.658 119.364 0.294 25541
426 1 2 . 1 1 40 40 ARG HA H 40 3.898 3.898 4.015 -0.117 25541
427 1 2 . 1 1 40 40 ARG C C 40 176.108 176.108 178.880 -2.772 25541
428 1 2 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.056 1.426 25541
429 1 2 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.281 0.583 25541
430 1 2 . 1 1 40 40 ARG H H 40 8.327 8.327 8.430 -0.103 25541
431 1 2 . 1 1 41 41 GLU N N 41 119.358 119.358 117.990 1.368 25541
432 1 2 . 1 1 41 41 GLU HA H 41 4.099 4.099 3.832 0.267 25541
433 1 2 . 1 1 41 41 GLU C C 41 171.786 171.786 178.671 -6.885 25541
434 1 2 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.425 -0.212 25541
435 1 2 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.092 0.185 25541
436 1 2 . 1 1 41 41 GLU H H 41 7.929 7.929 7.677 0.252 25541
437 1 2 . 1 1 42 42 GLU N N 42 121.281 121.281 118.941 2.340 25541
438 1 2 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.154 0.069 25541
439 1 2 . 1 1 42 42 GLU C C 42 173.408 173.408 178.899 -5.491 25541
440 1 2 . 1 1 42 42 GLU CA C 42 58.319 58.319 57.869 0.450 25541
441 1 2 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.108 -0.893 25541
442 1 2 . 1 1 42 42 GLU H H 42 7.945 7.945 7.673 0.272 25541
443 1 2 . 1 1 43 43 PHE N N 43 119.271 119.271 121.363 -2.092 25541
444 1 2 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.036 0.041 25541
445 1 2 . 1 1 43 43 PHE C C 43 175.299 175.299 177.443 -2.144 25541
446 1 2 . 1 1 43 43 PHE CA C 43 61.549 61.549 61.902 -0.353 25541
447 1 2 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.128 0.006 25541
448 1 2 . 1 1 43 43 PHE H H 43 8.624 8.624 8.735 -0.111 25541
449 1 2 . 1 1 44 44 HIS N N 44 116.374 116.374 116.079 0.295 25541
450 1 2 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.442 -0.176 25541
451 1 2 . 1 1 44 44 HIS C C 44 174.771 174.771 177.893 -3.122 25541
452 1 2 . 1 1 44 44 HIS CA C 44 59.343 59.343 58.646 0.697 25541
453 1 2 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.862 -0.374 25541
454 1 2 . 1 1 44 44 HIS H H 44 7.976 7.976 8.239 -0.263 25541
455 1 2 . 1 1 45 45 ARG N N 45 120.170 120.170 119.493 0.677 25541
456 1 2 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.119 -0.173 25541
457 1 2 . 1 1 45 45 ARG C C 45 176.310 176.310 178.618 -2.308 25541
458 1 2 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.157 0.049 25541
459 1 2 . 1 1 45 45 ARG CB C 45 30.388 30.388 30.049 0.339 25541
460 1 2 . 1 1 45 45 ARG H H 45 8.166 8.166 8.203 -0.037 25541
461 1 2 . 1 1 46 46 ARG N N 46 116.229 116.229 119.187 -2.958 25541
462 1 2 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.186 -0.121 25541
463 1 2 . 1 1 46 46 ARG C C 46 176.046 176.046 178.999 -2.953 25541
464 1 2 . 1 1 46 46 ARG CA C 46 57.691 57.691 58.158 -0.467 25541
465 1 2 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.309 0.939 25541
466 1 2 . 1 1 46 46 ARG H H 46 7.764 7.764 7.624 0.140 25541
467 1 2 . 1 1 47 47 LEU N N 47 119.010 119.010 119.783 -0.773 25541
468 1 2 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.298 -0.163 25541
469 1 2 . 1 1 47 47 LEU CA C 47 55.957 55.957 57.485 -1.528 25541
470 1 2 . 1 1 47 47 LEU CB C 47 42.024 42.024 40.858 1.166 25541
471 1 2 . 1 1 47 47 LEU H H 47 7.557 7.557 7.473 0.084 25541
472 1 2 . 1 1 48 48 LYS N N 48 119.277 119.277 119.356 -0.079 25541
473 1 2 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.004 0.071 25541
474 1 2 . 1 1 48 48 LYS C C 48 176.354 176.354 178.301 -1.947 25541
475 1 2 . 1 1 48 48 LYS CA C 48 56.655 56.655 59.232 -2.577 25541
476 1 2 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.354 0.056 25541
477 1 2 . 1 1 48 48 LYS H H 48 7.662 7.662 7.621 0.041 25541
478 1 2 . 1 1 49 49 VAL N N 49 119.095 119.095 116.120 2.975 25541
479 1 2 . 1 1 49 49 VAL HA H 49 3.972 3.972 3.790 0.182 25541
480 1 2 . 1 1 49 49 VAL C C 49 174.195 174.195 175.287 -1.092 25541
481 1 2 . 1 1 49 49 VAL CA C 49 62.214 62.214 62.914 -0.700 25541
482 1 2 . 1 1 49 49 VAL CB C 49 32.747 32.747 31.313 1.434 25541
483 1 2 . 1 1 49 49 VAL H H 49 7.688 7.688 7.320 0.368 25541
484 1 2 . 1 1 50 50 TYR N N 50 123.606 123.606 118.282 5.324 25541
485 1 2 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.671 -0.189 25541
486 1 2 . 1 1 50 50 TYR CA C 50 57.855 57.855 56.488 1.367 25541
487 1 2 . 1 1 50 50 TYR CB C 50 38.721 38.721 38.571 0.150 25541
488 1 2 . 1 1 50 50 TYR H H 50 8.164 8.164 7.919 0.245 25541
489 1 3 . 1 1 10 10 THR N N 10 114.351 114.351 115.445 -1.094 25541
490 1 3 . 1 1 10 10 THR HA H 10 4.241 4.241 4.299 -0.058 25541
491 1 3 . 1 1 10 10 THR C C 10 171.741 171.741 174.358 -2.617 25541
492 1 3 . 1 1 10 10 THR CA C 10 62.002 62.002 61.459 0.543 25541
493 1 3 . 1 1 10 10 THR CB C 10 69.796 69.796 68.802 0.994 25541
494 1 3 . 1 1 10 10 THR H H 10 8.114 8.114 8.154 -0.040 25541
495 1 3 . 1 1 11 11 LYS N N 11 124.677 124.677 127.691 -3.014 25541
496 1 3 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.296 -0.132 25541
497 1 3 . 1 1 11 11 LYS C C 11 172.964 172.964 176.317 -3.353 25541
498 1 3 . 1 1 11 11 LYS CA C 11 56.122 56.122 55.752 0.370 25541
499 1 3 . 1 1 11 11 LYS CB C 11 32.819 32.819 32.505 0.314 25541
500 1 3 . 1 1 11 11 LYS H H 11 8.436 8.436 8.284 0.152 25541
501 1 3 . 1 1 12 12 LYS N N 12 123.337 123.337 123.139 0.198 25541
502 1 3 . 1 1 12 12 LYS HA H 12 4.093 4.093 3.618 0.475 25541
503 1 3 . 1 1 12 12 LYS C C 12 173.147 173.147 176.052 -2.905 25541
504 1 3 . 1 1 12 12 LYS CA C 12 56.327 56.327 56.284 0.043 25541
505 1 3 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.255 0.968 25541
506 1 3 . 1 1 12 12 LYS H H 12 8.239 8.239 8.136 0.103 25541
507 1 3 . 1 1 13 13 TYR N N 13 119.233 119.233 117.292 1.941 25541
508 1 3 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.623 -0.222 25541
509 1 3 . 1 1 13 13 TYR C C 13 172.016 172.016 174.689 -2.673 25541
510 1 3 . 1 1 13 13 TYR CA C 13 57.325 57.325 56.925 0.400 25541
511 1 3 . 1 1 13 13 TYR CB C 13 39.864 39.864 40.468 -0.604 25541
512 1 3 . 1 1 13 13 TYR H H 13 8.274 8.274 7.780 0.494 25541
513 1 3 . 1 1 14 14 ASP N N 14 120.486 120.486 122.129 -1.643 25541
514 1 3 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.978 -0.301 25541
515 1 3 . 1 1 14 14 ASP C C 14 173.276 173.276 175.791 -2.515 25541
516 1 3 . 1 1 14 14 ASP CA C 14 52.719 52.719 54.179 -1.460 25541
517 1 3 . 1 1 14 14 ASP CB C 14 40.205 40.205 41.476 -1.271 25541
518 1 3 . 1 1 14 14 ASP H H 14 8.603 8.603 8.716 -0.113 25541
519 1 3 . 1 1 15 15 LEU N N 15 126.405 126.405 126.615 -0.210 25541
520 1 3 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.015 -1.250 25541
521 1 3 . 1 1 15 15 LEU C C 15 175.592 175.592 177.315 -1.723 25541
522 1 3 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.316 -1.061 25541
523 1 3 . 1 1 15 15 LEU CB C 15 39.967 39.967 40.613 -0.646 25541
524 1 3 . 1 1 15 15 LEU H H 15 8.901 8.901 8.707 0.194 25541
525 1 3 . 1 1 16 16 SER N N 16 116.540 116.540 116.023 0.517 25541
526 1 3 . 1 1 16 16 SER HA H 16 4.100 4.100 4.154 -0.054 25541
527 1 3 . 1 1 16 16 SER C C 16 173.247 173.247 174.274 -1.027 25541
528 1 3 . 1 1 16 16 SER CA C 16 61.720 61.720 60.999 0.721 25541
529 1 3 . 1 1 16 16 SER CB C 16 62.797 62.797 63.548 -0.751 25541
530 1 3 . 1 1 16 16 SER H H 16 8.112 8.112 9.094 -0.982 25541
531 1 3 . 1 1 17 17 LYS N N 17 118.008 118.008 118.178 -0.170 25541
532 1 3 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.578 -0.077 25541
533 1 3 . 1 1 17 17 LYS C C 17 175.079 175.079 174.921 0.158 25541
534 1 3 . 1 1 17 17 LYS CA C 17 55.267 55.267 55.647 -0.380 25541
535 1 3 . 1 1 17 17 LYS CB C 17 31.977 31.977 33.995 -2.018 25541
536 1 3 . 1 1 17 17 LYS H H 17 8.521 8.521 7.846 0.675 25541
537 1 3 . 1 1 18 18 TRP N N 18 122.041 122.041 123.518 -1.477 25541
538 1 3 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.842 -0.264 25541
539 1 3 . 1 1 18 18 TRP C C 18 174.862 174.862 175.020 -0.158 25541
540 1 3 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.505 0.866 25541
541 1 3 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.554 -4.010 25541
542 1 3 . 1 1 18 18 TRP H H 18 7.853 7.853 8.595 -0.742 25541
543 1 3 . 1 1 19 19 LYS N N 19 123.185 123.185 121.370 1.815 25541
544 1 3 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.715 -0.180 25541
545 1 3 . 1 1 19 19 LYS C C 19 175.094 175.094 176.932 -1.838 25541
546 1 3 . 1 1 19 19 LYS CA C 19 55.427 55.427 55.086 0.341 25541
547 1 3 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.932 -0.812 25541
548 1 3 . 1 1 19 19 LYS H H 19 9.544 9.544 8.413 1.131 25541
549 1 3 . 1 1 20 20 TYR N N 20 124.291 124.291 126.019 -1.728 25541
550 1 3 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.066 -0.041 25541
551 1 3 . 1 1 20 20 TYR C C 20 174.531 174.531 177.083 -2.552 25541
552 1 3 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.499 0.650 25541
553 1 3 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.403 -0.250 25541
554 1 3 . 1 1 20 20 TYR H H 20 9.266 9.266 9.252 0.014 25541
555 1 3 . 1 1 21 21 ALA N N 21 117.781 117.781 119.425 -1.644 25541
556 1 3 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.249 -0.376 25541
557 1 3 . 1 1 21 21 ALA C C 21 176.314 176.314 179.419 -3.105 25541
558 1 3 . 1 1 21 21 ALA CA C 21 55.335 55.335 54.698 0.637 25541
559 1 3 . 1 1 21 21 ALA CB C 21 18.703 18.703 18.263 0.440 25541
560 1 3 . 1 1 21 21 ALA H H 21 8.986 8.986 8.555 0.431 25541
561 1 3 . 1 1 22 22 GLU N N 22 115.218 115.218 119.663 -4.445 25541
562 1 3 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.246 -0.127 25541
563 1 3 . 1 1 22 22 GLU C C 22 177.380 177.380 179.233 -1.853 25541
564 1 3 . 1 1 22 22 GLU CA C 22 58.479 58.479 58.911 -0.432 25541
565 1 3 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.620 0.250 25541
566 1 3 . 1 1 22 22 GLU H H 22 6.854 6.854 7.852 -0.998 25541
567 1 3 . 1 1 23 23 LEU N N 23 122.132 122.132 120.459 1.673 25541
568 1 3 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.011 0.145 25541
569 1 3 . 1 1 23 23 LEU C C 23 174.830 174.830 179.354 -4.524 25541
570 1 3 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.445 0.077 25541
571 1 3 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.645 1.474 25541
572 1 3 . 1 1 23 23 LEU H H 23 7.909 7.909 9.058 -1.149 25541
573 1 3 . 1 1 24 24 ARG N N 24 118.051 118.051 118.240 -0.189 25541
574 1 3 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.927 -0.290 25541
575 1 3 . 1 1 24 24 ARG C C 24 175.240 175.240 178.447 -3.207 25541
576 1 3 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.722 0.254 25541
577 1 3 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.680 0.182 25541
578 1 3 . 1 1 24 24 ARG H H 24 8.250 8.250 7.620 0.630 25541
579 1 3 . 1 1 25 25 ASP N N 25 118.179 118.179 119.329 -1.150 25541
580 1 3 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.543 -0.158 25541
581 1 3 . 1 1 25 25 ASP C C 25 176.554 176.554 178.249 -1.695 25541
582 1 3 . 1 1 25 25 ASP CA C 25 57.356 57.356 56.981 0.375 25541
583 1 3 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.418 -0.376 25541
584 1 3 . 1 1 25 25 ASP H H 25 8.507 8.507 7.974 0.533 25541
585 1 3 . 1 1 26 26 THR N N 26 118.299 118.299 116.658 1.641 25541
586 1 3 . 1 1 26 26 THR HA H 26 3.891 3.891 4.053 -0.162 25541
587 1 3 . 1 1 26 26 THR C C 26 173.365 173.365 176.402 -3.037 25541
588 1 3 . 1 1 26 26 THR CA C 26 67.787 67.787 66.395 1.392 25541
589 1 3 . 1 1 26 26 THR CB C 26 68.120 68.120 68.925 -0.805 25541
590 1 3 . 1 1 26 26 THR H H 26 7.918 7.918 8.356 -0.438 25541
591 1 3 . 1 1 27 27 ILE N N 27 122.576 122.576 118.860 3.716 25541
592 1 3 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.812 -0.187 25541
593 1 3 . 1 1 27 27 ILE C C 27 174.485 174.485 176.274 -1.789 25541
594 1 3 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.261 0.450 25541
595 1 3 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.666 -0.139 25541
596 1 3 . 1 1 27 27 ILE H H 27 8.159 8.159 7.358 0.801 25541
597 1 3 . 1 1 28 28 ASN N N 28 115.118 115.118 116.447 -1.329 25541
598 1 3 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.736 -0.121 25541
599 1 3 . 1 1 28 28 ASN C C 28 173.902 173.902 174.893 -0.991 25541
600 1 3 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.734 0.726 25541
601 1 3 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.234 -0.004 25541
602 1 3 . 1 1 28 28 ASN H H 28 7.713 7.713 7.735 -0.022 25541
603 1 3 . 1 1 29 29 THR N N 29 107.730 107.730 108.983 -1.253 25541
604 1 3 . 1 1 29 29 THR HA H 29 4.600 4.600 4.401 0.199 25541
605 1 3 . 1 1 29 29 THR C C 29 172.290 172.290 174.841 -2.551 25541
606 1 3 . 1 1 29 29 THR CA C 29 62.595 62.595 62.738 -0.143 25541
607 1 3 . 1 1 29 29 THR CB C 29 72.291 72.291 69.928 2.363 25541
608 1 3 . 1 1 29 29 THR H H 29 7.587 7.587 7.519 0.068 25541
609 1 3 . 1 1 30 30 SER N N 30 117.784 117.784 118.283 -0.499 25541
610 1 3 . 1 1 30 30 SER HA H 30 4.296 4.296 4.587 -0.291 25541
611 1 3 . 1 1 30 30 SER C C 30 172.473 172.473 173.310 -0.837 25541
612 1 3 . 1 1 30 30 SER CA C 30 59.618 59.618 58.172 1.446 25541
613 1 3 . 1 1 30 30 SER CB C 30 64.402 64.402 64.088 0.314 25541
614 1 3 . 1 1 30 30 SER H H 30 8.698 8.698 8.347 0.351 25541
615 1 3 . 1 1 31 31 CYS N N 31 121.196 121.196 119.661 1.535 25541
616 1 3 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.676 0.111 25541
617 1 3 . 1 1 31 31 CYS C C 31 170.861 170.861 172.350 -1.489 25541
618 1 3 . 1 1 31 31 CYS CA C 31 57.372 57.372 59.255 -1.883 25541
619 1 3 . 1 1 31 31 CYS CB C 31 28.364 28.364 28.630 -0.266 25541
620 1 3 . 1 1 31 31 CYS H H 31 8.713 8.713 8.335 0.378 25541
621 1 3 . 1 1 32 32 ASP N N 32 124.610 124.610 125.732 -1.122 25541
622 1 3 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.839 -0.226 25541
623 1 3 . 1 1 32 32 ASP C C 32 172.541 172.541 174.743 -2.202 25541
624 1 3 . 1 1 32 32 ASP CA C 32 53.185 53.185 53.768 -0.583 25541
625 1 3 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.418 -2.281 25541
626 1 3 . 1 1 32 32 ASP H H 32 8.542 8.542 8.134 0.408 25541
627 1 3 . 1 1 33 33 ILE N N 33 125.134 125.134 122.098 3.036 25541
628 1 3 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.070 -0.384 25541
629 1 3 . 1 1 33 33 ILE C C 33 175.743 175.743 176.258 -0.515 25541
630 1 3 . 1 1 33 33 ILE CA C 33 64.710 64.710 62.936 1.774 25541
631 1 3 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.404 0.411 25541
632 1 3 . 1 1 33 33 ILE H H 33 8.459 8.459 8.539 -0.080 25541
633 1 3 . 1 1 34 34 GLU N N 34 121.097 121.097 119.278 1.819 25541
634 1 3 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.292 -0.161 25541
635 1 3 . 1 1 34 34 GLU C C 34 176.406 176.406 178.186 -1.780 25541
636 1 3 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.142 1.192 25541
637 1 3 . 1 1 34 34 GLU CB C 34 29.675 29.675 30.033 -0.358 25541
638 1 3 . 1 1 34 34 GLU H H 34 8.177 8.177 7.864 0.313 25541
639 1 3 . 1 1 35 35 LEU N N 35 124.890 124.890 121.393 3.497 25541
640 1 3 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.898 -0.287 25541
641 1 3 . 1 1 35 35 LEU C C 35 176.399 176.399 178.859 -2.460 25541
642 1 3 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.723 -0.655 25541
643 1 3 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.614 -0.704 25541
644 1 3 . 1 1 35 35 LEU H H 35 7.831 7.831 8.057 -0.226 25541
645 1 3 . 1 1 36 36 LEU N N 36 120.493 120.493 118.747 1.746 25541
646 1 3 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.739 -0.080 25541
647 1 3 . 1 1 36 36 LEU C C 36 176.280 176.280 178.946 -2.666 25541
648 1 3 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.143 0.472 25541
649 1 3 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.978 1.490 25541
650 1 3 . 1 1 36 36 LEU H H 36 8.843 8.843 7.487 1.356 25541
651 1 3 . 1 1 37 37 ALA N N 37 119.956 119.956 120.247 -0.291 25541
652 1 3 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.906 0.091 25541
653 1 3 . 1 1 37 37 ALA C C 37 177.606 177.606 179.126 -1.520 25541
654 1 3 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.498 0.671 25541
655 1 3 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.953 -0.333 25541
656 1 3 . 1 1 37 37 ALA H H 37 7.610 7.610 8.281 -0.671 25541
657 1 3 . 1 1 38 38 ALA N N 38 121.594 121.594 120.784 0.810 25541
658 1 3 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.077 0.026 25541
659 1 3 . 1 1 38 38 ALA C C 38 178.452 178.452 178.941 -0.489 25541
660 1 3 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.597 0.258 25541
661 1 3 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.299 -0.239 25541
662 1 3 . 1 1 38 38 ALA H H 38 7.665 7.665 8.351 -0.686 25541
663 1 3 . 1 1 39 39 CYS N N 39 119.263 119.263 117.874 1.389 25541
664 1 3 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.799 -0.068 25541
665 1 3 . 1 1 39 39 CYS C C 39 173.860 173.860 176.699 -2.839 25541
666 1 3 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.187 1.636 25541
667 1 3 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.348 -0.123 25541
668 1 3 . 1 1 39 39 CYS H H 39 8.766 8.766 8.498 0.268 25541
669 1 3 . 1 1 40 40 ARG N N 40 119.658 119.658 119.279 0.379 25541
670 1 3 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.865 0.033 25541
671 1 3 . 1 1 40 40 ARG C C 40 176.108 176.108 178.565 -2.457 25541
672 1 3 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.624 0.857 25541
673 1 3 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.642 0.222 25541
674 1 3 . 1 1 40 40 ARG H H 40 8.327 8.327 8.329 -0.002 25541
675 1 3 . 1 1 41 41 GLU N N 41 119.358 119.358 117.379 1.979 25541
676 1 3 . 1 1 41 41 GLU HA H 41 4.099 4.099 3.778 0.321 25541
677 1 3 . 1 1 41 41 GLU C C 41 171.786 171.786 178.718 -6.932 25541
678 1 3 . 1 1 41 41 GLU CA C 41 59.213 59.213 58.866 0.347 25541
679 1 3 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.079 0.198 25541
680 1 3 . 1 1 41 41 GLU H H 41 7.929 7.929 7.563 0.366 25541
681 1 3 . 1 1 42 42 GLU N N 42 121.281 121.281 119.633 1.648 25541
682 1 3 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.130 0.093 25541
683 1 3 . 1 1 42 42 GLU C C 42 173.408 173.408 178.839 -5.431 25541
684 1 3 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.416 -0.097 25541
685 1 3 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.528 -1.313 25541
686 1 3 . 1 1 42 42 GLU H H 42 7.945 7.945 7.818 0.127 25541
687 1 3 . 1 1 43 43 PHE N N 43 119.271 119.271 121.006 -1.735 25541
688 1 3 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.017 0.060 25541
689 1 3 . 1 1 43 43 PHE C C 43 175.299 175.299 177.419 -2.120 25541
690 1 3 . 1 1 43 43 PHE CA C 43 61.549 61.549 62.018 -0.469 25541
691 1 3 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.077 0.057 25541
692 1 3 . 1 1 43 43 PHE H H 43 8.624 8.624 8.539 0.085 25541
693 1 3 . 1 1 44 44 HIS N N 44 116.374 116.374 115.834 0.540 25541
694 1 3 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.276 -0.010 25541
695 1 3 . 1 1 44 44 HIS C C 44 174.771 174.771 177.822 -3.051 25541
696 1 3 . 1 1 44 44 HIS CA C 44 59.343 59.343 58.536 0.807 25541
697 1 3 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.657 -0.169 25541
698 1 3 . 1 1 44 44 HIS H H 44 7.976 7.976 7.857 0.119 25541
699 1 3 . 1 1 45 45 ARG N N 45 120.170 120.170 118.774 1.396 25541
700 1 3 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.145 -0.199 25541
701 1 3 . 1 1 45 45 ARG C C 45 176.310 176.310 178.218 -1.908 25541
702 1 3 . 1 1 45 45 ARG CA C 45 59.206 59.206 58.734 0.472 25541
703 1 3 . 1 1 45 45 ARG CB C 45 30.388 30.388 30.033 0.355 25541
704 1 3 . 1 1 45 45 ARG H H 45 8.166 8.166 8.067 0.099 25541
705 1 3 . 1 1 46 46 ARG N N 46 116.229 116.229 117.717 -1.488 25541
706 1 3 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.118 -0.053 25541
707 1 3 . 1 1 46 46 ARG C C 46 176.046 176.046 177.868 -1.822 25541
708 1 3 . 1 1 46 46 ARG CA C 46 57.691 57.691 57.315 0.376 25541
709 1 3 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.536 0.712 25541
710 1 3 . 1 1 46 46 ARG H H 46 7.764 7.764 7.604 0.160 25541
711 1 3 . 1 1 47 47 LEU N N 47 119.010 119.010 118.946 0.064 25541
712 1 3 . 1 1 47 47 LEU HA H 47 4.135 4.135 3.990 0.145 25541
713 1 3 . 1 1 47 47 LEU CA C 47 55.957 55.957 57.453 -1.496 25541
714 1 3 . 1 1 47 47 LEU CB C 47 42.024 42.024 42.203 -0.179 25541
715 1 3 . 1 1 47 47 LEU H H 47 7.557 7.557 7.495 0.062 25541
716 1 3 . 1 1 48 48 LYS N N 48 119.277 119.277 118.295 0.982 25541
717 1 3 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.497 -0.422 25541
718 1 3 . 1 1 48 48 LYS C C 48 176.354 176.354 175.508 0.846 25541
719 1 3 . 1 1 48 48 LYS CA C 48 56.655 56.655 55.492 1.163 25541
720 1 3 . 1 1 48 48 LYS CB C 48 32.410 32.410 31.911 0.499 25541
721 1 3 . 1 1 48 48 LYS H H 48 7.662 7.662 7.576 0.086 25541
722 1 3 . 1 1 49 49 VAL N N 49 119.095 119.095 120.639 -1.544 25541
723 1 3 . 1 1 49 49 VAL HA H 49 3.972 3.972 4.239 -0.267 25541
724 1 3 . 1 1 49 49 VAL C C 49 174.195 174.195 174.459 -0.264 25541
725 1 3 . 1 1 49 49 VAL CA C 49 62.214 62.214 62.331 -0.117 25541
726 1 3 . 1 1 49 49 VAL CB C 49 32.747 32.747 33.093 -0.346 25541
727 1 3 . 1 1 49 49 VAL H H 49 7.688 7.688 8.411 -0.723 25541
728 1 3 . 1 1 50 50 TYR N N 50 123.606 123.606 121.256 2.350 25541
729 1 3 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.237 0.245 25541
730 1 3 . 1 1 50 50 TYR CA C 50 57.855 57.855 58.813 -0.958 25541
731 1 3 . 1 1 50 50 TYR CB C 50 38.721 38.721 37.815 0.906 25541
732 1 3 . 1 1 50 50 TYR H H 50 8.164 8.164 8.099 0.065 25541
733 1 4 . 1 1 10 10 THR N N 10 114.351 114.351 118.816 -4.465 25541
734 1 4 . 1 1 10 10 THR HA H 10 4.241 4.241 4.073 0.168 25541
735 1 4 . 1 1 10 10 THR C C 10 171.741 171.741 173.958 -2.217 25541
736 1 4 . 1 1 10 10 THR CA C 10 62.002 62.002 63.085 -1.083 25541
737 1 4 . 1 1 10 10 THR CB C 10 69.796 69.796 68.140 1.656 25541
738 1 4 . 1 1 10 10 THR H H 10 8.114 8.114 8.114 -0.000 25541
739 1 4 . 1 1 11 11 LYS N N 11 124.677 124.677 126.054 -1.377 25541
740 1 4 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.364 -0.200 25541
741 1 4 . 1 1 11 11 LYS C C 11 172.964 172.964 175.230 -2.266 25541
742 1 4 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.283 -0.161 25541
743 1 4 . 1 1 11 11 LYS CB C 11 32.819 32.819 33.625 -0.806 25541
744 1 4 . 1 1 11 11 LYS H H 11 8.436 8.436 8.171 0.266 25541
745 1 4 . 1 1 12 12 LYS N N 12 123.337 123.337 123.498 -0.161 25541
746 1 4 . 1 1 12 12 LYS HA H 12 4.093 4.093 3.891 0.202 25541
747 1 4 . 1 1 12 12 LYS C C 12 173.147 173.147 175.964 -2.817 25541
748 1 4 . 1 1 12 12 LYS CA C 12 56.327 56.327 55.563 0.764 25541
749 1 4 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.514 0.709 25541
750 1 4 . 1 1 12 12 LYS H H 12 8.239 8.239 8.048 0.191 25541
751 1 4 . 1 1 13 13 TYR N N 13 119.233 119.233 117.765 1.468 25541
752 1 4 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.682 -0.281 25541
753 1 4 . 1 1 13 13 TYR C C 13 172.016 172.016 174.807 -2.791 25541
754 1 4 . 1 1 13 13 TYR CA C 13 57.325 57.325 56.948 0.377 25541
755 1 4 . 1 1 13 13 TYR CB C 13 39.864 39.864 40.624 -0.760 25541
756 1 4 . 1 1 13 13 TYR H H 13 8.274 8.274 8.014 0.260 25541
757 1 4 . 1 1 14 14 ASP N N 14 120.486 120.486 122.974 -2.488 25541
758 1 4 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.953 -0.276 25541
759 1 4 . 1 1 14 14 ASP C C 14 173.276 173.276 176.127 -2.851 25541
760 1 4 . 1 1 14 14 ASP CA C 14 52.719 52.719 54.002 -1.283 25541
761 1 4 . 1 1 14 14 ASP CB C 14 40.205 40.205 41.191 -0.986 25541
762 1 4 . 1 1 14 14 ASP H H 14 8.603 8.603 8.740 -0.137 25541
763 1 4 . 1 1 15 15 LEU N N 15 126.405 126.405 128.027 -1.622 25541
764 1 4 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.121 -1.356 25541
765 1 4 . 1 1 15 15 LEU C C 15 175.592 175.592 177.431 -1.839 25541
766 1 4 . 1 1 15 15 LEU CA C 15 53.255 53.255 53.788 -0.533 25541
767 1 4 . 1 1 15 15 LEU CB C 15 39.967 39.967 40.607 -0.640 25541
768 1 4 . 1 1 15 15 LEU H H 15 8.901 8.901 8.698 0.203 25541
769 1 4 . 1 1 16 16 SER N N 16 116.540 116.540 117.236 -0.696 25541
770 1 4 . 1 1 16 16 SER HA H 16 4.100 4.100 4.198 -0.098 25541
771 1 4 . 1 1 16 16 SER C C 16 173.247 173.247 174.875 -1.628 25541
772 1 4 . 1 1 16 16 SER CA C 16 61.720 61.720 61.156 0.564 25541
773 1 4 . 1 1 16 16 SER CB C 16 62.797 62.797 63.635 -0.838 25541
774 1 4 . 1 1 16 16 SER H H 16 8.112 8.112 8.086 0.026 25541
775 1 4 . 1 1 17 17 LYS N N 17 118.008 118.008 120.572 -2.564 25541
776 1 4 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.645 -0.144 25541
777 1 4 . 1 1 17 17 LYS C C 17 175.079 175.079 175.186 -0.107 25541
778 1 4 . 1 1 17 17 LYS CA C 17 55.267 55.267 55.854 -0.587 25541
779 1 4 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.238 -2.261 25541
780 1 4 . 1 1 17 17 LYS H H 17 8.521 8.521 8.320 0.201 25541
781 1 4 . 1 1 18 18 TRP N N 18 122.041 122.041 122.459 -0.418 25541
782 1 4 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.747 -0.169 25541
783 1 4 . 1 1 18 18 TRP C C 18 174.862 174.862 174.782 0.080 25541
784 1 4 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.046 1.325 25541
785 1 4 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.033 -3.489 25541
786 1 4 . 1 1 18 18 TRP H H 18 7.853 7.853 8.443 -0.590 25541
787 1 4 . 1 1 19 19 LYS N N 19 123.185 123.185 121.482 1.703 25541
788 1 4 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.672 -0.137 25541
789 1 4 . 1 1 19 19 LYS C C 19 175.094 175.094 177.194 -2.100 25541
790 1 4 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.685 0.742 25541
791 1 4 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.668 -0.548 25541
792 1 4 . 1 1 19 19 LYS H H 19 9.544 9.544 8.387 1.157 25541
793 1 4 . 1 1 20 20 TYR N N 20 124.291 124.291 126.273 -1.982 25541
794 1 4 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.037 -0.012 25541
795 1 4 . 1 1 20 20 TYR C C 20 174.531 174.531 177.033 -2.502 25541
796 1 4 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.677 0.472 25541
797 1 4 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.423 -0.270 25541
798 1 4 . 1 1 20 20 TYR H H 20 9.266 9.266 9.230 0.036 25541
799 1 4 . 1 1 21 21 ALA N N 21 117.781 117.781 121.332 -3.551 25541
800 1 4 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.167 -0.294 25541
801 1 4 . 1 1 21 21 ALA C C 21 176.314 176.314 179.430 -3.116 25541
802 1 4 . 1 1 21 21 ALA CA C 21 55.335 55.335 54.880 0.455 25541
803 1 4 . 1 1 21 21 ALA CB C 21 18.703 18.703 18.070 0.633 25541
804 1 4 . 1 1 21 21 ALA H H 21 8.986 8.986 8.588 0.398 25541
805 1 4 . 1 1 22 22 GLU N N 22 115.218 115.218 119.359 -4.141 25541
806 1 4 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.118 0.001 25541
807 1 4 . 1 1 22 22 GLU C C 22 177.380 177.380 179.368 -1.988 25541
808 1 4 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.518 -1.039 25541
809 1 4 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.341 0.529 25541
810 1 4 . 1 1 22 22 GLU H H 22 6.854 6.854 8.484 -1.630 25541
811 1 4 . 1 1 23 23 LEU N N 23 122.132 122.132 119.742 2.390 25541
812 1 4 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.106 0.050 25541
813 1 4 . 1 1 23 23 LEU C C 23 174.830 174.830 179.687 -4.857 25541
814 1 4 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.164 0.358 25541
815 1 4 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.659 1.460 25541
816 1 4 . 1 1 23 23 LEU H H 23 7.909 7.909 9.007 -1.098 25541
817 1 4 . 1 1 24 24 ARG N N 24 118.051 118.051 119.189 -1.138 25541
818 1 4 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.885 -0.248 25541
819 1 4 . 1 1 24 24 ARG C C 24 175.240 175.240 178.484 -3.244 25541
820 1 4 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.880 0.097 25541
821 1 4 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.703 0.159 25541
822 1 4 . 1 1 24 24 ARG H H 24 8.250 8.250 7.700 0.550 25541
823 1 4 . 1 1 25 25 ASP N N 25 118.179 118.179 119.593 -1.414 25541
824 1 4 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.425 -0.040 25541
825 1 4 . 1 1 25 25 ASP C C 25 176.554 176.554 178.572 -2.018 25541
826 1 4 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.635 -0.279 25541
827 1 4 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.455 -0.413 25541
828 1 4 . 1 1 25 25 ASP H H 25 8.507 8.507 8.644 -0.137 25541
829 1 4 . 1 1 26 26 THR N N 26 118.299 118.299 116.285 2.014 25541
830 1 4 . 1 1 26 26 THR HA H 26 3.891 3.891 4.002 -0.111 25541
831 1 4 . 1 1 26 26 THR C C 26 173.365 173.365 176.775 -3.410 25541
832 1 4 . 1 1 26 26 THR CA C 26 67.787 67.787 67.013 0.774 25541
833 1 4 . 1 1 26 26 THR CB C 26 68.120 68.120 68.871 -0.751 25541
834 1 4 . 1 1 26 26 THR H H 26 7.918 7.918 8.385 -0.467 25541
835 1 4 . 1 1 27 27 ILE N N 27 122.576 122.576 119.093 3.483 25541
836 1 4 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.865 -0.240 25541
837 1 4 . 1 1 27 27 ILE C C 27 174.485 174.485 176.603 -2.118 25541
838 1 4 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.084 0.627 25541
839 1 4 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.711 -0.184 25541
840 1 4 . 1 1 27 27 ILE H H 27 8.159 8.159 7.467 0.692 25541
841 1 4 . 1 1 28 28 ASN N N 28 115.118 115.118 115.771 -0.653 25541
842 1 4 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.721 -0.106 25541
843 1 4 . 1 1 28 28 ASN C C 28 173.902 173.902 175.226 -1.324 25541
844 1 4 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.989 0.471 25541
845 1 4 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.625 -0.395 25541
846 1 4 . 1 1 28 28 ASN H H 28 7.713 7.713 7.843 -0.130 25541
847 1 4 . 1 1 29 29 THR N N 29 107.730 107.730 108.658 -0.928 25541
848 1 4 . 1 1 29 29 THR HA H 29 4.600 4.600 4.414 0.186 25541
849 1 4 . 1 1 29 29 THR C C 29 172.290 172.290 175.003 -2.713 25541
850 1 4 . 1 1 29 29 THR CA C 29 62.595 62.595 62.289 0.306 25541
851 1 4 . 1 1 29 29 THR CB C 29 72.291 72.291 70.382 1.909 25541
852 1 4 . 1 1 29 29 THR H H 29 7.587 7.587 7.398 0.189 25541
853 1 4 . 1 1 30 30 SER N N 30 117.784 117.784 117.989 -0.205 25541
854 1 4 . 1 1 30 30 SER HA H 30 4.296 4.296 4.575 -0.279 25541
855 1 4 . 1 1 30 30 SER C C 30 172.473 172.473 173.050 -0.577 25541
856 1 4 . 1 1 30 30 SER CA C 30 59.618 59.618 58.381 1.237 25541
857 1 4 . 1 1 30 30 SER CB C 30 64.402 64.402 64.570 -0.169 25541
858 1 4 . 1 1 30 30 SER H H 30 8.698 8.698 8.587 0.111 25541
859 1 4 . 1 1 31 31 CYS N N 31 121.196 121.196 119.746 1.450 25541
860 1 4 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.666 0.121 25541
861 1 4 . 1 1 31 31 CYS C C 31 170.861 170.861 172.332 -1.471 25541
862 1 4 . 1 1 31 31 CYS CA C 31 57.372 57.372 59.185 -1.813 25541
863 1 4 . 1 1 31 31 CYS CB C 31 28.364 28.364 29.020 -0.656 25541
864 1 4 . 1 1 31 31 CYS H H 31 8.713 8.713 8.405 0.308 25541
865 1 4 . 1 1 32 32 ASP N N 32 124.610 124.610 126.950 -2.340 25541
866 1 4 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.680 -0.067 25541
867 1 4 . 1 1 32 32 ASP C C 32 172.541 172.541 175.976 -3.435 25541
868 1 4 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.185 -1.000 25541
869 1 4 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.111 -1.974 25541
870 1 4 . 1 1 32 32 ASP H H 32 8.542 8.542 8.238 0.304 25541
871 1 4 . 1 1 33 33 ILE N N 33 125.134 125.134 123.048 2.086 25541
872 1 4 . 1 1 33 33 ILE HA H 33 3.686 3.686 3.942 -0.256 25541
873 1 4 . 1 1 33 33 ILE C C 33 175.743 175.743 176.227 -0.484 25541
874 1 4 . 1 1 33 33 ILE CA C 33 64.710 64.710 63.111 1.599 25541
875 1 4 . 1 1 33 33 ILE CB C 33 37.815 37.815 36.955 0.860 25541
876 1 4 . 1 1 33 33 ILE H H 33 8.459 8.459 8.561 -0.102 25541
877 1 4 . 1 1 34 34 GLU N N 34 121.097 121.097 118.907 2.190 25541
878 1 4 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.360 -0.229 25541
879 1 4 . 1 1 34 34 GLU C C 34 176.406 176.406 178.316 -1.910 25541
880 1 4 . 1 1 34 34 GLU CA C 34 59.333 59.333 57.943 1.390 25541
881 1 4 . 1 1 34 34 GLU CB C 34 29.675 29.675 29.362 0.313 25541
882 1 4 . 1 1 34 34 GLU H H 34 8.177 8.177 7.856 0.321 25541
883 1 4 . 1 1 35 35 LEU N N 35 124.890 124.890 121.884 3.006 25541
884 1 4 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.920 -0.309 25541
885 1 4 . 1 1 35 35 LEU C C 35 176.399 176.399 179.118 -2.719 25541
886 1 4 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.714 -0.646 25541
887 1 4 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.615 -0.705 25541
888 1 4 . 1 1 35 35 LEU H H 35 7.831 7.831 8.020 -0.189 25541
889 1 4 . 1 1 36 36 LEU N N 36 120.493 120.493 118.641 1.852 25541
890 1 4 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.747 -0.088 25541
891 1 4 . 1 1 36 36 LEU C C 36 176.280 176.280 179.039 -2.759 25541
892 1 4 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.189 0.426 25541
893 1 4 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.975 1.494 25541
894 1 4 . 1 1 36 36 LEU H H 36 8.843 8.843 7.952 0.891 25541
895 1 4 . 1 1 37 37 ALA N N 37 119.956 119.956 120.685 -0.729 25541
896 1 4 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.947 0.050 25541
897 1 4 . 1 1 37 37 ALA C C 37 177.606 177.606 179.518 -1.912 25541
898 1 4 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.772 0.397 25541
899 1 4 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.948 -0.328 25541
900 1 4 . 1 1 37 37 ALA H H 37 7.610 7.610 8.054 -0.444 25541
901 1 4 . 1 1 38 38 ALA N N 38 121.594 121.594 120.573 1.021 25541
902 1 4 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.100 0.003 25541
903 1 4 . 1 1 38 38 ALA C C 38 178.452 178.452 178.960 -0.508 25541
904 1 4 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.517 0.338 25541
905 1 4 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.257 -0.197 25541
906 1 4 . 1 1 38 38 ALA H H 38 7.665 7.665 8.493 -0.828 25541
907 1 4 . 1 1 39 39 CYS N N 39 119.263 119.263 118.096 1.167 25541
908 1 4 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.817 -0.086 25541
909 1 4 . 1 1 39 39 CYS C C 39 173.860 173.860 176.733 -2.873 25541
910 1 4 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.673 1.150 25541
911 1 4 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.159 0.066 25541
912 1 4 . 1 1 39 39 CYS H H 39 8.766 8.766 8.521 0.245 25541
913 1 4 . 1 1 40 40 ARG N N 40 119.658 119.658 119.332 0.326 25541
914 1 4 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.879 0.019 25541
915 1 4 . 1 1 40 40 ARG C C 40 176.108 176.108 178.560 -2.452 25541
916 1 4 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.740 0.742 25541
917 1 4 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.686 0.178 25541
918 1 4 . 1 1 40 40 ARG H H 40 8.327 8.327 8.299 0.028 25541
919 1 4 . 1 1 41 41 GLU N N 41 119.358 119.358 118.001 1.357 25541
920 1 4 . 1 1 41 41 GLU HA H 41 4.099 4.099 3.812 0.287 25541
921 1 4 . 1 1 41 41 GLU C C 41 171.786 171.786 178.838 -7.052 25541
922 1 4 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.324 -0.111 25541
923 1 4 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.038 0.239 25541
924 1 4 . 1 1 41 41 GLU H H 41 7.929 7.929 7.663 0.266 25541
925 1 4 . 1 1 42 42 GLU N N 42 121.281 121.281 119.251 2.030 25541
926 1 4 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.109 0.114 25541
927 1 4 . 1 1 42 42 GLU C C 42 173.408 173.408 178.940 -5.532 25541
928 1 4 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.455 -0.135 25541
929 1 4 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.327 -1.112 25541
930 1 4 . 1 1 42 42 GLU H H 42 7.945 7.945 7.589 0.356 25541
931 1 4 . 1 1 43 43 PHE N N 43 119.271 119.271 121.297 -2.026 25541
932 1 4 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.031 0.046 25541
933 1 4 . 1 1 43 43 PHE C C 43 175.299 175.299 177.404 -2.105 25541
934 1 4 . 1 1 43 43 PHE CA C 43 61.549 61.549 62.210 -0.661 25541
935 1 4 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.062 0.072 25541
936 1 4 . 1 1 43 43 PHE H H 43 8.624 8.624 8.279 0.345 25541
937 1 4 . 1 1 44 44 HIS N N 44 116.374 116.374 115.800 0.574 25541
938 1 4 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.235 0.031 25541
939 1 4 . 1 1 44 44 HIS C C 44 174.771 174.771 177.904 -3.133 25541
940 1 4 . 1 1 44 44 HIS CA C 44 59.343 59.343 58.887 0.456 25541
941 1 4 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.653 -0.165 25541
942 1 4 . 1 1 44 44 HIS H H 44 7.976 7.976 8.170 -0.194 25541
943 1 4 . 1 1 45 45 ARG N N 45 120.170 120.170 118.199 1.971 25541
944 1 4 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.055 -0.109 25541
945 1 4 . 1 1 45 45 ARG C C 45 176.310 176.310 178.556 -2.246 25541
946 1 4 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.338 -0.132 25541
947 1 4 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.890 0.498 25541
948 1 4 . 1 1 45 45 ARG H H 45 8.166 8.166 7.972 0.194 25541
949 1 4 . 1 1 46 46 ARG N N 46 116.229 116.229 119.229 -3.000 25541
950 1 4 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.123 -0.058 25541
951 1 4 . 1 1 46 46 ARG C C 46 176.046 176.046 178.528 -2.482 25541
952 1 4 . 1 1 46 46 ARG CA C 46 57.691 57.691 57.652 0.039 25541
953 1 4 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.135 1.113 25541
954 1 4 . 1 1 46 46 ARG H H 46 7.764 7.764 7.476 0.288 25541
955 1 4 . 1 1 47 47 LEU N N 47 119.010 119.010 119.773 -0.763 25541
956 1 4 . 1 1 47 47 LEU HA H 47 4.135 4.135 3.960 0.175 25541
957 1 4 . 1 1 47 47 LEU CA C 47 55.957 55.957 57.834 -1.877 25541
958 1 4 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.366 0.658 25541
959 1 4 . 1 1 47 47 LEU H H 47 7.557 7.557 7.633 -0.076 25541
960 1 4 . 1 1 48 48 LYS N N 48 119.277 119.277 120.315 -1.038 25541
961 1 4 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.045 0.030 25541
962 1 4 . 1 1 48 48 LYS C C 48 176.354 176.354 178.819 -2.465 25541
963 1 4 . 1 1 48 48 LYS CA C 48 56.655 56.655 59.429 -2.774 25541
964 1 4 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.435 -0.025 25541
965 1 4 . 1 1 48 48 LYS H H 48 7.662 7.662 7.576 0.086 25541
966 1 4 . 1 1 49 49 VAL N N 49 119.095 119.095 120.306 -1.211 25541
967 1 4 . 1 1 49 49 VAL HA H 49 3.972 3.972 4.030 -0.058 25541
968 1 4 . 1 1 49 49 VAL C C 49 174.195 174.195 175.335 -1.140 25541
969 1 4 . 1 1 49 49 VAL CA C 49 62.214 62.214 63.501 -1.287 25541
970 1 4 . 1 1 49 49 VAL CB C 49 32.747 32.747 29.663 3.084 25541
971 1 4 . 1 1 49 49 VAL H H 49 7.688 7.688 7.830 -0.142 25541
972 1 4 . 1 1 50 50 TYR N N 50 123.606 123.606 118.860 4.746 25541
973 1 4 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.641 -0.159 25541
974 1 4 . 1 1 50 50 TYR CA C 50 57.855 57.855 57.728 0.127 25541
975 1 4 . 1 1 50 50 TYR CB C 50 38.721 38.721 40.118 -1.397 25541
976 1 4 . 1 1 50 50 TYR H H 50 8.164 8.164 8.047 0.117 25541
977 1 5 . 1 1 10 10 THR N N 10 114.351 114.351 114.640 -0.289 25541
978 1 5 . 1 1 10 10 THR HA H 10 4.241 4.241 4.181 0.060 25541
979 1 5 . 1 1 10 10 THR C C 10 171.741 171.741 173.589 -1.848 25541
980 1 5 . 1 1 10 10 THR CA C 10 62.002 62.002 62.217 -0.214 25541
981 1 5 . 1 1 10 10 THR CB C 10 69.796 69.796 69.338 0.458 25541
982 1 5 . 1 1 10 10 THR H H 10 8.114 8.114 7.938 0.176 25541
983 1 5 . 1 1 11 11 LYS N N 11 124.677 124.677 120.591 4.086 25541
984 1 5 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.442 -0.278 25541
985 1 5 . 1 1 11 11 LYS C C 11 172.964 172.964 175.027 -2.063 25541
986 1 5 . 1 1 11 11 LYS CA C 11 56.122 56.122 55.329 0.793 25541
987 1 5 . 1 1 11 11 LYS CB C 11 32.819 32.819 33.313 -0.494 25541
988 1 5 . 1 1 11 11 LYS H H 11 8.436 8.436 8.081 0.355 25541
989 1 5 . 1 1 12 12 LYS N N 12 123.337 123.337 120.518 2.819 25541
990 1 5 . 1 1 12 12 LYS HA H 12 4.093 4.093 4.038 0.055 25541
991 1 5 . 1 1 12 12 LYS C C 12 173.147 173.147 175.500 -2.353 25541
992 1 5 . 1 1 12 12 LYS CA C 12 56.327 56.327 55.650 0.677 25541
993 1 5 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.838 0.385 25541
994 1 5 . 1 1 12 12 LYS H H 12 8.239 8.239 7.622 0.617 25541
995 1 5 . 1 1 13 13 TYR N N 13 119.233 119.233 118.283 0.950 25541
996 1 5 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.698 -0.297 25541
997 1 5 . 1 1 13 13 TYR C C 13 172.016 172.016 175.628 -3.612 25541
998 1 5 . 1 1 13 13 TYR CA C 13 57.325 57.325 57.073 0.252 25541
999 1 5 . 1 1 13 13 TYR CB C 13 39.864 39.864 41.153 -1.288 25541
1000 1 5 . 1 1 13 13 TYR H H 13 8.274 8.274 8.296 -0.022 25541
1001 1 5 . 1 1 14 14 ASP N N 14 120.486 120.486 123.282 -2.796 25541
1002 1 5 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.928 -0.251 25541
1003 1 5 . 1 1 14 14 ASP C C 14 173.276 173.276 176.254 -2.978 25541
1004 1 5 . 1 1 14 14 ASP CA C 14 52.719 52.719 54.203 -1.484 25541
1005 1 5 . 1 1 14 14 ASP CB C 14 40.205 40.205 41.354 -1.149 25541
1006 1 5 . 1 1 14 14 ASP H H 14 8.603 8.603 8.769 -0.166 25541
1007 1 5 . 1 1 15 15 LEU N N 15 126.405 126.405 125.574 0.831 25541
1008 1 5 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.042 -1.277 25541
1009 1 5 . 1 1 15 15 LEU C C 15 175.592 175.592 177.196 -1.604 25541
1010 1 5 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.227 -0.972 25541
1011 1 5 . 1 1 15 15 LEU CB C 15 39.967 39.967 41.328 -1.361 25541
1012 1 5 . 1 1 15 15 LEU H H 15 8.901 8.901 8.589 0.312 25541
1013 1 5 . 1 1 16 16 SER N N 16 116.540 116.540 116.465 0.075 25541
1014 1 5 . 1 1 16 16 SER HA H 16 4.100 4.100 4.286 -0.186 25541
1015 1 5 . 1 1 16 16 SER C C 16 173.247 173.247 174.894 -1.647 25541
1016 1 5 . 1 1 16 16 SER CA C 16 61.720 61.720 60.407 1.313 25541
1017 1 5 . 1 1 16 16 SER CB C 16 62.797 62.797 63.162 -0.365 25541
1018 1 5 . 1 1 16 16 SER H H 16 8.112 8.112 8.280 -0.168 25541
1019 1 5 . 1 1 17 17 LYS N N 17 118.008 118.008 118.537 -0.529 25541
1020 1 5 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.621 -0.120 25541
1021 1 5 . 1 1 17 17 LYS C C 17 175.079 175.079 175.131 -0.052 25541
1022 1 5 . 1 1 17 17 LYS CA C 17 55.267 55.267 56.300 -1.033 25541
1023 1 5 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.484 -2.507 25541
1024 1 5 . 1 1 17 17 LYS H H 17 8.521 8.521 7.767 0.754 25541
1025 1 5 . 1 1 18 18 TRP N N 18 122.041 122.041 122.721 -0.680 25541
1026 1 5 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.925 -0.347 25541
1027 1 5 . 1 1 18 18 TRP C C 18 174.862 174.862 175.491 -0.629 25541
1028 1 5 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.040 1.331 25541
1029 1 5 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.562 -4.018 25541
1030 1 5 . 1 1 18 18 TRP H H 18 7.853 7.853 8.626 -0.773 25541
1031 1 5 . 1 1 19 19 LYS N N 19 123.185 123.185 121.094 2.091 25541
1032 1 5 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.697 -0.162 25541
1033 1 5 . 1 1 19 19 LYS C C 19 175.094 175.094 177.081 -1.987 25541
1034 1 5 . 1 1 19 19 LYS CA C 19 55.427 55.427 55.172 0.254 25541
1035 1 5 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.810 -0.690 25541
1036 1 5 . 1 1 19 19 LYS H H 19 9.544 9.544 8.464 1.080 25541
1037 1 5 . 1 1 20 20 TYR N N 20 124.291 124.291 125.507 -1.216 25541
1038 1 5 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.034 -0.009 25541
1039 1 5 . 1 1 20 20 TYR C C 20 174.531 174.531 177.213 -2.682 25541
1040 1 5 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.472 0.676 25541
1041 1 5 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.366 -0.213 25541
1042 1 5 . 1 1 20 20 TYR H H 20 9.266 9.266 9.235 0.031 25541
1043 1 5 . 1 1 21 21 ALA N N 21 117.781 117.781 121.406 -3.625 25541
1044 1 5 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.378 -0.505 25541
1045 1 5 . 1 1 21 21 ALA C C 21 176.314 176.314 179.610 -3.296 25541
1046 1 5 . 1 1 21 21 ALA CA C 21 55.335 55.335 55.062 0.273 25541
1047 1 5 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.902 0.801 25541
1048 1 5 . 1 1 21 21 ALA H H 21 8.986 8.986 8.508 0.478 25541
1049 1 5 . 1 1 22 22 GLU N N 22 115.218 115.218 119.464 -4.246 25541
1050 1 5 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.186 -0.067 25541
1051 1 5 . 1 1 22 22 GLU C C 22 177.380 177.380 179.423 -2.043 25541
1052 1 5 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.403 -0.923 25541
1053 1 5 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.300 0.570 25541
1054 1 5 . 1 1 22 22 GLU H H 22 6.854 6.854 8.494 -1.640 25541
1055 1 5 . 1 1 23 23 LEU N N 23 122.132 122.132 119.515 2.617 25541
1056 1 5 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.008 0.148 25541
1057 1 5 . 1 1 23 23 LEU C C 23 174.830 174.830 179.851 -5.021 25541
1058 1 5 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.273 0.249 25541
1059 1 5 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.646 1.473 25541
1060 1 5 . 1 1 23 23 LEU H H 23 7.909 7.909 9.025 -1.116 25541
1061 1 5 . 1 1 24 24 ARG N N 24 118.051 118.051 118.772 -0.721 25541
1062 1 5 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.947 -0.310 25541
1063 1 5 . 1 1 24 24 ARG C C 24 175.240 175.240 178.178 -2.938 25541
1064 1 5 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.754 0.222 25541
1065 1 5 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.891 -0.029 25541
1066 1 5 . 1 1 24 24 ARG H H 24 8.250 8.250 7.629 0.621 25541
1067 1 5 . 1 1 25 25 ASP N N 25 118.179 118.179 118.829 -0.650 25541
1068 1 5 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.468 -0.083 25541
1069 1 5 . 1 1 25 25 ASP C C 25 176.554 176.554 178.007 -1.453 25541
1070 1 5 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.373 -0.017 25541
1071 1 5 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.843 -0.801 25541
1072 1 5 . 1 1 25 25 ASP H H 25 8.507 8.507 8.496 0.011 25541
1073 1 5 . 1 1 26 26 THR N N 26 118.299 118.299 115.658 2.641 25541
1074 1 5 . 1 1 26 26 THR HA H 26 3.891 3.891 4.006 -0.115 25541
1075 1 5 . 1 1 26 26 THR C C 26 173.365 173.365 176.691 -3.326 25541
1076 1 5 . 1 1 26 26 THR CA C 26 67.787 67.787 66.861 0.926 25541
1077 1 5 . 1 1 26 26 THR CB C 26 68.120 68.120 68.855 -0.735 25541
1078 1 5 . 1 1 26 26 THR H H 26 7.918 7.918 8.433 -0.515 25541
1079 1 5 . 1 1 27 27 ILE N N 27 122.576 122.576 119.516 3.060 25541
1080 1 5 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.789 -0.164 25541
1081 1 5 . 1 1 27 27 ILE C C 27 174.485 174.485 176.539 -2.054 25541
1082 1 5 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.432 0.279 25541
1083 1 5 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.597 -0.070 25541
1084 1 5 . 1 1 27 27 ILE H H 27 8.159 8.159 7.403 0.756 25541
1085 1 5 . 1 1 28 28 ASN N N 28 115.118 115.118 115.716 -0.598 25541
1086 1 5 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.714 -0.099 25541
1087 1 5 . 1 1 28 28 ASN C C 28 173.902 173.902 175.225 -1.323 25541
1088 1 5 . 1 1 28 28 ASN CA C 28 54.460 54.460 54.070 0.390 25541
1089 1 5 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.541 -0.311 25541
1090 1 5 . 1 1 28 28 ASN H H 28 7.713 7.713 7.923 -0.210 25541
1091 1 5 . 1 1 29 29 THR N N 29 107.730 107.730 109.433 -1.703 25541
1092 1 5 . 1 1 29 29 THR HA H 29 4.600 4.600 4.415 0.185 25541
1093 1 5 . 1 1 29 29 THR C C 29 172.290 172.290 174.947 -2.657 25541
1094 1 5 . 1 1 29 29 THR CA C 29 62.595 62.595 62.470 0.125 25541
1095 1 5 . 1 1 29 29 THR CB C 29 72.291 72.291 70.305 1.986 25541
1096 1 5 . 1 1 29 29 THR H H 29 7.587 7.587 7.430 0.157 25541
1097 1 5 . 1 1 30 30 SER N N 30 117.784 117.784 117.760 0.024 25541
1098 1 5 . 1 1 30 30 SER HA H 30 4.296 4.296 4.537 -0.241 25541
1099 1 5 . 1 1 30 30 SER C C 30 172.473 172.473 173.089 -0.616 25541
1100 1 5 . 1 1 30 30 SER CA C 30 59.618 59.618 58.758 0.860 25541
1101 1 5 . 1 1 30 30 SER CB C 30 64.402 64.402 64.312 0.090 25541
1102 1 5 . 1 1 30 30 SER H H 30 8.698 8.698 8.270 0.428 25541
1103 1 5 . 1 1 31 31 CYS N N 31 121.196 121.196 119.440 1.756 25541
1104 1 5 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.631 0.156 25541
1105 1 5 . 1 1 31 31 CYS C C 31 170.861 170.861 172.529 -1.668 25541
1106 1 5 . 1 1 31 31 CYS CA C 31 57.372 57.372 59.156 -1.784 25541
1107 1 5 . 1 1 31 31 CYS CB C 31 28.364 28.364 29.038 -0.674 25541
1108 1 5 . 1 1 31 31 CYS H H 31 8.713 8.713 8.374 0.339 25541
1109 1 5 . 1 1 32 32 ASP N N 32 124.610 124.610 124.878 -0.268 25541
1110 1 5 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.851 -0.238 25541
1111 1 5 . 1 1 32 32 ASP C C 32 172.541 172.541 174.861 -2.320 25541
1112 1 5 . 1 1 32 32 ASP CA C 32 53.185 53.185 53.806 -0.621 25541
1113 1 5 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.343 -2.206 25541
1114 1 5 . 1 1 32 32 ASP H H 32 8.542 8.542 8.067 0.475 25541
1115 1 5 . 1 1 33 33 ILE N N 33 125.134 125.134 121.555 3.579 25541
1116 1 5 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.093 -0.407 25541
1117 1 5 . 1 1 33 33 ILE C C 33 175.743 175.743 176.147 -0.404 25541
1118 1 5 . 1 1 33 33 ILE CA C 33 64.710 64.710 62.661 2.049 25541
1119 1 5 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.504 0.311 25541
1120 1 5 . 1 1 33 33 ILE H H 33 8.459 8.459 8.561 -0.102 25541
1121 1 5 . 1 1 34 34 GLU N N 34 121.097 121.097 120.171 0.926 25541
1122 1 5 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.252 -0.121 25541
1123 1 5 . 1 1 34 34 GLU C C 34 176.406 176.406 178.084 -1.678 25541
1124 1 5 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.197 1.136 25541
1125 1 5 . 1 1 34 34 GLU CB C 34 29.675 29.675 30.377 -0.702 25541
1126 1 5 . 1 1 34 34 GLU H H 34 8.177 8.177 7.824 0.353 25541
1127 1 5 . 1 1 35 35 LEU N N 35 124.890 124.890 120.976 3.914 25541
1128 1 5 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.851 -0.240 25541
1129 1 5 . 1 1 35 35 LEU C C 35 176.399 176.399 178.800 -2.401 25541
1130 1 5 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.867 -0.799 25541
1131 1 5 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.750 -0.840 25541
1132 1 5 . 1 1 35 35 LEU H H 35 7.831 7.831 7.769 0.062 25541
1133 1 5 . 1 1 36 36 LEU N N 36 120.493 120.493 118.693 1.800 25541
1134 1 5 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.722 -0.063 25541
1135 1 5 . 1 1 36 36 LEU C C 36 176.280 176.280 178.925 -2.645 25541
1136 1 5 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.137 0.478 25541
1137 1 5 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.965 1.504 25541
1138 1 5 . 1 1 36 36 LEU H H 36 8.843 8.843 7.479 1.364 25541
1139 1 5 . 1 1 37 37 ALA N N 37 119.956 119.956 120.532 -0.576 25541
1140 1 5 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.959 0.038 25541
1141 1 5 . 1 1 37 37 ALA C C 37 177.606 177.606 179.474 -1.868 25541
1142 1 5 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.725 0.444 25541
1143 1 5 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.861 -0.241 25541
1144 1 5 . 1 1 37 37 ALA H H 37 7.610 7.610 8.226 -0.616 25541
1145 1 5 . 1 1 38 38 ALA N N 38 121.594 121.594 121.430 0.164 25541
1146 1 5 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.383 -0.280 25541
1147 1 5 . 1 1 38 38 ALA C C 38 178.452 178.452 178.863 -0.411 25541
1148 1 5 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.227 0.628 25541
1149 1 5 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.471 -0.411 25541
1150 1 5 . 1 1 38 38 ALA H H 38 7.665 7.665 8.177 -0.512 25541
1151 1 5 . 1 1 39 39 CYS N N 39 119.263 119.263 117.976 1.287 25541
1152 1 5 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.793 -0.062 25541
1153 1 5 . 1 1 39 39 CYS C C 39 173.860 173.860 176.564 -2.704 25541
1154 1 5 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.575 1.248 25541
1155 1 5 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.740 -0.515 25541
1156 1 5 . 1 1 39 39 CYS H H 39 8.766 8.766 8.508 0.258 25541
1157 1 5 . 1 1 40 40 ARG N N 40 119.658 119.658 119.254 0.404 25541
1158 1 5 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.737 0.161 25541
1159 1 5 . 1 1 40 40 ARG C C 40 176.108 176.108 178.396 -2.288 25541
1160 1 5 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.509 0.973 25541
1161 1 5 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.647 0.217 25541
1162 1 5 . 1 1 40 40 ARG H H 40 8.327 8.327 8.361 -0.034 25541
1163 1 5 . 1 1 41 41 GLU N N 41 119.358 119.358 118.016 1.342 25541
1164 1 5 . 1 1 41 41 GLU HA H 41 4.099 4.099 3.851 0.248 25541
1165 1 5 . 1 1 41 41 GLU C C 41 171.786 171.786 178.832 -7.046 25541
1166 1 5 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.438 -0.225 25541
1167 1 5 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.275 0.002 25541
1168 1 5 . 1 1 41 41 GLU H H 41 7.929 7.929 7.651 0.278 25541
1169 1 5 . 1 1 42 42 GLU N N 42 121.281 121.281 119.319 1.962 25541
1170 1 5 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.101 0.122 25541
1171 1 5 . 1 1 42 42 GLU C C 42 173.408 173.408 178.861 -5.453 25541
1172 1 5 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.522 -0.203 25541
1173 1 5 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.385 -1.170 25541
1174 1 5 . 1 1 42 42 GLU H H 42 7.945 7.945 7.588 0.357 25541
1175 1 5 . 1 1 43 43 PHE N N 43 119.271 119.271 120.238 -0.967 25541
1176 1 5 . 1 1 43 43 PHE HA H 43 4.077 4.077 3.959 0.118 25541
1177 1 5 . 1 1 43 43 PHE C C 43 175.299 175.299 177.846 -2.547 25541
1178 1 5 . 1 1 43 43 PHE CA C 43 61.549 61.549 61.793 -0.244 25541
1179 1 5 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.072 0.062 25541
1180 1 5 . 1 1 43 43 PHE H H 43 8.624 8.624 8.529 0.095 25541
1181 1 5 . 1 1 44 44 HIS N N 44 116.374 116.374 115.919 0.455 25541
1182 1 5 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.413 -0.147 25541
1183 1 5 . 1 1 44 44 HIS C C 44 174.771 174.771 177.829 -3.058 25541
1184 1 5 . 1 1 44 44 HIS CA C 44 59.343 59.343 58.214 1.129 25541
1185 1 5 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.800 -0.312 25541
1186 1 5 . 1 1 44 44 HIS H H 44 7.976 7.976 8.016 -0.040 25541
1187 1 5 . 1 1 45 45 ARG N N 45 120.170 120.170 119.349 0.821 25541
1188 1 5 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.066 -0.120 25541
1189 1 5 . 1 1 45 45 ARG C C 45 176.310 176.310 178.540 -2.230 25541
1190 1 5 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.148 0.059 25541
1191 1 5 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.903 0.485 25541
1192 1 5 . 1 1 45 45 ARG H H 45 8.166 8.166 8.025 0.141 25541
1193 1 5 . 1 1 46 46 ARG N N 46 116.229 116.229 119.450 -3.221 25541
1194 1 5 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.225 -0.160 25541
1195 1 5 . 1 1 46 46 ARG C C 46 176.046 176.046 178.823 -2.777 25541
1196 1 5 . 1 1 46 46 ARG CA C 46 57.691 57.691 58.084 -0.393 25541
1197 1 5 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.308 0.940 25541
1198 1 5 . 1 1 46 46 ARG H H 46 7.764 7.764 7.544 0.220 25541
1199 1 5 . 1 1 47 47 LEU N N 47 119.010 119.010 119.264 -0.254 25541
1200 1 5 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.111 0.025 25541
1201 1 5 . 1 1 47 47 LEU CA C 47 55.957 55.957 57.263 -1.306 25541
1202 1 5 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.258 0.766 25541
1203 1 5 . 1 1 47 47 LEU H H 47 7.557 7.557 7.693 -0.136 25541
1204 1 5 . 1 1 48 48 LYS N N 48 119.277 119.277 118.623 0.654 25541
1205 1 5 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.072 0.003 25541
1206 1 5 . 1 1 48 48 LYS C C 48 176.354 176.354 176.957 -0.603 25541
1207 1 5 . 1 1 48 48 LYS CA C 48 56.655 56.655 58.695 -2.040 25541
1208 1 5 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.726 -0.316 25541
1209 1 5 . 1 1 48 48 LYS H H 48 7.662 7.662 7.403 0.259 25541
1210 1 5 . 1 1 49 49 VAL N N 49 119.095 119.095 117.118 1.977 25541
1211 1 5 . 1 1 49 49 VAL HA H 49 3.972 3.972 3.843 0.129 25541
1212 1 5 . 1 1 49 49 VAL C C 49 174.195 174.195 175.399 -1.204 25541
1213 1 5 . 1 1 49 49 VAL CA C 49 62.214 62.214 61.815 0.399 25541
1214 1 5 . 1 1 49 49 VAL CB C 49 32.747 32.747 31.948 0.799 25541
1215 1 5 . 1 1 49 49 VAL H H 49 7.688 7.688 7.374 0.314 25541
1216 1 5 . 1 1 50 50 TYR N N 50 123.606 123.606 114.839 8.767 25541
1217 1 5 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.059 0.423 25541
1218 1 5 . 1 1 50 50 TYR CA C 50 57.855 57.855 58.386 -0.532 25541
1219 1 5 . 1 1 50 50 TYR CB C 50 38.721 38.721 35.927 2.794 25541
1220 1 5 . 1 1 50 50 TYR H H 50 8.164 8.164 7.575 0.589 25541
1221 1 6 . 1 1 10 10 THR N N 10 114.351 114.351 114.365 -0.014 25541
1222 1 6 . 1 1 10 10 THR HA H 10 4.241 4.241 4.473 -0.232 25541
1223 1 6 . 1 1 10 10 THR C C 10 171.741 171.741 172.248 -0.507 25541
1224 1 6 . 1 1 10 10 THR CA C 10 62.002 62.002 62.612 -0.610 25541
1225 1 6 . 1 1 10 10 THR CB C 10 69.796 69.796 70.049 -0.253 25541
1226 1 6 . 1 1 10 10 THR H H 10 8.114 8.114 7.674 0.440 25541
1227 1 6 . 1 1 11 11 LYS N N 11 124.677 124.677 121.474 3.203 25541
1228 1 6 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.295 -0.131 25541
1229 1 6 . 1 1 11 11 LYS C C 11 172.964 172.964 174.327 -1.363 25541
1230 1 6 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.134 -0.012 25541
1231 1 6 . 1 1 11 11 LYS CB C 11 32.819 32.819 33.278 -0.459 25541
1232 1 6 . 1 1 11 11 LYS H H 11 8.436 8.436 8.176 0.260 25541
1233 1 6 . 1 1 12 12 LYS N N 12 123.337 123.337 123.185 0.152 25541
1234 1 6 . 1 1 12 12 LYS HA H 12 4.093 4.093 3.782 0.311 25541
1235 1 6 . 1 1 12 12 LYS C C 12 173.147 173.147 174.906 -1.759 25541
1236 1 6 . 1 1 12 12 LYS CA C 12 56.327 56.327 56.568 -0.241 25541
1237 1 6 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.601 0.622 25541
1238 1 6 . 1 1 12 12 LYS H H 12 8.239 8.239 8.029 0.210 25541
1239 1 6 . 1 1 13 13 TYR N N 13 119.233 119.233 116.374 2.859 25541
1240 1 6 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.641 -0.240 25541
1241 1 6 . 1 1 13 13 TYR C C 13 172.016 172.016 174.575 -2.559 25541
1242 1 6 . 1 1 13 13 TYR CA C 13 57.325 57.325 57.006 0.319 25541
1243 1 6 . 1 1 13 13 TYR CB C 13 39.864 39.864 41.240 -1.376 25541
1244 1 6 . 1 1 13 13 TYR H H 13 8.274 8.274 7.826 0.448 25541
1245 1 6 . 1 1 14 14 ASP N N 14 120.486 120.486 120.981 -0.495 25541
1246 1 6 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.918 -0.241 25541
1247 1 6 . 1 1 14 14 ASP C C 14 173.276 173.276 176.416 -3.140 25541
1248 1 6 . 1 1 14 14 ASP CA C 14 52.719 52.719 53.705 -0.986 25541
1249 1 6 . 1 1 14 14 ASP CB C 14 40.205 40.205 40.926 -0.721 25541
1250 1 6 . 1 1 14 14 ASP H H 14 8.603 8.603 8.734 -0.131 25541
1251 1 6 . 1 1 15 15 LEU N N 15 126.405 126.405 125.020 1.385 25541
1252 1 6 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.054 -1.289 25541
1253 1 6 . 1 1 15 15 LEU C C 15 175.592 175.592 177.218 -1.626 25541
1254 1 6 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.369 -1.114 25541
1255 1 6 . 1 1 15 15 LEU CB C 15 39.967 39.967 40.683 -0.716 25541
1256 1 6 . 1 1 15 15 LEU H H 15 8.901 8.901 8.692 0.209 25541
1257 1 6 . 1 1 16 16 SER N N 16 116.540 116.540 116.137 0.403 25541
1258 1 6 . 1 1 16 16 SER HA H 16 4.100 4.100 4.201 -0.101 25541
1259 1 6 . 1 1 16 16 SER C C 16 173.247 173.247 174.100 -0.853 25541
1260 1 6 . 1 1 16 16 SER CA C 16 61.720 61.720 61.010 0.710 25541
1261 1 6 . 1 1 16 16 SER CB C 16 62.797 62.797 63.395 -0.598 25541
1262 1 6 . 1 1 16 16 SER H H 16 8.112 8.112 8.690 -0.578 25541
1263 1 6 . 1 1 17 17 LYS N N 17 118.008 118.008 118.171 -0.163 25541
1264 1 6 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.575 -0.074 25541
1265 1 6 . 1 1 17 17 LYS C C 17 175.079 175.079 175.039 0.040 25541
1266 1 6 . 1 1 17 17 LYS CA C 17 55.267 55.267 56.367 -1.100 25541
1267 1 6 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.380 -2.403 25541
1268 1 6 . 1 1 17 17 LYS H H 17 8.521 8.521 7.833 0.688 25541
1269 1 6 . 1 1 18 18 TRP N N 18 122.041 122.041 122.168 -0.127 25541
1270 1 6 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.867 -0.289 25541
1271 1 6 . 1 1 18 18 TRP C C 18 174.862 174.862 175.177 -0.315 25541
1272 1 6 . 1 1 18 18 TRP CA C 18 58.371 58.371 56.849 1.522 25541
1273 1 6 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.649 -4.105 25541
1274 1 6 . 1 1 18 18 TRP H H 18 7.853 7.853 8.435 -0.582 25541
1275 1 6 . 1 1 19 19 LYS N N 19 123.185 123.185 120.617 2.568 25541
1276 1 6 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.676 -0.141 25541
1277 1 6 . 1 1 19 19 LYS C C 19 175.094 175.094 177.014 -1.920 25541
1278 1 6 . 1 1 19 19 LYS CA C 19 55.427 55.427 55.038 0.389 25541
1279 1 6 . 1 1 19 19 LYS CB C 19 33.120 33.120 34.370 -1.250 25541
1280 1 6 . 1 1 19 19 LYS H H 19 9.544 9.544 8.268 1.276 25541
1281 1 6 . 1 1 20 20 TYR N N 20 124.291 124.291 125.213 -0.922 25541
1282 1 6 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.051 -0.026 25541
1283 1 6 . 1 1 20 20 TYR C C 20 174.531 174.531 177.192 -2.661 25541
1284 1 6 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.622 0.527 25541
1285 1 6 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.288 -0.135 25541
1286 1 6 . 1 1 20 20 TYR H H 20 9.266 9.266 9.185 0.081 25541
1287 1 6 . 1 1 21 21 ALA N N 21 117.781 117.781 121.155 -3.374 25541
1288 1 6 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.120 -0.247 25541
1289 1 6 . 1 1 21 21 ALA C C 21 176.314 176.314 179.658 -3.344 25541
1290 1 6 . 1 1 21 21 ALA CA C 21 55.335 55.335 55.252 0.083 25541
1291 1 6 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.666 1.037 25541
1292 1 6 . 1 1 21 21 ALA H H 21 8.986 8.986 8.573 0.413 25541
1293 1 6 . 1 1 22 22 GLU N N 22 115.218 115.218 119.141 -3.923 25541
1294 1 6 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.123 -0.004 25541
1295 1 6 . 1 1 22 22 GLU C C 22 177.380 177.380 179.357 -1.977 25541
1296 1 6 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.396 -0.917 25541
1297 1 6 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.351 0.519 25541
1298 1 6 . 1 1 22 22 GLU H H 22 6.854 6.854 8.444 -1.590 25541
1299 1 6 . 1 1 23 23 LEU N N 23 122.132 122.132 120.267 1.865 25541
1300 1 6 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.120 0.036 25541
1301 1 6 . 1 1 23 23 LEU C C 23 174.830 174.830 179.732 -4.902 25541
1302 1 6 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.320 0.202 25541
1303 1 6 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.719 1.400 25541
1304 1 6 . 1 1 23 23 LEU H H 23 7.909 7.909 9.028 -1.119 25541
1305 1 6 . 1 1 24 24 ARG N N 24 118.051 118.051 118.595 -0.544 25541
1306 1 6 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.883 -0.246 25541
1307 1 6 . 1 1 24 24 ARG C C 24 175.240 175.240 178.337 -3.097 25541
1308 1 6 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.795 0.181 25541
1309 1 6 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.628 0.234 25541
1310 1 6 . 1 1 24 24 ARG H H 24 8.250 8.250 7.997 0.253 25541
1311 1 6 . 1 1 25 25 ASP N N 25 118.179 118.179 118.754 -0.575 25541
1312 1 6 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.431 -0.046 25541
1313 1 6 . 1 1 25 25 ASP C C 25 176.554 176.554 178.579 -2.025 25541
1314 1 6 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.245 0.111 25541
1315 1 6 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.819 -0.777 25541
1316 1 6 . 1 1 25 25 ASP H H 25 8.507 8.507 8.419 0.088 25541
1317 1 6 . 1 1 26 26 THR N N 26 118.299 118.299 118.360 -0.061 25541
1318 1 6 . 1 1 26 26 THR HA H 26 3.891 3.891 3.972 -0.081 25541
1319 1 6 . 1 1 26 26 THR C C 26 173.365 173.365 176.589 -3.224 25541
1320 1 6 . 1 1 26 26 THR CA C 26 67.787 67.787 66.729 1.058 25541
1321 1 6 . 1 1 26 26 THR CB C 26 68.120 68.120 68.999 -0.879 25541
1322 1 6 . 1 1 26 26 THR H H 26 7.918 7.918 8.482 -0.564 25541
1323 1 6 . 1 1 27 27 ILE N N 27 122.576 122.576 118.481 4.095 25541
1324 1 6 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.802 -0.177 25541
1325 1 6 . 1 1 27 27 ILE C C 27 174.485 174.485 176.485 -2.000 25541
1326 1 6 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.393 0.318 25541
1327 1 6 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.685 -0.158 25541
1328 1 6 . 1 1 27 27 ILE H H 27 8.159 8.159 7.467 0.692 25541
1329 1 6 . 1 1 28 28 ASN N N 28 115.118 115.118 115.232 -0.114 25541
1330 1 6 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.778 -0.163 25541
1331 1 6 . 1 1 28 28 ASN C C 28 173.902 173.902 174.973 -1.071 25541
1332 1 6 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.443 1.017 25541
1333 1 6 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.276 -0.046 25541
1334 1 6 . 1 1 28 28 ASN H H 28 7.713 7.713 7.765 -0.052 25541
1335 1 6 . 1 1 29 29 THR N N 29 107.730 107.730 109.999 -2.269 25541
1336 1 6 . 1 1 29 29 THR HA H 29 4.600 4.600 4.438 0.162 25541
1337 1 6 . 1 1 29 29 THR C C 29 172.290 172.290 174.481 -2.191 25541
1338 1 6 . 1 1 29 29 THR CA C 29 62.595 62.595 62.650 -0.055 25541
1339 1 6 . 1 1 29 29 THR CB C 29 72.291 72.291 70.354 1.937 25541
1340 1 6 . 1 1 29 29 THR H H 29 7.587 7.587 7.693 -0.106 25541
1341 1 6 . 1 1 30 30 SER N N 30 117.784 117.784 117.806 -0.022 25541
1342 1 6 . 1 1 30 30 SER HA H 30 4.296 4.296 4.594 -0.298 25541
1343 1 6 . 1 1 30 30 SER C C 30 172.473 172.473 173.007 -0.534 25541
1344 1 6 . 1 1 30 30 SER CA C 30 59.618 59.618 58.444 1.174 25541
1345 1 6 . 1 1 30 30 SER CB C 30 64.402 64.402 64.236 0.166 25541
1346 1 6 . 1 1 30 30 SER H H 30 8.698 8.698 8.503 0.195 25541
1347 1 6 . 1 1 31 31 CYS N N 31 121.196 121.196 119.462 1.734 25541
1348 1 6 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.673 0.114 25541
1349 1 6 . 1 1 31 31 CYS C C 31 170.861 170.861 172.377 -1.516 25541
1350 1 6 . 1 1 31 31 CYS CA C 31 57.372 57.372 59.235 -1.863 25541
1351 1 6 . 1 1 31 31 CYS CB C 31 28.364 28.364 28.712 -0.348 25541
1352 1 6 . 1 1 31 31 CYS H H 31 8.713 8.713 8.318 0.395 25541
1353 1 6 . 1 1 32 32 ASP N N 32 124.610 124.610 126.735 -2.125 25541
1354 1 6 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.771 -0.158 25541
1355 1 6 . 1 1 32 32 ASP C C 32 172.541 172.541 175.765 -3.224 25541
1356 1 6 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.140 -0.955 25541
1357 1 6 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.164 -2.027 25541
1358 1 6 . 1 1 32 32 ASP H H 32 8.542 8.542 8.206 0.336 25541
1359 1 6 . 1 1 33 33 ILE N N 33 125.134 125.134 122.630 2.504 25541
1360 1 6 . 1 1 33 33 ILE HA H 33 3.686 3.686 3.885 -0.199 25541
1361 1 6 . 1 1 33 33 ILE C C 33 175.743 175.743 176.169 -0.426 25541
1362 1 6 . 1 1 33 33 ILE CA C 33 64.710 64.710 63.184 1.526 25541
1363 1 6 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.917 -0.102 25541
1364 1 6 . 1 1 33 33 ILE H H 33 8.459 8.459 8.541 -0.082 25541
1365 1 6 . 1 1 34 34 GLU N N 34 121.097 121.097 119.282 1.815 25541
1366 1 6 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.174 -0.043 25541
1367 1 6 . 1 1 34 34 GLU C C 34 176.406 176.406 178.108 -1.702 25541
1368 1 6 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.382 0.951 25541
1369 1 6 . 1 1 34 34 GLU CB C 34 29.675 29.675 30.225 -0.550 25541
1370 1 6 . 1 1 34 34 GLU H H 34 8.177 8.177 7.941 0.236 25541
1371 1 6 . 1 1 35 35 LEU N N 35 124.890 124.890 121.514 3.376 25541
1372 1 6 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.847 -0.236 25541
1373 1 6 . 1 1 35 35 LEU C C 35 176.399 176.399 178.934 -2.535 25541
1374 1 6 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.665 -0.597 25541
1375 1 6 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.566 -0.656 25541
1376 1 6 . 1 1 35 35 LEU H H 35 7.831 7.831 7.998 -0.167 25541
1377 1 6 . 1 1 36 36 LEU N N 36 120.493 120.493 118.615 1.878 25541
1378 1 6 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.726 -0.067 25541
1379 1 6 . 1 1 36 36 LEU C C 36 176.280 176.280 178.949 -2.669 25541
1380 1 6 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.198 0.417 25541
1381 1 6 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.977 1.492 25541
1382 1 6 . 1 1 36 36 LEU H H 36 8.843 8.843 7.712 1.131 25541
1383 1 6 . 1 1 37 37 ALA N N 37 119.956 119.956 120.517 -0.561 25541
1384 1 6 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.938 0.059 25541
1385 1 6 . 1 1 37 37 ALA C C 37 177.606 177.606 179.495 -1.889 25541
1386 1 6 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.772 0.397 25541
1387 1 6 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.873 -0.253 25541
1388 1 6 . 1 1 37 37 ALA H H 37 7.610 7.610 8.187 -0.577 25541
1389 1 6 . 1 1 38 38 ALA N N 38 121.594 121.594 121.339 0.255 25541
1390 1 6 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.396 -0.293 25541
1391 1 6 . 1 1 38 38 ALA C C 38 178.452 178.452 178.944 -0.492 25541
1392 1 6 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.160 0.695 25541
1393 1 6 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.457 -0.397 25541
1394 1 6 . 1 1 38 38 ALA H H 38 7.665 7.665 8.170 -0.505 25541
1395 1 6 . 1 1 39 39 CYS N N 39 119.263 119.263 118.088 1.175 25541
1396 1 6 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.842 -0.111 25541
1397 1 6 . 1 1 39 39 CYS C C 39 173.860 173.860 176.638 -2.778 25541
1398 1 6 . 1 1 39 39 CYS CA C 39 63.823 63.823 63.045 0.777 25541
1399 1 6 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.701 -0.476 25541
1400 1 6 . 1 1 39 39 CYS H H 39 8.766 8.766 8.533 0.233 25541
1401 1 6 . 1 1 40 40 ARG N N 40 119.658 119.658 119.252 0.406 25541
1402 1 6 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.907 -0.009 25541
1403 1 6 . 1 1 40 40 ARG C C 40 176.108 176.108 178.584 -2.476 25541
1404 1 6 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.934 0.548 25541
1405 1 6 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.764 0.100 25541
1406 1 6 . 1 1 40 40 ARG H H 40 8.327 8.327 8.488 -0.161 25541
1407 1 6 . 1 1 41 41 GLU N N 41 119.358 119.358 118.293 1.065 25541
1408 1 6 . 1 1 41 41 GLU HA H 41 4.099 4.099 3.841 0.258 25541
1409 1 6 . 1 1 41 41 GLU C C 41 171.786 171.786 179.196 -7.410 25541
1410 1 6 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.437 -0.223 25541
1411 1 6 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.237 0.040 25541
1412 1 6 . 1 1 41 41 GLU H H 41 7.929 7.929 7.739 0.190 25541
1413 1 6 . 1 1 42 42 GLU N N 42 121.281 121.281 119.621 1.660 25541
1414 1 6 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.123 0.100 25541
1415 1 6 . 1 1 42 42 GLU C C 42 173.408 173.408 178.704 -5.296 25541
1416 1 6 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.260 0.059 25541
1417 1 6 . 1 1 42 42 GLU CB C 42 28.215 28.215 28.959 -0.744 25541
1418 1 6 . 1 1 42 42 GLU H H 42 7.945 7.945 7.663 0.282 25541
1419 1 6 . 1 1 43 43 PHE N N 43 119.271 119.271 122.158 -2.887 25541
1420 1 6 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.074 0.003 25541
1421 1 6 . 1 1 43 43 PHE C C 43 175.299 175.299 177.391 -2.092 25541
1422 1 6 . 1 1 43 43 PHE CA C 43 61.549 61.549 62.344 -0.795 25541
1423 1 6 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.109 0.025 25541
1424 1 6 . 1 1 43 43 PHE H H 43 8.624 8.624 8.812 -0.188 25541
1425 1 6 . 1 1 44 44 HIS N N 44 116.374 116.374 115.586 0.788 25541
1426 1 6 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.259 0.007 25541
1427 1 6 . 1 1 44 44 HIS C C 44 174.771 174.771 178.033 -3.262 25541
1428 1 6 . 1 1 44 44 HIS CA C 44 59.343 59.343 58.897 0.446 25541
1429 1 6 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.739 -0.251 25541
1430 1 6 . 1 1 44 44 HIS H H 44 7.976 7.976 8.329 -0.353 25541
1431 1 6 . 1 1 45 45 ARG N N 45 120.170 120.170 118.903 1.267 25541
1432 1 6 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.192 -0.246 25541
1433 1 6 . 1 1 45 45 ARG C C 45 176.310 176.310 179.019 -2.709 25541
1434 1 6 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.047 0.159 25541
1435 1 6 . 1 1 45 45 ARG CB C 45 30.388 30.388 30.279 0.109 25541
1436 1 6 . 1 1 45 45 ARG H H 45 8.166 8.166 8.062 0.104 25541
1437 1 6 . 1 1 46 46 ARG N N 46 116.229 116.229 119.455 -3.226 25541
1438 1 6 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.018 0.047 25541
1439 1 6 . 1 1 46 46 ARG C C 46 176.046 176.046 178.773 -2.727 25541
1440 1 6 . 1 1 46 46 ARG CA C 46 57.691 57.691 57.734 -0.043 25541
1441 1 6 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.034 1.214 25541
1442 1 6 . 1 1 46 46 ARG H H 46 7.764 7.764 7.773 -0.009 25541
1443 1 6 . 1 1 47 47 LEU N N 47 119.010 119.010 119.272 -0.262 25541
1444 1 6 . 1 1 47 47 LEU HA H 47 4.135 4.135 3.962 0.173 25541
1445 1 6 . 1 1 47 47 LEU CA C 47 55.957 55.957 57.468 -1.511 25541
1446 1 6 . 1 1 47 47 LEU CB C 47 42.024 42.024 42.233 -0.209 25541
1447 1 6 . 1 1 47 47 LEU H H 47 7.557 7.557 7.604 -0.047 25541
1448 1 6 . 1 1 48 48 LYS N N 48 119.277 119.277 114.576 4.701 25541
1449 1 6 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.534 -0.459 25541
1450 1 6 . 1 1 48 48 LYS C C 48 176.354 176.354 174.424 1.930 25541
1451 1 6 . 1 1 48 48 LYS CA C 48 56.655 56.655 55.608 1.047 25541
1452 1 6 . 1 1 48 48 LYS CB C 48 32.410 32.410 34.370 -1.960 25541
1453 1 6 . 1 1 48 48 LYS H H 48 7.662 7.662 7.475 0.187 25541
1454 1 6 . 1 1 49 49 VAL N N 49 119.095 119.095 118.421 0.674 25541
1455 1 6 . 1 1 49 49 VAL HA H 49 3.972 3.972 4.712 -0.740 25541
1456 1 6 . 1 1 49 49 VAL C C 49 174.195 174.195 175.073 -0.878 25541
1457 1 6 . 1 1 49 49 VAL CA C 49 62.214 62.214 60.103 2.111 25541
1458 1 6 . 1 1 49 49 VAL CB C 49 32.747 32.747 34.276 -1.529 25541
1459 1 6 . 1 1 49 49 VAL H H 49 7.688 7.688 8.145 -0.457 25541
1460 1 6 . 1 1 50 50 TYR N N 50 123.606 123.606 119.006 4.600 25541
1461 1 6 . 1 1 50 50 TYR HA H 50 4.482 4.482 5.085 -0.603 25541
1462 1 6 . 1 1 50 50 TYR CA C 50 57.855 57.855 57.536 0.319 25541
1463 1 6 . 1 1 50 50 TYR CB C 50 38.721 38.721 37.923 0.798 25541
1464 1 6 . 1 1 50 50 TYR H H 50 8.164 8.164 8.652 -0.488 25541
1465 1 7 . 1 1 10 10 THR N N 10 114.351 114.351 113.652 0.699 25541
1466 1 7 . 1 1 10 10 THR HA H 10 4.241 4.241 4.511 -0.270 25541
1467 1 7 . 1 1 10 10 THR C C 10 171.741 171.741 173.420 -1.679 25541
1468 1 7 . 1 1 10 10 THR CA C 10 62.002 62.002 61.523 0.479 25541
1469 1 7 . 1 1 10 10 THR CB C 10 69.796 69.796 70.344 -0.548 25541
1470 1 7 . 1 1 10 10 THR H H 10 8.114 8.114 8.067 0.047 25541
1471 1 7 . 1 1 11 11 LYS N N 11 124.677 124.677 122.330 2.347 25541
1472 1 7 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.417 -0.253 25541
1473 1 7 . 1 1 11 11 LYS C C 11 172.964 172.964 174.907 -1.943 25541
1474 1 7 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.745 -0.623 25541
1475 1 7 . 1 1 11 11 LYS CB C 11 32.819 32.819 33.112 -0.293 25541
1476 1 7 . 1 1 11 11 LYS H H 11 8.436 8.436 8.357 0.079 25541
1477 1 7 . 1 1 12 12 LYS N N 12 123.337 123.337 122.661 0.676 25541
1478 1 7 . 1 1 12 12 LYS HA H 12 4.093 4.093 3.816 0.277 25541
1479 1 7 . 1 1 12 12 LYS C C 12 173.147 173.147 174.413 -1.266 25541
1480 1 7 . 1 1 12 12 LYS CA C 12 56.327 56.327 54.627 1.700 25541
1481 1 7 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.299 0.924 25541
1482 1 7 . 1 1 12 12 LYS H H 12 8.239 8.239 7.879 0.360 25541
1483 1 7 . 1 1 13 13 TYR N N 13 119.233 119.233 119.089 0.144 25541
1484 1 7 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.729 -0.328 25541
1485 1 7 . 1 1 13 13 TYR C C 13 172.016 172.016 175.266 -3.250 25541
1486 1 7 . 1 1 13 13 TYR CA C 13 57.325 57.325 57.123 0.202 25541
1487 1 7 . 1 1 13 13 TYR CB C 13 39.864 39.864 40.401 -0.537 25541
1488 1 7 . 1 1 13 13 TYR H H 13 8.274 8.274 8.082 0.192 25541
1489 1 7 . 1 1 14 14 ASP N N 14 120.486 120.486 124.032 -3.546 25541
1490 1 7 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.911 -0.234 25541
1491 1 7 . 1 1 14 14 ASP C C 14 173.276 173.276 176.394 -3.118 25541
1492 1 7 . 1 1 14 14 ASP CA C 14 52.719 52.719 54.111 -1.391 25541
1493 1 7 . 1 1 14 14 ASP CB C 14 40.205 40.205 41.430 -1.225 25541
1494 1 7 . 1 1 14 14 ASP H H 14 8.603 8.603 8.794 -0.191 25541
1495 1 7 . 1 1 15 15 LEU N N 15 126.405 126.405 126.015 0.390 25541
1496 1 7 . 1 1 15 15 LEU HA H 15 3.765 3.765 4.971 -1.206 25541
1497 1 7 . 1 1 15 15 LEU C C 15 175.592 175.592 177.272 -1.680 25541
1498 1 7 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.246 -0.991 25541
1499 1 7 . 1 1 15 15 LEU CB C 15 39.967 39.967 40.537 -0.570 25541
1500 1 7 . 1 1 15 15 LEU H H 15 8.901 8.901 8.643 0.258 25541
1501 1 7 . 1 1 16 16 SER N N 16 116.540 116.540 115.471 1.069 25541
1502 1 7 . 1 1 16 16 SER HA H 16 4.100 4.100 4.264 -0.164 25541
1503 1 7 . 1 1 16 16 SER C C 16 173.247 173.247 174.918 -1.671 25541
1504 1 7 . 1 1 16 16 SER CA C 16 61.720 61.720 60.391 1.329 25541
1505 1 7 . 1 1 16 16 SER CB C 16 62.797 62.797 63.364 -0.567 25541
1506 1 7 . 1 1 16 16 SER H H 16 8.112 8.112 8.006 0.106 25541
1507 1 7 . 1 1 17 17 LYS N N 17 118.008 118.008 118.080 -0.072 25541
1508 1 7 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.599 -0.098 25541
1509 1 7 . 1 1 17 17 LYS C C 17 175.079 175.079 175.259 -0.180 25541
1510 1 7 . 1 1 17 17 LYS CA C 17 55.267 55.267 56.267 -1.000 25541
1511 1 7 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.141 -2.164 25541
1512 1 7 . 1 1 17 17 LYS H H 17 8.521 8.521 7.811 0.710 25541
1513 1 7 . 1 1 18 18 TRP N N 18 122.041 122.041 122.863 -0.822 25541
1514 1 7 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.838 -0.260 25541
1515 1 7 . 1 1 18 18 TRP C C 18 174.862 174.862 175.566 -0.704 25541
1516 1 7 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.053 1.317 25541
1517 1 7 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.191 -3.647 25541
1518 1 7 . 1 1 18 18 TRP H H 18 7.853 7.853 8.566 -0.713 25541
1519 1 7 . 1 1 19 19 LYS N N 19 123.185 123.185 121.405 1.780 25541
1520 1 7 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.704 -0.169 25541
1521 1 7 . 1 1 19 19 LYS C C 19 175.094 175.094 177.156 -2.062 25541
1522 1 7 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.780 0.647 25541
1523 1 7 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.630 -0.510 25541
1524 1 7 . 1 1 19 19 LYS H H 19 9.544 9.544 8.484 1.060 25541
1525 1 7 . 1 1 20 20 TYR N N 20 124.291 124.291 126.160 -1.869 25541
1526 1 7 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.112 -0.087 25541
1527 1 7 . 1 1 20 20 TYR C C 20 174.531 174.531 177.077 -2.546 25541
1528 1 7 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.669 0.480 25541
1529 1 7 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.527 -0.374 25541
1530 1 7 . 1 1 20 20 TYR H H 20 9.266 9.266 9.265 0.001 25541
1531 1 7 . 1 1 21 21 ALA N N 21 117.781 117.781 121.284 -3.503 25541
1532 1 7 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.303 -0.430 25541
1533 1 7 . 1 1 21 21 ALA C C 21 176.314 176.314 179.582 -3.268 25541
1534 1 7 . 1 1 21 21 ALA CA C 21 55.335 55.335 54.996 0.339 25541
1535 1 7 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.837 0.866 25541
1536 1 7 . 1 1 21 21 ALA H H 21 8.986 8.986 8.539 0.447 25541
1537 1 7 . 1 1 22 22 GLU N N 22 115.218 115.218 119.402 -4.184 25541
1538 1 7 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.136 -0.017 25541
1539 1 7 . 1 1 22 22 GLU C C 22 177.380 177.380 179.382 -2.002 25541
1540 1 7 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.546 -1.067 25541
1541 1 7 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.409 0.462 25541
1542 1 7 . 1 1 22 22 GLU H H 22 6.854 6.854 8.430 -1.576 25541
1543 1 7 . 1 1 23 23 LEU N N 23 122.132 122.132 119.834 2.298 25541
1544 1 7 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.022 0.134 25541
1545 1 7 . 1 1 23 23 LEU C C 23 174.830 174.830 179.616 -4.786 25541
1546 1 7 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.243 0.279 25541
1547 1 7 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.674 1.445 25541
1548 1 7 . 1 1 23 23 LEU H H 23 7.909 7.909 9.026 -1.117 25541
1549 1 7 . 1 1 24 24 ARG N N 24 118.051 118.051 117.969 0.082 25541
1550 1 7 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.711 -0.074 25541
1551 1 7 . 1 1 24 24 ARG C C 24 175.240 175.240 178.235 -2.995 25541
1552 1 7 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.565 0.411 25541
1553 1 7 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.595 0.267 25541
1554 1 7 . 1 1 24 24 ARG H H 24 8.250 8.250 7.485 0.765 25541
1555 1 7 . 1 1 25 25 ASP N N 25 118.179 118.179 118.963 -0.784 25541
1556 1 7 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.480 -0.095 25541
1557 1 7 . 1 1 25 25 ASP C C 25 176.554 176.554 178.526 -1.972 25541
1558 1 7 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.198 0.158 25541
1559 1 7 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.737 -0.695 25541
1560 1 7 . 1 1 25 25 ASP H H 25 8.507 8.507 8.268 0.239 25541
1561 1 7 . 1 1 26 26 THR N N 26 118.299 118.299 116.603 1.696 25541
1562 1 7 . 1 1 26 26 THR HA H 26 3.891 3.891 3.995 -0.104 25541
1563 1 7 . 1 1 26 26 THR C C 26 173.365 173.365 176.753 -3.388 25541
1564 1 7 . 1 1 26 26 THR CA C 26 67.787 67.787 66.779 1.008 25541
1565 1 7 . 1 1 26 26 THR CB C 26 68.120 68.120 68.628 -0.508 25541
1566 1 7 . 1 1 26 26 THR H H 26 7.918 7.918 8.521 -0.603 25541
1567 1 7 . 1 1 27 27 ILE N N 27 122.576 122.576 119.742 2.834 25541
1568 1 7 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.806 -0.181 25541
1569 1 7 . 1 1 27 27 ILE C C 27 174.485 174.485 176.063 -1.578 25541
1570 1 7 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.255 0.456 25541
1571 1 7 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.751 -0.224 25541
1572 1 7 . 1 1 27 27 ILE H H 27 8.159 8.159 7.301 0.858 25541
1573 1 7 . 1 1 28 28 ASN N N 28 115.118 115.118 116.128 -1.010 25541
1574 1 7 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.700 -0.085 25541
1575 1 7 . 1 1 28 28 ASN C C 28 173.902 173.902 174.968 -1.066 25541
1576 1 7 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.865 0.595 25541
1577 1 7 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.303 -0.073 25541
1578 1 7 . 1 1 28 28 ASN H H 28 7.713 7.713 7.746 -0.033 25541
1579 1 7 . 1 1 29 29 THR N N 29 107.730 107.730 108.987 -1.257 25541
1580 1 7 . 1 1 29 29 THR HA H 29 4.600 4.600 4.430 0.170 25541
1581 1 7 . 1 1 29 29 THR C C 29 172.290 172.290 174.878 -2.588 25541
1582 1 7 . 1 1 29 29 THR CA C 29 62.595 62.595 62.838 -0.243 25541
1583 1 7 . 1 1 29 29 THR CB C 29 72.291 72.291 70.096 2.195 25541
1584 1 7 . 1 1 29 29 THR H H 29 7.587 7.587 7.477 0.110 25541
1585 1 7 . 1 1 30 30 SER N N 30 117.784 117.784 118.932 -1.148 25541
1586 1 7 . 1 1 30 30 SER HA H 30 4.296 4.296 4.559 -0.263 25541
1587 1 7 . 1 1 30 30 SER C C 30 172.473 172.473 173.101 -0.628 25541
1588 1 7 . 1 1 30 30 SER CA C 30 59.618 59.618 58.512 1.106 25541
1589 1 7 . 1 1 30 30 SER CB C 30 64.402 64.402 64.303 0.099 25541
1590 1 7 . 1 1 30 30 SER H H 30 8.698 8.698 8.229 0.469 25541
1591 1 7 . 1 1 31 31 CYS N N 31 121.196 121.196 119.289 1.907 25541
1592 1 7 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.615 0.172 25541
1593 1 7 . 1 1 31 31 CYS C C 31 170.861 170.861 172.464 -1.603 25541
1594 1 7 . 1 1 31 31 CYS CA C 31 57.372 57.372 59.172 -1.800 25541
1595 1 7 . 1 1 31 31 CYS CB C 31 28.364 28.364 29.079 -0.716 25541
1596 1 7 . 1 1 31 31 CYS H H 31 8.713 8.713 8.373 0.340 25541
1597 1 7 . 1 1 32 32 ASP N N 32 124.610 124.610 125.851 -1.241 25541
1598 1 7 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.761 -0.148 25541
1599 1 7 . 1 1 32 32 ASP C C 32 172.541 172.541 175.603 -3.062 25541
1600 1 7 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.045 -0.860 25541
1601 1 7 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.107 -1.970 25541
1602 1 7 . 1 1 32 32 ASP H H 32 8.542 8.542 8.205 0.337 25541
1603 1 7 . 1 1 33 33 ILE N N 33 125.134 125.134 121.950 3.184 25541
1604 1 7 . 1 1 33 33 ILE HA H 33 3.686 3.686 3.992 -0.306 25541
1605 1 7 . 1 1 33 33 ILE C C 33 175.743 175.743 176.100 -0.357 25541
1606 1 7 . 1 1 33 33 ILE CA C 33 64.710 64.710 63.261 1.449 25541
1607 1 7 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.864 -0.049 25541
1608 1 7 . 1 1 33 33 ILE H H 33 8.459 8.459 8.580 -0.121 25541
1609 1 7 . 1 1 34 34 GLU N N 34 121.097 121.097 119.826 1.271 25541
1610 1 7 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.293 -0.162 25541
1611 1 7 . 1 1 34 34 GLU C C 34 176.406 176.406 178.015 -1.609 25541
1612 1 7 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.032 1.301 25541
1613 1 7 . 1 1 34 34 GLU CB C 34 29.675 29.675 30.042 -0.367 25541
1614 1 7 . 1 1 34 34 GLU H H 34 8.177 8.177 7.811 0.366 25541
1615 1 7 . 1 1 35 35 LEU N N 35 124.890 124.890 121.184 3.706 25541
1616 1 7 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.963 -0.352 25541
1617 1 7 . 1 1 35 35 LEU C C 35 176.399 176.399 178.992 -2.593 25541
1618 1 7 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.957 -0.889 25541
1619 1 7 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.845 -0.935 25541
1620 1 7 . 1 1 35 35 LEU H H 35 7.831 7.831 7.905 -0.074 25541
1621 1 7 . 1 1 36 36 LEU N N 36 120.493 120.493 118.414 2.079 25541
1622 1 7 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.747 -0.088 25541
1623 1 7 . 1 1 36 36 LEU C C 36 176.280 176.280 178.953 -2.673 25541
1624 1 7 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.134 0.481 25541
1625 1 7 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.967 1.502 25541
1626 1 7 . 1 1 36 36 LEU H H 36 8.843 8.843 7.561 1.282 25541
1627 1 7 . 1 1 37 37 ALA N N 37 119.956 119.956 120.532 -0.576 25541
1628 1 7 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.875 0.122 25541
1629 1 7 . 1 1 37 37 ALA C C 37 177.606 177.606 179.128 -1.522 25541
1630 1 7 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.598 0.571 25541
1631 1 7 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.966 -0.346 25541
1632 1 7 . 1 1 37 37 ALA H H 37 7.610 7.610 8.244 -0.634 25541
1633 1 7 . 1 1 38 38 ALA N N 38 121.594 121.594 120.512 1.082 25541
1634 1 7 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.104 -0.001 25541
1635 1 7 . 1 1 38 38 ALA C C 38 178.452 178.452 178.982 -0.530 25541
1636 1 7 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.519 0.336 25541
1637 1 7 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.282 -0.222 25541
1638 1 7 . 1 1 38 38 ALA H H 38 7.665 7.665 8.453 -0.788 25541
1639 1 7 . 1 1 39 39 CYS N N 39 119.263 119.263 118.116 1.147 25541
1640 1 7 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.945 -0.214 25541
1641 1 7 . 1 1 39 39 CYS C C 39 173.860 173.860 176.718 -2.858 25541
1642 1 7 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.367 1.456 25541
1643 1 7 . 1 1 39 39 CYS CB C 39 27.225 27.225 26.695 0.530 25541
1644 1 7 . 1 1 39 39 CYS H H 39 8.766 8.766 8.486 0.280 25541
1645 1 7 . 1 1 40 40 ARG N N 40 119.658 119.658 119.245 0.413 25541
1646 1 7 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.892 0.006 25541
1647 1 7 . 1 1 40 40 ARG C C 40 176.108 176.108 178.689 -2.581 25541
1648 1 7 . 1 1 40 40 ARG CA C 40 60.482 60.482 58.729 1.753 25541
1649 1 7 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.204 0.659 25541
1650 1 7 . 1 1 40 40 ARG H H 40 8.327 8.327 8.386 -0.059 25541
1651 1 7 . 1 1 41 41 GLU N N 41 119.358 119.358 118.035 1.323 25541
1652 1 7 . 1 1 41 41 GLU HA H 41 4.099 4.099 3.857 0.242 25541
1653 1 7 . 1 1 41 41 GLU C C 41 171.786 171.786 178.805 -7.019 25541
1654 1 7 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.356 -0.143 25541
1655 1 7 . 1 1 41 41 GLU CB C 41 29.277 29.277 28.996 0.281 25541
1656 1 7 . 1 1 41 41 GLU H H 41 7.929 7.929 7.605 0.324 25541
1657 1 7 . 1 1 42 42 GLU N N 42 121.281 121.281 119.316 1.965 25541
1658 1 7 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.153 0.070 25541
1659 1 7 . 1 1 42 42 GLU C C 42 173.408 173.408 179.003 -5.595 25541
1660 1 7 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.386 -0.067 25541
1661 1 7 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.570 -1.355 25541
1662 1 7 . 1 1 42 42 GLU H H 42 7.945 7.945 7.606 0.339 25541
1663 1 7 . 1 1 43 43 PHE N N 43 119.271 119.271 120.599 -1.328 25541
1664 1 7 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.062 0.015 25541
1665 1 7 . 1 1 43 43 PHE C C 43 175.299 175.299 177.574 -2.275 25541
1666 1 7 . 1 1 43 43 PHE CA C 43 61.549 61.549 61.566 -0.016 25541
1667 1 7 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.063 0.071 25541
1668 1 7 . 1 1 43 43 PHE H H 43 8.624 8.624 8.689 -0.065 25541
1669 1 7 . 1 1 44 44 HIS N N 44 116.374 116.374 116.041 0.333 25541
1670 1 7 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.336 -0.070 25541
1671 1 7 . 1 1 44 44 HIS C C 44 174.771 174.771 177.794 -3.023 25541
1672 1 7 . 1 1 44 44 HIS CA C 44 59.343 59.343 58.357 0.986 25541
1673 1 7 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.794 -0.306 25541
1674 1 7 . 1 1 44 44 HIS H H 44 7.976 7.976 8.246 -0.270 25541
1675 1 7 . 1 1 45 45 ARG N N 45 120.170 120.170 119.557 0.613 25541
1676 1 7 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.066 -0.120 25541
1677 1 7 . 1 1 45 45 ARG C C 45 176.310 176.310 178.566 -2.256 25541
1678 1 7 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.375 -0.169 25541
1679 1 7 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.842 0.546 25541
1680 1 7 . 1 1 45 45 ARG H H 45 8.166 8.166 8.096 0.070 25541
1681 1 7 . 1 1 46 46 ARG N N 46 116.229 116.229 117.531 -1.302 25541
1682 1 7 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.137 -0.072 25541
1683 1 7 . 1 1 46 46 ARG C C 46 176.046 176.046 177.909 -1.863 25541
1684 1 7 . 1 1 46 46 ARG CA C 46 57.691 57.691 57.300 0.391 25541
1685 1 7 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.385 0.863 25541
1686 1 7 . 1 1 46 46 ARG H H 46 7.764 7.764 7.451 0.313 25541
1687 1 7 . 1 1 47 47 LEU N N 47 119.010 119.010 119.136 -0.126 25541
1688 1 7 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.107 0.028 25541
1689 1 7 . 1 1 47 47 LEU CA C 47 55.957 55.957 56.620 -0.663 25541
1690 1 7 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.679 0.345 25541
1691 1 7 . 1 1 47 47 LEU H H 47 7.557 7.557 7.469 0.088 25541
1692 1 7 . 1 1 48 48 LYS N N 48 119.277 119.277 118.418 0.859 25541
1693 1 7 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.058 0.017 25541
1694 1 7 . 1 1 48 48 LYS C C 48 176.354 176.354 176.964 -0.610 25541
1695 1 7 . 1 1 48 48 LYS CA C 48 56.655 56.655 58.837 -2.182 25541
1696 1 7 . 1 1 48 48 LYS CB C 48 32.410 32.410 33.057 -0.647 25541
1697 1 7 . 1 1 48 48 LYS H H 48 7.662 7.662 7.634 0.028 25541
1698 1 7 . 1 1 49 49 VAL N N 49 119.095 119.095 116.357 2.738 25541
1699 1 7 . 1 1 49 49 VAL HA H 49 3.972 3.972 4.181 -0.209 25541
1700 1 7 . 1 1 49 49 VAL C C 49 174.195 174.195 174.308 -0.113 25541
1701 1 7 . 1 1 49 49 VAL CA C 49 62.214 62.214 60.158 2.056 25541
1702 1 7 . 1 1 49 49 VAL CB C 49 32.747 32.747 34.566 -1.819 25541
1703 1 7 . 1 1 49 49 VAL H H 49 7.688 7.688 7.486 0.202 25541
1704 1 7 . 1 1 50 50 TYR N N 50 123.606 123.606 121.077 2.529 25541
1705 1 7 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.899 -0.417 25541
1706 1 7 . 1 1 50 50 TYR CA C 50 57.855 57.855 55.668 2.187 25541
1707 1 7 . 1 1 50 50 TYR CB C 50 38.721 38.721 38.702 0.019 25541
1708 1 7 . 1 1 50 50 TYR H H 50 8.164 8.164 7.772 0.392 25541
1709 1 8 . 1 1 10 10 THR N N 10 114.351 114.351 115.593 -1.242 25541
1710 1 8 . 1 1 10 10 THR HA H 10 4.241 4.241 4.270 -0.029 25541
1711 1 8 . 1 1 10 10 THR C C 10 171.741 171.741 174.488 -2.747 25541
1712 1 8 . 1 1 10 10 THR CA C 10 62.002 62.002 61.616 0.386 25541
1713 1 8 . 1 1 10 10 THR CB C 10 69.796 69.796 69.042 0.754 25541
1714 1 8 . 1 1 10 10 THR H H 10 8.114 8.114 8.115 -0.001 25541
1715 1 8 . 1 1 11 11 LYS N N 11 124.677 124.677 125.735 -1.058 25541
1716 1 8 . 1 1 11 11 LYS HA H 11 4.164 4.164 3.846 0.318 25541
1717 1 8 . 1 1 11 11 LYS C C 11 172.964 172.964 175.241 -2.277 25541
1718 1 8 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.843 -0.721 25541
1719 1 8 . 1 1 11 11 LYS CB C 11 32.819 32.819 31.695 1.124 25541
1720 1 8 . 1 1 11 11 LYS H H 11 8.436 8.436 8.430 0.006 25541
1721 1 8 . 1 1 12 12 LYS N N 12 123.337 123.337 122.952 0.385 25541
1722 1 8 . 1 1 12 12 LYS HA H 12 4.093 4.093 3.764 0.329 25541
1723 1 8 . 1 1 12 12 LYS C C 12 173.147 173.147 175.750 -2.603 25541
1724 1 8 . 1 1 12 12 LYS CA C 12 56.327 56.327 56.494 -0.167 25541
1725 1 8 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.769 0.454 25541
1726 1 8 . 1 1 12 12 LYS H H 12 8.239 8.239 8.014 0.225 25541
1727 1 8 . 1 1 13 13 TYR N N 13 119.233 119.233 116.984 2.249 25541
1728 1 8 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.705 -0.304 25541
1729 1 8 . 1 1 13 13 TYR C C 13 172.016 172.016 174.543 -2.527 25541
1730 1 8 . 1 1 13 13 TYR CA C 13 57.325 57.325 57.164 0.161 25541
1731 1 8 . 1 1 13 13 TYR CB C 13 39.864 39.864 40.590 -0.726 25541
1732 1 8 . 1 1 13 13 TYR H H 13 8.274 8.274 7.904 0.370 25541
1733 1 8 . 1 1 14 14 ASP N N 14 120.486 120.486 122.518 -2.032 25541
1734 1 8 . 1 1 14 14 ASP HA H 14 4.677 4.677 5.043 -0.366 25541
1735 1 8 . 1 1 14 14 ASP C C 14 173.276 173.276 175.906 -2.630 25541
1736 1 8 . 1 1 14 14 ASP CA C 14 52.719 52.719 53.829 -1.110 25541
1737 1 8 . 1 1 14 14 ASP CB C 14 40.205 40.205 41.256 -1.051 25541
1738 1 8 . 1 1 14 14 ASP H H 14 8.603 8.603 8.731 -0.128 25541
1739 1 8 . 1 1 15 15 LEU N N 15 126.405 126.405 126.459 -0.054 25541
1740 1 8 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.116 -1.351 25541
1741 1 8 . 1 1 15 15 LEU C C 15 175.592 175.592 176.868 -1.276 25541
1742 1 8 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.409 -1.154 25541
1743 1 8 . 1 1 15 15 LEU CB C 15 39.967 39.967 41.572 -1.605 25541
1744 1 8 . 1 1 15 15 LEU H H 15 8.901 8.901 8.581 0.320 25541
1745 1 8 . 1 1 16 16 SER N N 16 116.540 116.540 116.009 0.531 25541
1746 1 8 . 1 1 16 16 SER HA H 16 4.100 4.100 4.283 -0.183 25541
1747 1 8 . 1 1 16 16 SER C C 16 173.247 173.247 174.751 -1.504 25541
1748 1 8 . 1 1 16 16 SER CA C 16 61.720 61.720 60.594 1.125 25541
1749 1 8 . 1 1 16 16 SER CB C 16 62.797 62.797 63.283 -0.486 25541
1750 1 8 . 1 1 16 16 SER H H 16 8.112 8.112 8.273 -0.161 25541
1751 1 8 . 1 1 17 17 LYS N N 17 118.008 118.008 118.146 -0.138 25541
1752 1 8 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.626 -0.125 25541
1753 1 8 . 1 1 17 17 LYS C C 17 175.079 175.079 174.873 0.206 25541
1754 1 8 . 1 1 17 17 LYS CA C 17 55.267 55.267 55.834 -0.567 25541
1755 1 8 . 1 1 17 17 LYS CB C 17 31.977 31.977 33.698 -1.721 25541
1756 1 8 . 1 1 17 17 LYS H H 17 8.521 8.521 7.993 0.528 25541
1757 1 8 . 1 1 18 18 TRP N N 18 122.041 122.041 122.715 -0.674 25541
1758 1 8 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.868 -0.290 25541
1759 1 8 . 1 1 18 18 TRP C C 18 174.862 174.862 175.010 -0.148 25541
1760 1 8 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.274 1.097 25541
1761 1 8 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.277 -3.733 25541
1762 1 8 . 1 1 18 18 TRP H H 18 7.853 7.853 8.481 -0.628 25541
1763 1 8 . 1 1 19 19 LYS N N 19 123.185 123.185 120.613 2.572 25541
1764 1 8 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.777 -0.242 25541
1765 1 8 . 1 1 19 19 LYS C C 19 175.094 175.094 177.012 -1.918 25541
1766 1 8 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.933 0.494 25541
1767 1 8 . 1 1 19 19 LYS CB C 19 33.120 33.120 34.325 -1.205 25541
1768 1 8 . 1 1 19 19 LYS H H 19 9.544 9.544 8.521 1.023 25541
1769 1 8 . 1 1 20 20 TYR N N 20 124.291 124.291 125.574 -1.283 25541
1770 1 8 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.082 -0.057 25541
1771 1 8 . 1 1 20 20 TYR C C 20 174.531 174.531 177.165 -2.634 25541
1772 1 8 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.665 0.484 25541
1773 1 8 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.366 -0.213 25541
1774 1 8 . 1 1 20 20 TYR H H 20 9.266 9.266 9.228 0.038 25541
1775 1 8 . 1 1 21 21 ALA N N 21 117.781 117.781 121.272 -3.491 25541
1776 1 8 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.161 -0.288 25541
1777 1 8 . 1 1 21 21 ALA C C 21 176.314 176.314 179.639 -3.325 25541
1778 1 8 . 1 1 21 21 ALA CA C 21 55.335 55.335 55.256 0.079 25541
1779 1 8 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.708 0.995 25541
1780 1 8 . 1 1 21 21 ALA H H 21 8.986 8.986 8.574 0.412 25541
1781 1 8 . 1 1 22 22 GLU N N 22 115.218 115.218 119.039 -3.821 25541
1782 1 8 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.127 -0.008 25541
1783 1 8 . 1 1 22 22 GLU C C 22 177.380 177.380 179.436 -2.056 25541
1784 1 8 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.497 -1.018 25541
1785 1 8 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.356 0.514 25541
1786 1 8 . 1 1 22 22 GLU H H 22 6.854 6.854 8.439 -1.585 25541
1787 1 8 . 1 1 23 23 LEU N N 23 122.132 122.132 120.176 1.956 25541
1788 1 8 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.069 0.087 25541
1789 1 8 . 1 1 23 23 LEU C C 23 174.830 174.830 179.548 -4.718 25541
1790 1 8 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.439 0.083 25541
1791 1 8 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.720 1.399 25541
1792 1 8 . 1 1 23 23 LEU H H 23 7.909 7.909 9.024 -1.115 25541
1793 1 8 . 1 1 24 24 ARG N N 24 118.051 118.051 118.291 -0.240 25541
1794 1 8 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.882 -0.245 25541
1795 1 8 . 1 1 24 24 ARG C C 24 175.240 175.240 178.542 -3.302 25541
1796 1 8 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.720 0.256 25541
1797 1 8 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.562 0.300 25541
1798 1 8 . 1 1 24 24 ARG H H 24 8.250 8.250 7.934 0.316 25541
1799 1 8 . 1 1 25 25 ASP N N 25 118.179 118.179 119.287 -1.108 25541
1800 1 8 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.503 -0.118 25541
1801 1 8 . 1 1 25 25 ASP C C 25 176.554 176.554 178.278 -1.724 25541
1802 1 8 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.114 0.242 25541
1803 1 8 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.545 -0.503 25541
1804 1 8 . 1 1 25 25 ASP H H 25 8.507 8.507 8.351 0.156 25541
1805 1 8 . 1 1 26 26 THR N N 26 118.299 118.299 116.330 1.969 25541
1806 1 8 . 1 1 26 26 THR HA H 26 3.891 3.891 4.055 -0.164 25541
1807 1 8 . 1 1 26 26 THR C C 26 173.365 173.365 176.444 -3.079 25541
1808 1 8 . 1 1 26 26 THR CA C 26 67.787 67.787 66.398 1.389 25541
1809 1 8 . 1 1 26 26 THR CB C 26 68.120 68.120 68.993 -0.873 25541
1810 1 8 . 1 1 26 26 THR H H 26 7.918 7.918 8.406 -0.488 25541
1811 1 8 . 1 1 27 27 ILE N N 27 122.576 122.576 118.895 3.681 25541
1812 1 8 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.821 -0.196 25541
1813 1 8 . 1 1 27 27 ILE C C 27 174.485 174.485 176.371 -1.886 25541
1814 1 8 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.299 0.412 25541
1815 1 8 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.592 -0.064 25541
1816 1 8 . 1 1 27 27 ILE H H 27 8.159 8.159 7.414 0.745 25541
1817 1 8 . 1 1 28 28 ASN N N 28 115.118 115.118 116.271 -1.153 25541
1818 1 8 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.751 -0.136 25541
1819 1 8 . 1 1 28 28 ASN C C 28 173.902 173.902 174.910 -1.008 25541
1820 1 8 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.669 0.791 25541
1821 1 8 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.340 -0.110 25541
1822 1 8 . 1 1 28 28 ASN H H 28 7.713 7.713 7.692 0.021 25541
1823 1 8 . 1 1 29 29 THR N N 29 107.730 107.730 109.078 -1.348 25541
1824 1 8 . 1 1 29 29 THR HA H 29 4.600 4.600 4.444 0.156 25541
1825 1 8 . 1 1 29 29 THR C C 29 172.290 172.290 174.921 -2.631 25541
1826 1 8 . 1 1 29 29 THR CA C 29 62.595 62.595 62.914 -0.319 25541
1827 1 8 . 1 1 29 29 THR CB C 29 72.291 72.291 70.117 2.174 25541
1828 1 8 . 1 1 29 29 THR H H 29 7.587 7.587 7.576 0.011 25541
1829 1 8 . 1 1 30 30 SER N N 30 117.784 117.784 119.221 -1.437 25541
1830 1 8 . 1 1 30 30 SER HA H 30 4.296 4.296 4.579 -0.283 25541
1831 1 8 . 1 1 30 30 SER C C 30 172.473 172.473 173.259 -0.786 25541
1832 1 8 . 1 1 30 30 SER CA C 30 59.618 59.618 58.032 1.586 25541
1833 1 8 . 1 1 30 30 SER CB C 30 64.402 64.402 64.437 -0.035 25541
1834 1 8 . 1 1 30 30 SER H H 30 8.698 8.698 8.490 0.208 25541
1835 1 8 . 1 1 31 31 CYS N N 31 121.196 121.196 119.496 1.700 25541
1836 1 8 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.651 0.136 25541
1837 1 8 . 1 1 31 31 CYS C C 31 170.861 170.861 172.362 -1.501 25541
1838 1 8 . 1 1 31 31 CYS CA C 31 57.372 57.372 58.785 -1.413 25541
1839 1 8 . 1 1 31 31 CYS CB C 31 28.364 28.364 28.698 -0.334 25541
1840 1 8 . 1 1 31 31 CYS H H 31 8.713 8.713 8.394 0.319 25541
1841 1 8 . 1 1 32 32 ASP N N 32 124.610 124.610 126.478 -1.868 25541
1842 1 8 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.672 -0.059 25541
1843 1 8 . 1 1 32 32 ASP C C 32 172.541 172.541 175.760 -3.219 25541
1844 1 8 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.070 -0.885 25541
1845 1 8 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.140 -2.003 25541
1846 1 8 . 1 1 32 32 ASP H H 32 8.542 8.542 8.176 0.366 25541
1847 1 8 . 1 1 33 33 ILE N N 33 125.134 125.134 120.365 4.769 25541
1848 1 8 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.057 -0.371 25541
1849 1 8 . 1 1 33 33 ILE C C 33 175.743 175.743 176.027 -0.284 25541
1850 1 8 . 1 1 33 33 ILE CA C 33 64.710 64.710 61.687 3.023 25541
1851 1 8 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.608 0.207 25541
1852 1 8 . 1 1 33 33 ILE H H 33 8.459 8.459 8.623 -0.164 25541
1853 1 8 . 1 1 34 34 GLU N N 34 121.097 121.097 118.872 2.225 25541
1854 1 8 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.363 -0.232 25541
1855 1 8 . 1 1 34 34 GLU C C 34 176.406 176.406 178.507 -2.101 25541
1856 1 8 . 1 1 34 34 GLU CA C 34 59.333 59.333 57.473 1.860 25541
1857 1 8 . 1 1 34 34 GLU CB C 34 29.675 29.675 30.393 -0.719 25541
1858 1 8 . 1 1 34 34 GLU H H 34 8.177 8.177 7.709 0.468 25541
1859 1 8 . 1 1 35 35 LEU N N 35 124.890 124.890 120.732 4.158 25541
1860 1 8 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.783 -0.172 25541
1861 1 8 . 1 1 35 35 LEU C C 35 176.399 176.399 178.805 -2.406 25541
1862 1 8 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.778 -0.710 25541
1863 1 8 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.713 -0.803 25541
1864 1 8 . 1 1 35 35 LEU H H 35 7.831 7.831 7.690 0.141 25541
1865 1 8 . 1 1 36 36 LEU N N 36 120.493 120.493 118.711 1.782 25541
1866 1 8 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.724 -0.065 25541
1867 1 8 . 1 1 36 36 LEU C C 36 176.280 176.280 178.930 -2.650 25541
1868 1 8 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.137 0.478 25541
1869 1 8 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.969 1.500 25541
1870 1 8 . 1 1 36 36 LEU H H 36 8.843 8.843 7.485 1.358 25541
1871 1 8 . 1 1 37 37 ALA N N 37 119.956 119.956 120.576 -0.620 25541
1872 1 8 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.994 0.003 25541
1873 1 8 . 1 1 37 37 ALA C C 37 177.606 177.606 179.524 -1.918 25541
1874 1 8 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.774 0.395 25541
1875 1 8 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.864 -0.244 25541
1876 1 8 . 1 1 37 37 ALA H H 37 7.610 7.610 8.237 -0.627 25541
1877 1 8 . 1 1 38 38 ALA N N 38 121.594 121.594 121.762 -0.168 25541
1878 1 8 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.552 -0.449 25541
1879 1 8 . 1 1 38 38 ALA C C 38 178.452 178.452 178.996 -0.544 25541
1880 1 8 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.217 0.638 25541
1881 1 8 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.474 -0.415 25541
1882 1 8 . 1 1 38 38 ALA H H 38 7.665 7.665 8.148 -0.483 25541
1883 1 8 . 1 1 39 39 CYS N N 39 119.263 119.263 117.843 1.420 25541
1884 1 8 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.830 -0.099 25541
1885 1 8 . 1 1 39 39 CYS C C 39 173.860 173.860 176.755 -2.895 25541
1886 1 8 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.250 1.573 25541
1887 1 8 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.498 -0.273 25541
1888 1 8 . 1 1 39 39 CYS H H 39 8.766 8.766 8.567 0.199 25541
1889 1 8 . 1 1 40 40 ARG N N 40 119.658 119.658 119.459 0.199 25541
1890 1 8 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.858 0.040 25541
1891 1 8 . 1 1 40 40 ARG C C 40 176.108 176.108 178.497 -2.389 25541
1892 1 8 . 1 1 40 40 ARG CA C 40 60.482 60.482 60.094 0.388 25541
1893 1 8 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.878 -0.014 25541
1894 1 8 . 1 1 40 40 ARG H H 40 8.327 8.327 8.561 -0.234 25541
1895 1 8 . 1 1 41 41 GLU N N 41 119.358 119.358 118.522 0.836 25541
1896 1 8 . 1 1 41 41 GLU HA H 41 4.099 4.099 4.025 0.074 25541
1897 1 8 . 1 1 41 41 GLU C C 41 171.786 171.786 178.797 -7.011 25541
1898 1 8 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.780 -0.567 25541
1899 1 8 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.340 -0.063 25541
1900 1 8 . 1 1 41 41 GLU H H 41 7.929 7.929 7.820 0.109 25541
1901 1 8 . 1 1 42 42 GLU N N 42 121.281 121.281 119.077 2.204 25541
1902 1 8 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.113 0.110 25541
1903 1 8 . 1 1 42 42 GLU C C 42 173.408 173.408 178.866 -5.458 25541
1904 1 8 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.368 -0.049 25541
1905 1 8 . 1 1 42 42 GLU CB C 42 28.215 28.215 28.967 -0.752 25541
1906 1 8 . 1 1 42 42 GLU H H 42 7.945 7.945 7.613 0.332 25541
1907 1 8 . 1 1 43 43 PHE N N 43 119.271 119.271 121.947 -2.676 25541
1908 1 8 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.037 0.040 25541
1909 1 8 . 1 1 43 43 PHE C C 43 175.299 175.299 177.257 -1.958 25541
1910 1 8 . 1 1 43 43 PHE CA C 43 61.549 61.549 62.160 -0.612 25541
1911 1 8 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.053 0.081 25541
1912 1 8 . 1 1 43 43 PHE H H 43 8.624 8.624 8.880 -0.256 25541
1913 1 8 . 1 1 44 44 HIS N N 44 116.374 116.374 117.491 -1.117 25541
1914 1 8 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.205 0.061 25541
1915 1 8 . 1 1 44 44 HIS C C 44 174.771 174.771 177.759 -2.988 25541
1916 1 8 . 1 1 44 44 HIS CA C 44 59.343 59.343 59.114 0.229 25541
1917 1 8 . 1 1 44 44 HIS CB C 44 29.488 29.488 30.118 -0.630 25541
1918 1 8 . 1 1 44 44 HIS H H 44 7.976 7.976 8.235 -0.259 25541
1919 1 8 . 1 1 45 45 ARG N N 45 120.170 120.170 118.798 1.372 25541
1920 1 8 . 1 1 45 45 ARG HA H 45 3.946 3.946 3.940 0.006 25541
1921 1 8 . 1 1 45 45 ARG C C 45 176.310 176.310 178.541 -2.231 25541
1922 1 8 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.281 -0.075 25541
1923 1 8 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.983 0.405 25541
1924 1 8 . 1 1 45 45 ARG H H 45 8.166 8.166 7.912 0.254 25541
1925 1 8 . 1 1 46 46 ARG N N 46 116.229 116.229 117.966 -1.737 25541
1926 1 8 . 1 1 46 46 ARG HA H 46 4.065 4.065 3.884 0.181 25541
1927 1 8 . 1 1 46 46 ARG C C 46 176.046 176.046 178.315 -2.269 25541
1928 1 8 . 1 1 46 46 ARG CA C 46 57.691 57.691 57.668 0.023 25541
1929 1 8 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.168 1.080 25541
1930 1 8 . 1 1 46 46 ARG H H 46 7.764 7.764 7.620 0.144 25541
1931 1 8 . 1 1 47 47 LEU N N 47 119.010 119.010 117.900 1.110 25541
1932 1 8 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.156 -0.021 25541
1933 1 8 . 1 1 47 47 LEU CA C 47 55.957 55.957 57.232 -1.275 25541
1934 1 8 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.765 0.259 25541
1935 1 8 . 1 1 47 47 LEU H H 47 7.557 7.557 7.439 0.118 25541
1936 1 8 . 1 1 48 48 LYS N N 48 119.277 119.277 119.719 -0.442 25541
1937 1 8 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.264 -0.189 25541
1938 1 8 . 1 1 48 48 LYS C C 48 176.354 176.354 177.267 -0.913 25541
1939 1 8 . 1 1 48 48 LYS CA C 48 56.655 56.655 58.044 -1.389 25541
1940 1 8 . 1 1 48 48 LYS CB C 48 32.410 32.410 33.288 -0.878 25541
1941 1 8 . 1 1 48 48 LYS H H 48 7.662 7.662 7.646 0.016 25541
1942 1 8 . 1 1 49 49 VAL N N 49 119.095 119.095 118.076 1.019 25541
1943 1 8 . 1 1 49 49 VAL HA H 49 3.972 3.972 3.853 0.119 25541
1944 1 8 . 1 1 49 49 VAL C C 49 174.195 174.195 176.124 -1.929 25541
1945 1 8 . 1 1 49 49 VAL CA C 49 62.214 62.214 62.750 -0.536 25541
1946 1 8 . 1 1 49 49 VAL CB C 49 32.747 32.747 31.702 1.045 25541
1947 1 8 . 1 1 49 49 VAL H H 49 7.688 7.688 7.544 0.144 25541
1948 1 8 . 1 1 50 50 TYR N N 50 123.606 123.606 124.804 -1.198 25541
1949 1 8 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.831 -0.349 25541
1950 1 8 . 1 1 50 50 TYR CA C 50 57.855 57.855 54.194 3.661 25541
1951 1 8 . 1 1 50 50 TYR CB C 50 38.721 38.721 36.370 2.351 25541
1952 1 8 . 1 1 50 50 TYR H H 50 8.164 8.164 8.040 0.124 25541
1953 1 9 . 1 1 10 10 THR N N 10 114.351 114.351 112.418 1.933 25541
1954 1 9 . 1 1 10 10 THR HA H 10 4.241 4.241 4.353 -0.112 25541
1955 1 9 . 1 1 10 10 THR C C 10 171.741 171.741 174.167 -2.426 25541
1956 1 9 . 1 1 10 10 THR CA C 10 62.002 62.002 61.197 0.805 25541
1957 1 9 . 1 1 10 10 THR CB C 10 69.796 69.796 70.688 -0.892 25541
1958 1 9 . 1 1 10 10 THR H H 10 8.114 8.114 8.093 0.021 25541
1959 1 9 . 1 1 11 11 LYS N N 11 124.677 124.677 121.827 2.850 25541
1960 1 9 . 1 1 11 11 LYS HA H 11 4.164 4.164 3.925 0.239 25541
1961 1 9 . 1 1 11 11 LYS C C 11 172.964 172.964 175.777 -2.813 25541
1962 1 9 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.544 -0.422 25541
1963 1 9 . 1 1 11 11 LYS CB C 11 32.819 32.819 32.165 0.654 25541
1964 1 9 . 1 1 11 11 LYS H H 11 8.436 8.436 8.506 -0.070 25541
1965 1 9 . 1 1 12 12 LYS N N 12 123.337 123.337 120.048 3.289 25541
1966 1 9 . 1 1 12 12 LYS HA H 12 4.093 4.093 3.667 0.426 25541
1967 1 9 . 1 1 12 12 LYS C C 12 173.147 173.147 174.070 -0.923 25541
1968 1 9 . 1 1 12 12 LYS CA C 12 56.327 56.327 57.506 -1.179 25541
1969 1 9 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.521 0.702 25541
1970 1 9 . 1 1 12 12 LYS H H 12 8.239 8.239 8.388 -0.149 25541
1971 1 9 . 1 1 13 13 TYR N N 13 119.233 119.233 116.513 2.720 25541
1972 1 9 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.674 -0.273 25541
1973 1 9 . 1 1 13 13 TYR C C 13 172.016 172.016 174.363 -2.347 25541
1974 1 9 . 1 1 13 13 TYR CA C 13 57.325 57.325 56.839 0.486 25541
1975 1 9 . 1 1 13 13 TYR CB C 13 39.864 39.864 42.167 -2.303 25541
1976 1 9 . 1 1 13 13 TYR H H 13 8.274 8.274 8.077 0.197 25541
1977 1 9 . 1 1 14 14 ASP N N 14 120.486 120.486 120.662 -0.176 25541
1978 1 9 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.881 -0.204 25541
1979 1 9 . 1 1 14 14 ASP C C 14 173.276 173.276 176.408 -3.132 25541
1980 1 9 . 1 1 14 14 ASP CA C 14 52.719 52.719 53.863 -1.144 25541
1981 1 9 . 1 1 14 14 ASP CB C 14 40.205 40.205 40.717 -0.512 25541
1982 1 9 . 1 1 14 14 ASP H H 14 8.603 8.603 8.726 -0.123 25541
1983 1 9 . 1 1 15 15 LEU N N 15 126.405 126.405 125.474 0.931 25541
1984 1 9 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.003 -1.238 25541
1985 1 9 . 1 1 15 15 LEU C C 15 175.592 175.592 177.321 -1.729 25541
1986 1 9 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.309 -1.054 25541
1987 1 9 . 1 1 15 15 LEU CB C 15 39.967 39.967 40.688 -0.722 25541
1988 1 9 . 1 1 15 15 LEU H H 15 8.901 8.901 8.671 0.230 25541
1989 1 9 . 1 1 16 16 SER N N 16 116.540 116.540 116.789 -0.249 25541
1990 1 9 . 1 1 16 16 SER HA H 16 4.100 4.100 4.219 -0.119 25541
1991 1 9 . 1 1 16 16 SER C C 16 173.247 173.247 174.623 -1.376 25541
1992 1 9 . 1 1 16 16 SER CA C 16 61.720 61.720 60.690 1.030 25541
1993 1 9 . 1 1 16 16 SER CB C 16 62.797 62.797 63.390 -0.593 25541
1994 1 9 . 1 1 16 16 SER H H 16 8.112 8.112 8.697 -0.585 25541
1995 1 9 . 1 1 17 17 LYS N N 17 118.008 118.008 118.491 -0.483 25541
1996 1 9 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.590 -0.089 25541
1997 1 9 . 1 1 17 17 LYS C C 17 175.079 175.079 175.128 -0.049 25541
1998 1 9 . 1 1 17 17 LYS CA C 17 55.267 55.267 56.205 -0.938 25541
1999 1 9 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.447 -2.470 25541
2000 1 9 . 1 1 17 17 LYS H H 17 8.521 8.521 7.747 0.774 25541
2001 1 9 . 1 1 18 18 TRP N N 18 122.041 122.041 122.157 -0.116 25541
2002 1 9 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.860 -0.282 25541
2003 1 9 . 1 1 18 18 TRP C C 18 174.862 174.862 175.454 -0.592 25541
2004 1 9 . 1 1 18 18 TRP CA C 18 58.371 58.371 56.541 1.830 25541
2005 1 9 . 1 1 18 18 TRP CB C 18 28.544 28.544 33.370 -4.826 25541
2006 1 9 . 1 1 18 18 TRP H H 18 7.853 7.853 8.579 -0.726 25541
2007 1 9 . 1 1 19 19 LYS N N 19 123.185 123.185 120.480 2.705 25541
2008 1 9 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.711 -0.176 25541
2009 1 9 . 1 1 19 19 LYS C C 19 175.094 175.094 177.129 -2.035 25541
2010 1 9 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.371 1.056 25541
2011 1 9 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.666 -0.546 25541
2012 1 9 . 1 1 19 19 LYS H H 19 9.544 9.544 8.933 0.611 25541
2013 1 9 . 1 1 20 20 TYR N N 20 124.291 124.291 126.299 -2.008 25541
2014 1 9 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.030 -0.005 25541
2015 1 9 . 1 1 20 20 TYR C C 20 174.531 174.531 177.293 -2.762 25541
2016 1 9 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.706 0.443 25541
2017 1 9 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.457 -0.304 25541
2018 1 9 . 1 1 20 20 TYR H H 20 9.266 9.266 9.169 0.097 25541
2019 1 9 . 1 1 21 21 ALA N N 21 117.781 117.781 121.565 -3.784 25541
2020 1 9 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.296 -0.423 25541
2021 1 9 . 1 1 21 21 ALA C C 21 176.314 176.314 179.426 -3.112 25541
2022 1 9 . 1 1 21 21 ALA CA C 21 55.335 55.335 55.181 0.154 25541
2023 1 9 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.963 0.740 25541
2024 1 9 . 1 1 21 21 ALA H H 21 8.986 8.986 8.573 0.413 25541
2025 1 9 . 1 1 22 22 GLU N N 22 115.218 115.218 119.759 -4.541 25541
2026 1 9 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.072 0.047 25541
2027 1 9 . 1 1 22 22 GLU C C 22 177.380 177.380 179.409 -2.029 25541
2028 1 9 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.766 -1.287 25541
2029 1 9 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.453 0.417 25541
2030 1 9 . 1 1 22 22 GLU H H 22 6.854 6.854 8.592 -1.738 25541
2031 1 9 . 1 1 23 23 LEU N N 23 122.132 122.132 119.885 2.247 25541
2032 1 9 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.056 0.100 25541
2033 1 9 . 1 1 23 23 LEU C C 23 174.830 174.830 178.982 -4.152 25541
2034 1 9 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.434 0.088 25541
2035 1 9 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.882 1.237 25541
2036 1 9 . 1 1 23 23 LEU H H 23 7.909 7.909 8.772 -0.863 25541
2037 1 9 . 1 1 24 24 ARG N N 24 118.051 118.051 118.678 -0.627 25541
2038 1 9 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.857 -0.220 25541
2039 1 9 . 1 1 24 24 ARG C C 24 175.240 175.240 178.551 -3.311 25541
2040 1 9 . 1 1 24 24 ARG CA C 24 58.976 58.976 59.485 -0.509 25541
2041 1 9 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.813 0.049 25541
2042 1 9 . 1 1 24 24 ARG H H 24 8.250 8.250 7.570 0.680 25541
2043 1 9 . 1 1 25 25 ASP N N 25 118.179 118.179 119.072 -0.893 25541
2044 1 9 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.522 -0.137 25541
2045 1 9 . 1 1 25 25 ASP C C 25 176.554 176.554 178.342 -1.788 25541
2046 1 9 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.224 0.132 25541
2047 1 9 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.549 -0.507 25541
2048 1 9 . 1 1 25 25 ASP H H 25 8.507 8.507 8.678 -0.171 25541
2049 1 9 . 1 1 26 26 THR N N 26 118.299 118.299 116.570 1.729 25541
2050 1 9 . 1 1 26 26 THR HA H 26 3.891 3.891 4.091 -0.200 25541
2051 1 9 . 1 1 26 26 THR C C 26 173.365 173.365 176.491 -3.126 25541
2052 1 9 . 1 1 26 26 THR CA C 26 67.787 67.787 66.202 1.585 25541
2053 1 9 . 1 1 26 26 THR CB C 26 68.120 68.120 68.951 -0.831 25541
2054 1 9 . 1 1 26 26 THR H H 26 7.918 7.918 8.394 -0.476 25541
2055 1 9 . 1 1 27 27 ILE N N 27 122.576 122.576 119.229 3.347 25541
2056 1 9 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.842 -0.217 25541
2057 1 9 . 1 1 27 27 ILE C C 27 174.485 174.485 176.181 -1.696 25541
2058 1 9 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.229 0.482 25541
2059 1 9 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.717 -0.189 25541
2060 1 9 . 1 1 27 27 ILE H H 27 8.159 8.159 7.479 0.680 25541
2061 1 9 . 1 1 28 28 ASN N N 28 115.118 115.118 116.428 -1.310 25541
2062 1 9 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.746 -0.131 25541
2063 1 9 . 1 1 28 28 ASN C C 28 173.902 173.902 174.927 -1.025 25541
2064 1 9 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.801 0.659 25541
2065 1 9 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.106 0.124 25541
2066 1 9 . 1 1 28 28 ASN H H 28 7.713 7.713 7.772 -0.059 25541
2067 1 9 . 1 1 29 29 THR N N 29 107.730 107.730 107.898 -0.168 25541
2068 1 9 . 1 1 29 29 THR HA H 29 4.600 4.600 4.400 0.200 25541
2069 1 9 . 1 1 29 29 THR C C 29 172.290 172.290 174.996 -2.706 25541
2070 1 9 . 1 1 29 29 THR CA C 29 62.595 62.595 62.221 0.374 25541
2071 1 9 . 1 1 29 29 THR CB C 29 72.291 72.291 69.956 2.335 25541
2072 1 9 . 1 1 29 29 THR H H 29 7.587 7.587 7.525 0.062 25541
2073 1 9 . 1 1 30 30 SER N N 30 117.784 117.784 118.064 -0.280 25541
2074 1 9 . 1 1 30 30 SER HA H 30 4.296 4.296 4.577 -0.281 25541
2075 1 9 . 1 1 30 30 SER C C 30 172.473 172.473 173.218 -0.745 25541
2076 1 9 . 1 1 30 30 SER CA C 30 59.618 59.618 58.242 1.376 25541
2077 1 9 . 1 1 30 30 SER CB C 30 64.402 64.402 64.390 0.012 25541
2078 1 9 . 1 1 30 30 SER H H 30 8.698 8.698 8.232 0.466 25541
2079 1 9 . 1 1 31 31 CYS N N 31 121.196 121.196 119.837 1.359 25541
2080 1 9 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.659 0.128 25541
2081 1 9 . 1 1 31 31 CYS C C 31 170.861 170.861 172.487 -1.626 25541
2082 1 9 . 1 1 31 31 CYS CA C 31 57.372 57.372 59.246 -1.874 25541
2083 1 9 . 1 1 31 31 CYS CB C 31 28.364 28.364 28.484 -0.120 25541
2084 1 9 . 1 1 31 31 CYS H H 31 8.713 8.713 8.419 0.294 25541
2085 1 9 . 1 1 32 32 ASP N N 32 124.610 124.610 126.339 -1.729 25541
2086 1 9 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.698 -0.085 25541
2087 1 9 . 1 1 32 32 ASP C C 32 172.541 172.541 175.857 -3.316 25541
2088 1 9 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.223 -1.038 25541
2089 1 9 . 1 1 32 32 ASP CB C 32 41.137 41.137 42.946 -1.809 25541
2090 1 9 . 1 1 32 32 ASP H H 32 8.542 8.542 8.128 0.414 25541
2091 1 9 . 1 1 33 33 ILE N N 33 125.134 125.134 121.265 3.869 25541
2092 1 9 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.127 -0.441 25541
2093 1 9 . 1 1 33 33 ILE C C 33 175.743 175.743 176.165 -0.422 25541
2094 1 9 . 1 1 33 33 ILE CA C 33 64.710 64.710 62.524 2.186 25541
2095 1 9 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.410 0.405 25541
2096 1 9 . 1 1 33 33 ILE H H 33 8.459 8.459 8.612 -0.153 25541
2097 1 9 . 1 1 34 34 GLU N N 34 121.097 121.097 120.331 0.766 25541
2098 1 9 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.240 -0.109 25541
2099 1 9 . 1 1 34 34 GLU C C 34 176.406 176.406 178.277 -1.871 25541
2100 1 9 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.487 0.846 25541
2101 1 9 . 1 1 34 34 GLU CB C 34 29.675 29.675 30.271 -0.596 25541
2102 1 9 . 1 1 34 34 GLU H H 34 8.177 8.177 7.924 0.253 25541
2103 1 9 . 1 1 35 35 LEU N N 35 124.890 124.890 120.663 4.227 25541
2104 1 9 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.873 -0.262 25541
2105 1 9 . 1 1 35 35 LEU C C 35 176.399 176.399 178.872 -2.473 25541
2106 1 9 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.832 -0.764 25541
2107 1 9 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.764 -0.854 25541
2108 1 9 . 1 1 35 35 LEU H H 35 7.831 7.831 7.741 0.090 25541
2109 1 9 . 1 1 36 36 LEU N N 36 120.493 120.493 118.679 1.814 25541
2110 1 9 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.758 -0.099 25541
2111 1 9 . 1 1 36 36 LEU C C 36 176.280 176.280 178.904 -2.624 25541
2112 1 9 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.123 0.492 25541
2113 1 9 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.978 1.491 25541
2114 1 9 . 1 1 36 36 LEU H H 36 8.843 8.843 7.492 1.351 25541
2115 1 9 . 1 1 37 37 ALA N N 37 119.956 119.956 120.735 -0.779 25541
2116 1 9 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.964 0.033 25541
2117 1 9 . 1 1 37 37 ALA C C 37 177.606 177.606 179.588 -1.982 25541
2118 1 9 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.844 0.325 25541
2119 1 9 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.867 -0.247 25541
2120 1 9 . 1 1 37 37 ALA H H 37 7.610 7.610 8.244 -0.634 25541
2121 1 9 . 1 1 38 38 ALA N N 38 121.594 121.594 121.324 0.270 25541
2122 1 9 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.119 -0.016 25541
2123 1 9 . 1 1 38 38 ALA C C 38 178.452 178.452 178.849 -0.397 25541
2124 1 9 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.324 0.531 25541
2125 1 9 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.541 -0.481 25541
2126 1 9 . 1 1 38 38 ALA H H 38 7.665 7.665 8.228 -0.563 25541
2127 1 9 . 1 1 39 39 CYS N N 39 119.263 119.263 118.312 0.951 25541
2128 1 9 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.936 -0.205 25541
2129 1 9 . 1 1 39 39 CYS C C 39 173.860 173.860 177.016 -3.156 25541
2130 1 9 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.488 1.335 25541
2131 1 9 . 1 1 39 39 CYS CB C 39 27.225 27.225 26.747 0.478 25541
2132 1 9 . 1 1 39 39 CYS H H 39 8.766 8.766 8.595 0.171 25541
2133 1 9 . 1 1 40 40 ARG N N 40 119.658 119.658 118.529 1.129 25541
2134 1 9 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.935 -0.037 25541
2135 1 9 . 1 1 40 40 ARG C C 40 176.108 176.108 178.894 -2.786 25541
2136 1 9 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.699 0.783 25541
2137 1 9 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.848 0.016 25541
2138 1 9 . 1 1 40 40 ARG H H 40 8.327 8.327 8.536 -0.209 25541
2139 1 9 . 1 1 41 41 GLU N N 41 119.358 119.358 118.937 0.421 25541
2140 1 9 . 1 1 41 41 GLU HA H 41 4.099 4.099 4.082 0.017 25541
2141 1 9 . 1 1 41 41 GLU C C 41 171.786 171.786 178.555 -6.769 25541
2142 1 9 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.601 -0.388 25541
2143 1 9 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.694 -0.417 25541
2144 1 9 . 1 1 41 41 GLU H H 41 7.929 7.929 7.663 0.266 25541
2145 1 9 . 1 1 42 42 GLU N N 42 121.281 121.281 119.833 1.448 25541
2146 1 9 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.105 0.118 25541
2147 1 9 . 1 1 42 42 GLU C C 42 173.408 173.408 178.654 -5.246 25541
2148 1 9 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.565 -0.246 25541
2149 1 9 . 1 1 42 42 GLU CB C 42 28.215 28.215 28.945 -0.730 25541
2150 1 9 . 1 1 42 42 GLU H H 42 7.945 7.945 7.929 0.016 25541
2151 1 9 . 1 1 43 43 PHE N N 43 119.271 119.271 120.425 -1.154 25541
2152 1 9 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.077 -0.000 25541
2153 1 9 . 1 1 43 43 PHE C C 43 175.299 175.299 177.034 -1.735 25541
2154 1 9 . 1 1 43 43 PHE CA C 43 61.549 61.549 61.863 -0.314 25541
2155 1 9 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.258 -0.124 25541
2156 1 9 . 1 1 43 43 PHE H H 43 8.624 8.624 8.583 0.041 25541
2157 1 9 . 1 1 44 44 HIS N N 44 116.374 116.374 118.326 -1.952 25541
2158 1 9 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.363 -0.097 25541
2159 1 9 . 1 1 44 44 HIS C C 44 174.771 174.771 177.790 -3.019 25541
2160 1 9 . 1 1 44 44 HIS CA C 44 59.343 59.343 59.327 0.016 25541
2161 1 9 . 1 1 44 44 HIS CB C 44 29.488 29.488 30.076 -0.588 25541
2162 1 9 . 1 1 44 44 HIS H H 44 7.976 7.976 7.661 0.315 25541
2163 1 9 . 1 1 45 45 ARG N N 45 120.170 120.170 118.755 1.415 25541
2164 1 9 . 1 1 45 45 ARG HA H 45 3.946 3.946 3.908 0.038 25541
2165 1 9 . 1 1 45 45 ARG C C 45 176.310 176.310 178.680 -2.370 25541
2166 1 9 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.363 -0.157 25541
2167 1 9 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.914 0.474 25541
2168 1 9 . 1 1 45 45 ARG H H 45 8.166 8.166 7.621 0.545 25541
2169 1 9 . 1 1 46 46 ARG N N 46 116.229 116.229 117.624 -1.395 25541
2170 1 9 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.122 -0.057 25541
2171 1 9 . 1 1 46 46 ARG C C 46 176.046 176.046 178.287 -2.241 25541
2172 1 9 . 1 1 46 46 ARG CA C 46 57.691 57.691 58.018 -0.327 25541
2173 1 9 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.209 1.039 25541
2174 1 9 . 1 1 46 46 ARG H H 46 7.764 7.764 7.510 0.254 25541
2175 1 9 . 1 1 47 47 LEU N N 47 119.010 119.010 117.215 1.795 25541
2176 1 9 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.404 -0.269 25541
2177 1 9 . 1 1 47 47 LEU CA C 47 55.957 55.957 56.577 -0.619 25541
2178 1 9 . 1 1 47 47 LEU CB C 47 42.024 42.024 42.162 -0.138 25541
2179 1 9 . 1 1 47 47 LEU H H 47 7.557 7.557 7.660 -0.103 25541
2180 1 9 . 1 1 48 48 LYS N N 48 119.277 119.277 118.597 0.680 25541
2181 1 9 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.409 -0.334 25541
2182 1 9 . 1 1 48 48 LYS C C 48 176.354 176.354 178.023 -1.669 25541
2183 1 9 . 1 1 48 48 LYS CA C 48 56.655 56.655 56.693 -0.038 25541
2184 1 9 . 1 1 48 48 LYS CB C 48 32.410 32.410 33.277 -0.867 25541
2185 1 9 . 1 1 48 48 LYS H H 48 7.662 7.662 7.721 -0.059 25541
2186 1 9 . 1 1 49 49 VAL N N 49 119.095 119.095 120.347 -1.252 25541
2187 1 9 . 1 1 49 49 VAL HA H 49 3.972 3.972 3.827 0.145 25541
2188 1 9 . 1 1 49 49 VAL C C 49 174.195 174.195 175.409 -1.214 25541
2189 1 9 . 1 1 49 49 VAL CA C 49 62.214 62.214 64.535 -2.321 25541
2190 1 9 . 1 1 49 49 VAL CB C 49 32.747 32.747 32.269 0.478 25541
2191 1 9 . 1 1 49 49 VAL H H 49 7.688 7.688 8.043 -0.355 25541
2192 1 9 . 1 1 50 50 TYR N N 50 123.606 123.606 120.464 3.142 25541
2193 1 9 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.704 -0.222 25541
2194 1 9 . 1 1 50 50 TYR CA C 50 57.855 57.855 57.197 0.658 25541
2195 1 9 . 1 1 50 50 TYR CB C 50 38.721 38.721 38.250 0.471 25541
2196 1 9 . 1 1 50 50 TYR H H 50 8.164 8.164 7.618 0.546 25541
2197 1 10 . 1 1 10 10 THR N N 10 114.351 114.351 114.076 0.275 25541
2198 1 10 . 1 1 10 10 THR HA H 10 4.241 4.241 4.101 0.140 25541
2199 1 10 . 1 1 10 10 THR C C 10 171.741 171.741 172.802 -1.061 25541
2200 1 10 . 1 1 10 10 THR CA C 10 62.002 62.002 62.236 -0.234 25541
2201 1 10 . 1 1 10 10 THR CB C 10 69.796 69.796 69.528 0.268 25541
2202 1 10 . 1 1 10 10 THR H H 10 8.114 8.114 8.185 -0.071 25541
2203 1 10 . 1 1 11 11 LYS N N 11 124.677 124.677 121.677 3.000 25541
2204 1 10 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.383 -0.219 25541
2205 1 10 . 1 1 11 11 LYS C C 11 172.964 172.964 176.443 -3.479 25541
2206 1 10 . 1 1 11 11 LYS CA C 11 56.122 56.122 55.700 0.422 25541
2207 1 10 . 1 1 11 11 LYS CB C 11 32.819 32.819 32.226 0.593 25541
2208 1 10 . 1 1 11 11 LYS H H 11 8.436 8.436 8.299 0.137 25541
2209 1 10 . 1 1 12 12 LYS N N 12 123.337 123.337 118.490 4.847 25541
2210 1 10 . 1 1 12 12 LYS HA H 12 4.093 4.093 3.588 0.505 25541
2211 1 10 . 1 1 12 12 LYS C C 12 173.147 173.147 175.251 -2.104 25541
2212 1 10 . 1 1 12 12 LYS CA C 12 56.327 56.327 57.560 -1.233 25541
2213 1 10 . 1 1 12 12 LYS CB C 12 33.223 33.223 31.962 1.261 25541
2214 1 10 . 1 1 12 12 LYS H H 12 8.239 8.239 8.268 -0.029 25541
2215 1 10 . 1 1 13 13 TYR N N 13 119.233 119.233 118.973 0.260 25541
2216 1 10 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.665 -0.264 25541
2217 1 10 . 1 1 13 13 TYR C C 13 172.016 172.016 174.852 -2.836 25541
2218 1 10 . 1 1 13 13 TYR CA C 13 57.325 57.325 56.817 0.508 25541
2219 1 10 . 1 1 13 13 TYR CB C 13 39.864 39.864 41.384 -1.520 25541
2220 1 10 . 1 1 13 13 TYR H H 13 8.274 8.274 8.172 0.102 25541
2221 1 10 . 1 1 14 14 ASP N N 14 120.486 120.486 120.248 0.238 25541
2222 1 10 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.848 -0.171 25541
2223 1 10 . 1 1 14 14 ASP C C 14 173.276 173.276 176.390 -3.114 25541
2224 1 10 . 1 1 14 14 ASP CA C 14 52.719 52.719 53.856 -1.137 25541
2225 1 10 . 1 1 14 14 ASP CB C 14 40.205 40.205 40.630 -0.425 25541
2226 1 10 . 1 1 14 14 ASP H H 14 8.603 8.603 8.767 -0.164 25541
2227 1 10 . 1 1 15 15 LEU N N 15 126.405 126.405 125.482 0.923 25541
2228 1 10 . 1 1 15 15 LEU HA H 15 3.765 3.765 4.989 -1.224 25541
2229 1 10 . 1 1 15 15 LEU C C 15 175.592 175.592 177.388 -1.796 25541
2230 1 10 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.175 -0.919 25541
2231 1 10 . 1 1 15 15 LEU CB C 15 39.967 39.967 40.595 -0.628 25541
2232 1 10 . 1 1 15 15 LEU H H 15 8.901 8.901 8.613 0.288 25541
2233 1 10 . 1 1 16 16 SER N N 16 116.540 116.540 115.529 1.011 25541
2234 1 10 . 1 1 16 16 SER HA H 16 4.100 4.100 4.220 -0.120 25541
2235 1 10 . 1 1 16 16 SER C C 16 173.247 173.247 174.270 -1.023 25541
2236 1 10 . 1 1 16 16 SER CA C 16 61.720 61.720 60.566 1.154 25541
2237 1 10 . 1 1 16 16 SER CB C 16 62.797 62.797 63.574 -0.777 25541
2238 1 10 . 1 1 16 16 SER H H 16 8.112 8.112 8.469 -0.357 25541
2239 1 10 . 1 1 17 17 LYS N N 17 118.008 118.008 118.097 -0.089 25541
2240 1 10 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.531 -0.030 25541
2241 1 10 . 1 1 17 17 LYS C C 17 175.079 175.079 175.066 0.013 25541
2242 1 10 . 1 1 17 17 LYS CA C 17 55.267 55.267 55.854 -0.587 25541
2243 1 10 . 1 1 17 17 LYS CB C 17 31.977 31.977 33.884 -1.907 25541
2244 1 10 . 1 1 17 17 LYS H H 17 8.521 8.521 7.960 0.561 25541
2245 1 10 . 1 1 18 18 TRP N N 18 122.041 122.041 122.799 -0.758 25541
2246 1 10 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.855 -0.277 25541
2247 1 10 . 1 1 18 18 TRP C C 18 174.862 174.862 174.903 -0.041 25541
2248 1 10 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.322 1.049 25541
2249 1 10 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.512 -3.968 25541
2250 1 10 . 1 1 18 18 TRP H H 18 7.853 7.853 8.480 -0.627 25541
2251 1 10 . 1 1 19 19 LYS N N 19 123.185 123.185 121.038 2.147 25541
2252 1 10 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.737 -0.202 25541
2253 1 10 . 1 1 19 19 LYS C C 19 175.094 175.094 177.052 -1.958 25541
2254 1 10 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.980 0.447 25541
2255 1 10 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.938 -0.818 25541
2256 1 10 . 1 1 19 19 LYS H H 19 9.544 9.544 8.497 1.047 25541
2257 1 10 . 1 1 20 20 TYR N N 20 124.291 124.291 126.082 -1.791 25541
2258 1 10 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.086 -0.061 25541
2259 1 10 . 1 1 20 20 TYR C C 20 174.531 174.531 177.066 -2.535 25541
2260 1 10 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.488 0.661 25541
2261 1 10 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.414 -0.261 25541
2262 1 10 . 1 1 20 20 TYR H H 20 9.266 9.266 9.284 -0.019 25541
2263 1 10 . 1 1 21 21 ALA N N 21 117.781 117.781 120.380 -2.599 25541
2264 1 10 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.269 -0.396 25541
2265 1 10 . 1 1 21 21 ALA C C 21 176.314 176.314 179.388 -3.074 25541
2266 1 10 . 1 1 21 21 ALA CA C 21 55.335 55.335 54.854 0.481 25541
2267 1 10 . 1 1 21 21 ALA CB C 21 18.703 18.703 18.191 0.512 25541
2268 1 10 . 1 1 21 21 ALA H H 21 8.986 8.986 8.489 0.497 25541
2269 1 10 . 1 1 22 22 GLU N N 22 115.218 115.218 119.631 -4.413 25541
2270 1 10 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.219 -0.100 25541
2271 1 10 . 1 1 22 22 GLU C C 22 177.380 177.380 179.332 -1.952 25541
2272 1 10 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.272 -0.793 25541
2273 1 10 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.430 0.440 25541
2274 1 10 . 1 1 22 22 GLU H H 22 6.854 6.854 7.651 -0.797 25541
2275 1 10 . 1 1 23 23 LEU N N 23 122.132 122.132 120.330 1.802 25541
2276 1 10 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.006 0.150 25541
2277 1 10 . 1 1 23 23 LEU C C 23 174.830 174.830 179.425 -4.595 25541
2278 1 10 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.372 0.150 25541
2279 1 10 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.667 1.452 25541
2280 1 10 . 1 1 23 23 LEU H H 23 7.909 7.909 9.060 -1.151 25541
2281 1 10 . 1 1 24 24 ARG N N 24 118.051 118.051 118.348 -0.297 25541
2282 1 10 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.917 -0.280 25541
2283 1 10 . 1 1 24 24 ARG C C 24 175.240 175.240 178.540 -3.300 25541
2284 1 10 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.793 0.183 25541
2285 1 10 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.673 0.189 25541
2286 1 10 . 1 1 24 24 ARG H H 24 8.250 8.250 7.570 0.680 25541
2287 1 10 . 1 1 25 25 ASP N N 25 118.179 118.179 119.257 -1.078 25541
2288 1 10 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.517 -0.132 25541
2289 1 10 . 1 1 25 25 ASP C C 25 176.554 176.554 178.381 -1.827 25541
2290 1 10 . 1 1 25 25 ASP CA C 25 57.356 57.356 56.965 0.391 25541
2291 1 10 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.329 -0.287 25541
2292 1 10 . 1 1 25 25 ASP H H 25 8.507 8.507 8.191 0.316 25541
2293 1 10 . 1 1 26 26 THR N N 26 118.299 118.299 116.519 1.780 25541
2294 1 10 . 1 1 26 26 THR HA H 26 3.891 3.891 4.065 -0.174 25541
2295 1 10 . 1 1 26 26 THR C C 26 173.365 173.365 176.460 -3.095 25541
2296 1 10 . 1 1 26 26 THR CA C 26 67.787 67.787 66.247 1.540 25541
2297 1 10 . 1 1 26 26 THR CB C 26 68.120 68.120 68.891 -0.771 25541
2298 1 10 . 1 1 26 26 THR H H 26 7.918 7.918 8.384 -0.466 25541
2299 1 10 . 1 1 27 27 ILE N N 27 122.576 122.576 118.896 3.680 25541
2300 1 10 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.868 -0.243 25541
2301 1 10 . 1 1 27 27 ILE C C 27 174.485 174.485 175.649 -1.164 25541
2302 1 10 . 1 1 27 27 ILE CA C 27 64.711 64.711 63.846 0.865 25541
2303 1 10 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.927 -0.400 25541
2304 1 10 . 1 1 27 27 ILE H H 27 8.159 8.159 7.281 0.878 25541
2305 1 10 . 1 1 28 28 ASN N N 28 115.118 115.118 116.564 -1.446 25541
2306 1 10 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.732 -0.117 25541
2307 1 10 . 1 1 28 28 ASN C C 28 173.902 173.902 174.872 -0.970 25541
2308 1 10 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.548 0.912 25541
2309 1 10 . 1 1 28 28 ASN CB C 28 39.230 39.230 38.809 0.420 25541
2310 1 10 . 1 1 28 28 ASN H H 28 7.713 7.713 7.791 -0.078 25541
2311 1 10 . 1 1 29 29 THR N N 29 107.730 107.730 107.887 -0.157 25541
2312 1 10 . 1 1 29 29 THR HA H 29 4.600 4.600 4.407 0.193 25541
2313 1 10 . 1 1 29 29 THR C C 29 172.290 172.290 174.964 -2.674 25541
2314 1 10 . 1 1 29 29 THR CA C 29 62.595 62.595 62.221 0.374 25541
2315 1 10 . 1 1 29 29 THR CB C 29 72.291 72.291 70.001 2.290 25541
2316 1 10 . 1 1 29 29 THR H H 29 7.587 7.587 7.524 0.063 25541
2317 1 10 . 1 1 30 30 SER N N 30 117.784 117.784 118.454 -0.670 25541
2318 1 10 . 1 1 30 30 SER HA H 30 4.296 4.296 4.593 -0.297 25541
2319 1 10 . 1 1 30 30 SER C C 30 172.473 172.473 173.053 -0.580 25541
2320 1 10 . 1 1 30 30 SER CA C 30 59.618 59.618 58.142 1.476 25541
2321 1 10 . 1 1 30 30 SER CB C 30 64.402 64.402 64.604 -0.202 25541
2322 1 10 . 1 1 30 30 SER H H 30 8.698 8.698 8.184 0.514 25541
2323 1 10 . 1 1 31 31 CYS N N 31 121.196 121.196 119.468 1.728 25541
2324 1 10 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.625 0.162 25541
2325 1 10 . 1 1 31 31 CYS C C 31 170.861 170.861 172.313 -1.452 25541
2326 1 10 . 1 1 31 31 CYS CA C 31 57.372 57.372 58.816 -1.444 25541
2327 1 10 . 1 1 31 31 CYS CB C 31 28.364 28.364 28.786 -0.422 25541
2328 1 10 . 1 1 31 31 CYS H H 31 8.713 8.713 8.444 0.269 25541
2329 1 10 . 1 1 32 32 ASP N N 32 124.610 124.610 126.480 -1.870 25541
2330 1 10 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.690 -0.077 25541
2331 1 10 . 1 1 32 32 ASP C C 32 172.541 172.541 175.657 -3.116 25541
2332 1 10 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.035 -0.850 25541
2333 1 10 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.207 -2.070 25541
2334 1 10 . 1 1 32 32 ASP H H 32 8.542 8.542 8.262 0.280 25541
2335 1 10 . 1 1 33 33 ILE N N 33 125.134 125.134 121.302 3.832 25541
2336 1 10 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.081 -0.395 25541
2337 1 10 . 1 1 33 33 ILE C C 33 175.743 175.743 176.194 -0.451 25541
2338 1 10 . 1 1 33 33 ILE CA C 33 64.710 64.710 62.303 2.407 25541
2339 1 10 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.227 0.588 25541
2340 1 10 . 1 1 33 33 ILE H H 33 8.459 8.459 8.589 -0.130 25541
2341 1 10 . 1 1 34 34 GLU N N 34 121.097 121.097 118.937 2.160 25541
2342 1 10 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.212 -0.081 25541
2343 1 10 . 1 1 34 34 GLU C C 34 176.406 176.406 178.324 -1.918 25541
2344 1 10 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.041 1.292 25541
2345 1 10 . 1 1 34 34 GLU CB C 34 29.675 29.675 29.711 -0.036 25541
2346 1 10 . 1 1 34 34 GLU H H 34 8.177 8.177 7.932 0.245 25541
2347 1 10 . 1 1 35 35 LEU N N 35 124.890 124.890 121.669 3.221 25541
2348 1 10 . 1 1 35 35 LEU HA H 35 3.611 3.611 4.004 -0.393 25541
2349 1 10 . 1 1 35 35 LEU C C 35 176.399 176.399 179.076 -2.677 25541
2350 1 10 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.769 -0.701 25541
2351 1 10 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.703 -0.793 25541
2352 1 10 . 1 1 35 35 LEU H H 35 7.831 7.831 8.073 -0.242 25541
2353 1 10 . 1 1 36 36 LEU N N 36 120.493 120.493 118.550 1.943 25541
2354 1 10 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.771 -0.112 25541
2355 1 10 . 1 1 36 36 LEU C C 36 176.280 176.280 179.012 -2.732 25541
2356 1 10 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.130 0.485 25541
2357 1 10 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.986 1.483 25541
2358 1 10 . 1 1 36 36 LEU H H 36 8.843 8.843 7.548 1.295 25541
2359 1 10 . 1 1 37 37 ALA N N 37 119.956 119.956 120.715 -0.759 25541
2360 1 10 . 1 1 37 37 ALA HA H 37 3.997 3.997 4.001 -0.004 25541
2361 1 10 . 1 1 37 37 ALA C C 37 177.606 177.606 179.551 -1.945 25541
2362 1 10 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.788 0.382 25541
2363 1 10 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.923 -0.303 25541
2364 1 10 . 1 1 37 37 ALA H H 37 7.610 7.610 8.222 -0.612 25541
2365 1 10 . 1 1 38 38 ALA N N 38 121.594 121.594 120.948 0.646 25541
2366 1 10 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.252 -0.149 25541
2367 1 10 . 1 1 38 38 ALA C C 38 178.452 178.452 178.867 -0.415 25541
2368 1 10 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.465 0.390 25541
2369 1 10 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.532 -0.472 25541
2370 1 10 . 1 1 38 38 ALA H H 38 7.665 7.665 8.462 -0.797 25541
2371 1 10 . 1 1 39 39 CYS N N 39 119.263 119.263 118.226 1.037 25541
2372 1 10 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.885 -0.154 25541
2373 1 10 . 1 1 39 39 CYS C C 39 173.860 173.860 176.620 -2.760 25541
2374 1 10 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.399 1.424 25541
2375 1 10 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.731 -0.506 25541
2376 1 10 . 1 1 39 39 CYS H H 39 8.766 8.766 8.504 0.262 25541
2377 1 10 . 1 1 40 40 ARG N N 40 119.658 119.658 119.405 0.253 25541
2378 1 10 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.871 0.027 25541
2379 1 10 . 1 1 40 40 ARG C C 40 176.108 176.108 178.715 -2.607 25541
2380 1 10 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.953 0.529 25541
2381 1 10 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.948 -0.084 25541
2382 1 10 . 1 1 40 40 ARG H H 40 8.327 8.327 8.435 -0.108 25541
2383 1 10 . 1 1 41 41 GLU N N 41 119.358 119.358 118.384 0.974 25541
2384 1 10 . 1 1 41 41 GLU HA H 41 4.099 4.099 4.037 0.062 25541
2385 1 10 . 1 1 41 41 GLU C C 41 171.786 171.786 178.944 -7.158 25541
2386 1 10 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.645 -0.432 25541
2387 1 10 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.293 -0.016 25541
2388 1 10 . 1 1 41 41 GLU H H 41 7.929 7.929 7.814 0.115 25541
2389 1 10 . 1 1 42 42 GLU N N 42 121.281 121.281 119.322 1.959 25541
2390 1 10 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.151 0.072 25541
2391 1 10 . 1 1 42 42 GLU C C 42 173.408 173.408 178.838 -5.430 25541
2392 1 10 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.719 -0.400 25541
2393 1 10 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.537 -1.322 25541
2394 1 10 . 1 1 42 42 GLU H H 42 7.945 7.945 7.708 0.237 25541
2395 1 10 . 1 1 43 43 PHE N N 43 119.271 119.271 120.626 -1.355 25541
2396 1 10 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.066 0.011 25541
2397 1 10 . 1 1 43 43 PHE C C 43 175.299 175.299 177.717 -2.418 25541
2398 1 10 . 1 1 43 43 PHE CA C 43 61.549 61.549 61.730 -0.181 25541
2399 1 10 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.123 0.011 25541
2400 1 10 . 1 1 43 43 PHE H H 43 8.624 8.624 8.435 0.189 25541
2401 1 10 . 1 1 44 44 HIS N N 44 116.374 116.374 117.563 -1.189 25541
2402 1 10 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.369 -0.103 25541
2403 1 10 . 1 1 44 44 HIS C C 44 174.771 174.771 177.711 -2.940 25541
2404 1 10 . 1 1 44 44 HIS CA C 44 59.343 59.343 58.854 0.489 25541
2405 1 10 . 1 1 44 44 HIS CB C 44 29.488 29.488 30.201 -0.713 25541
2406 1 10 . 1 1 44 44 HIS H H 44 7.976 7.976 8.184 -0.208 25541
2407 1 10 . 1 1 45 45 ARG N N 45 120.170 120.170 119.017 1.153 25541
2408 1 10 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.016 -0.070 25541
2409 1 10 . 1 1 45 45 ARG C C 45 176.310 176.310 178.708 -2.398 25541
2410 1 10 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.166 0.040 25541
2411 1 10 . 1 1 45 45 ARG CB C 45 30.388 30.388 30.055 0.333 25541
2412 1 10 . 1 1 45 45 ARG H H 45 8.166 8.166 8.032 0.134 25541
2413 1 10 . 1 1 46 46 ARG N N 46 116.229 116.229 118.930 -2.701 25541
2414 1 10 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.290 -0.225 25541
2415 1 10 . 1 1 46 46 ARG C C 46 176.046 176.046 178.487 -2.441 25541
2416 1 10 . 1 1 46 46 ARG CA C 46 57.691 57.691 58.471 -0.780 25541
2417 1 10 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.798 0.450 25541
2418 1 10 . 1 1 46 46 ARG H H 46 7.764 7.764 7.963 -0.199 25541
2419 1 10 . 1 1 47 47 LEU N N 47 119.010 119.010 118.582 0.428 25541
2420 1 10 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.105 0.030 25541
2421 1 10 . 1 1 47 47 LEU CA C 47 55.957 55.957 57.697 -1.740 25541
2422 1 10 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.240 0.783 25541
2423 1 10 . 1 1 47 47 LEU H H 47 7.557 7.557 7.278 0.279 25541
2424 1 10 . 1 1 48 48 LYS N N 48 119.277 119.277 116.414 2.863 25541
2425 1 10 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.052 0.023 25541
2426 1 10 . 1 1 48 48 LYS C C 48 176.354 176.354 176.866 -0.512 25541
2427 1 10 . 1 1 48 48 LYS CA C 48 56.655 56.655 58.337 -1.682 25541
2428 1 10 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.752 -0.342 25541
2429 1 10 . 1 1 48 48 LYS H H 48 7.662 7.662 7.576 0.086 25541
2430 1 10 . 1 1 49 49 VAL N N 49 119.095 119.095 116.302 2.793 25541
2431 1 10 . 1 1 49 49 VAL HA H 49 3.972 3.972 3.848 0.124 25541
2432 1 10 . 1 1 49 49 VAL C C 49 174.195 174.195 173.839 0.356 25541
2433 1 10 . 1 1 49 49 VAL CA C 49 62.214 62.214 60.457 1.757 25541
2434 1 10 . 1 1 49 49 VAL CB C 49 32.747 32.747 34.152 -1.405 25541
2435 1 10 . 1 1 49 49 VAL H H 49 7.688 7.688 7.441 0.247 25541
2436 1 10 . 1 1 50 50 TYR N N 50 123.606 123.606 127.724 -4.118 25541
2437 1 10 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.646 -0.164 25541
2438 1 10 . 1 1 50 50 TYR CA C 50 57.855 57.855 57.017 0.837 25541
2439 1 10 . 1 1 50 50 TYR CB C 50 38.721 38.721 38.648 0.074 25541
2440 1 10 . 1 1 50 50 TYR H H 50 8.164 8.164 7.813 0.351 25541
2441 1 11 . 1 1 10 10 THR N N 10 114.351 114.351 113.690 0.661 25541
2442 1 11 . 1 1 10 10 THR HA H 10 4.241 4.241 4.476 -0.235 25541
2443 1 11 . 1 1 10 10 THR C C 10 171.741 171.741 173.085 -1.344 25541
2444 1 11 . 1 1 10 10 THR CA C 10 62.002 62.002 61.730 0.272 25541
2445 1 11 . 1 1 10 10 THR CB C 10 69.796 69.796 69.665 0.132 25541
2446 1 11 . 1 1 10 10 THR H H 10 8.114 8.114 7.962 0.152 25541
2447 1 11 . 1 1 11 11 LYS N N 11 124.677 124.677 122.693 1.984 25541
2448 1 11 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.321 -0.157 25541
2449 1 11 . 1 1 11 11 LYS C C 11 172.964 172.964 175.496 -2.532 25541
2450 1 11 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.362 -0.240 25541
2451 1 11 . 1 1 11 11 LYS CB C 11 32.819 32.819 32.754 0.065 25541
2452 1 11 . 1 1 11 11 LYS H H 11 8.436 8.436 8.334 0.102 25541
2453 1 11 . 1 1 12 12 LYS N N 12 123.337 123.337 119.651 3.686 25541
2454 1 11 . 1 1 12 12 LYS HA H 12 4.093 4.093 3.568 0.525 25541
2455 1 11 . 1 1 12 12 LYS C C 12 173.147 173.147 175.181 -2.034 25541
2456 1 11 . 1 1 12 12 LYS CA C 12 56.327 56.327 57.274 -0.947 25541
2457 1 11 . 1 1 12 12 LYS CB C 12 33.223 33.223 31.210 2.013 25541
2458 1 11 . 1 1 12 12 LYS H H 12 8.239 8.239 8.166 0.073 25541
2459 1 11 . 1 1 13 13 TYR N N 13 119.233 119.233 117.666 1.567 25541
2460 1 11 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.648 -0.247 25541
2461 1 11 . 1 1 13 13 TYR C C 13 172.016 172.016 174.483 -2.467 25541
2462 1 11 . 1 1 13 13 TYR CA C 13 57.325 57.325 57.127 0.198 25541
2463 1 11 . 1 1 13 13 TYR CB C 13 39.864 39.864 41.519 -1.655 25541
2464 1 11 . 1 1 13 13 TYR H H 13 8.274 8.274 7.923 0.351 25541
2465 1 11 . 1 1 14 14 ASP N N 14 120.486 120.486 123.434 -2.948 25541
2466 1 11 . 1 1 14 14 ASP HA H 14 4.677 4.677 5.073 -0.396 25541
2467 1 11 . 1 1 14 14 ASP C C 14 173.276 173.276 175.993 -2.717 25541
2468 1 11 . 1 1 14 14 ASP CA C 14 52.719 52.719 54.066 -1.347 25541
2469 1 11 . 1 1 14 14 ASP CB C 14 40.205 40.205 41.442 -1.237 25541
2470 1 11 . 1 1 14 14 ASP H H 14 8.603 8.603 8.794 -0.191 25541
2471 1 11 . 1 1 15 15 LEU N N 15 126.405 126.405 125.501 0.904 25541
2472 1 11 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.089 -1.324 25541
2473 1 11 . 1 1 15 15 LEU C C 15 175.592 175.592 177.483 -1.891 25541
2474 1 11 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.418 -1.163 25541
2475 1 11 . 1 1 15 15 LEU CB C 15 39.967 39.967 41.352 -1.385 25541
2476 1 11 . 1 1 15 15 LEU H H 15 8.901 8.901 8.674 0.227 25541
2477 1 11 . 1 1 16 16 SER N N 16 116.540 116.540 115.917 0.623 25541
2478 1 11 . 1 1 16 16 SER HA H 16 4.100 4.100 4.235 -0.135 25541
2479 1 11 . 1 1 16 16 SER C C 16 173.247 173.247 174.743 -1.496 25541
2480 1 11 . 1 1 16 16 SER CA C 16 61.720 61.720 60.444 1.276 25541
2481 1 11 . 1 1 16 16 SER CB C 16 62.797 62.797 63.352 -0.555 25541
2482 1 11 . 1 1 16 16 SER H H 16 8.112 8.112 8.013 0.099 25541
2483 1 11 . 1 1 17 17 LYS N N 17 118.008 118.008 120.542 -2.534 25541
2484 1 11 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.577 -0.076 25541
2485 1 11 . 1 1 17 17 LYS C C 17 175.079 175.079 175.124 -0.045 25541
2486 1 11 . 1 1 17 17 LYS CA C 17 55.267 55.267 56.002 -0.735 25541
2487 1 11 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.372 -2.395 25541
2488 1 11 . 1 1 17 17 LYS H H 17 8.521 8.521 8.196 0.325 25541
2489 1 11 . 1 1 18 18 TRP N N 18 122.041 122.041 122.234 -0.193 25541
2490 1 11 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.758 -0.180 25541
2491 1 11 . 1 1 18 18 TRP C C 18 174.862 174.862 174.996 -0.134 25541
2492 1 11 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.061 1.310 25541
2493 1 11 . 1 1 18 18 TRP CB C 18 28.544 28.544 31.935 -3.391 25541
2494 1 11 . 1 1 18 18 TRP H H 18 7.853 7.853 8.481 -0.628 25541
2495 1 11 . 1 1 19 19 LYS N N 19 123.185 123.185 121.680 1.505 25541
2496 1 11 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.777 -0.242 25541
2497 1 11 . 1 1 19 19 LYS C C 19 175.094 175.094 176.659 -1.565 25541
2498 1 11 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.831 0.596 25541
2499 1 11 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.952 -0.832 25541
2500 1 11 . 1 1 19 19 LYS H H 19 9.544 9.544 8.609 0.935 25541
2501 1 11 . 1 1 20 20 TYR N N 20 124.291 124.291 126.034 -1.743 25541
2502 1 11 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.027 -0.002 25541
2503 1 11 . 1 1 20 20 TYR C C 20 174.531 174.531 177.160 -2.629 25541
2504 1 11 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.677 0.472 25541
2505 1 11 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.525 -0.372 25541
2506 1 11 . 1 1 20 20 TYR H H 20 9.266 9.266 9.256 0.010 25541
2507 1 11 . 1 1 21 21 ALA N N 21 117.781 117.781 121.256 -3.475 25541
2508 1 11 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.341 -0.468 25541
2509 1 11 . 1 1 21 21 ALA C C 21 176.314 176.314 179.606 -3.292 25541
2510 1 11 . 1 1 21 21 ALA CA C 21 55.335 55.335 54.969 0.366 25541
2511 1 11 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.837 0.866 25541
2512 1 11 . 1 1 21 21 ALA H H 21 8.986 8.986 8.541 0.445 25541
2513 1 11 . 1 1 22 22 GLU N N 22 115.218 115.218 119.531 -4.313 25541
2514 1 11 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.147 -0.028 25541
2515 1 11 . 1 1 22 22 GLU C C 22 177.380 177.380 179.302 -1.922 25541
2516 1 11 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.476 -0.997 25541
2517 1 11 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.416 0.454 25541
2518 1 11 . 1 1 22 22 GLU H H 22 6.854 6.854 8.466 -1.612 25541
2519 1 11 . 1 1 23 23 LEU N N 23 122.132 122.132 119.788 2.344 25541
2520 1 11 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.085 0.071 25541
2521 1 11 . 1 1 23 23 LEU C C 23 174.830 174.830 179.736 -4.906 25541
2522 1 11 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.331 0.191 25541
2523 1 11 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.578 1.541 25541
2524 1 11 . 1 1 23 23 LEU H H 23 7.909 7.909 9.038 -1.129 25541
2525 1 11 . 1 1 24 24 ARG N N 24 118.051 118.051 118.884 -0.833 25541
2526 1 11 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.983 -0.346 25541
2527 1 11 . 1 1 24 24 ARG C C 24 175.240 175.240 178.251 -3.011 25541
2528 1 11 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.870 0.106 25541
2529 1 11 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.831 0.031 25541
2530 1 11 . 1 1 24 24 ARG H H 24 8.250 8.250 7.589 0.661 25541
2531 1 11 . 1 1 25 25 ASP N N 25 118.179 118.179 118.367 -0.188 25541
2532 1 11 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.426 -0.041 25541
2533 1 11 . 1 1 25 25 ASP C C 25 176.554 176.554 178.158 -1.604 25541
2534 1 11 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.294 0.062 25541
2535 1 11 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.907 -0.865 25541
2536 1 11 . 1 1 25 25 ASP H H 25 8.507 8.507 8.422 0.085 25541
2537 1 11 . 1 1 26 26 THR N N 26 118.299 118.299 115.311 2.988 25541
2538 1 11 . 1 1 26 26 THR HA H 26 3.891 3.891 4.039 -0.148 25541
2539 1 11 . 1 1 26 26 THR C C 26 173.365 173.365 176.474 -3.109 25541
2540 1 11 . 1 1 26 26 THR CA C 26 67.787 67.787 66.834 0.953 25541
2541 1 11 . 1 1 26 26 THR CB C 26 68.120 68.120 69.124 -1.004 25541
2542 1 11 . 1 1 26 26 THR H H 26 7.918 7.918 8.399 -0.481 25541
2543 1 11 . 1 1 27 27 ILE N N 27 122.576 122.576 119.795 2.781 25541
2544 1 11 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.800 -0.175 25541
2545 1 11 . 1 1 27 27 ILE C C 27 174.485 174.485 176.531 -2.046 25541
2546 1 11 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.671 0.040 25541
2547 1 11 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.722 -0.195 25541
2548 1 11 . 1 1 27 27 ILE H H 27 8.159 8.159 7.552 0.607 25541
2549 1 11 . 1 1 28 28 ASN N N 28 115.118 115.118 115.262 -0.144 25541
2550 1 11 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.800 -0.185 25541
2551 1 11 . 1 1 28 28 ASN C C 28 173.902 173.902 175.016 -1.114 25541
2552 1 11 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.505 0.955 25541
2553 1 11 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.083 0.147 25541
2554 1 11 . 1 1 28 28 ASN H H 28 7.713 7.713 7.927 -0.214 25541
2555 1 11 . 1 1 29 29 THR N N 29 107.730 107.730 109.855 -2.125 25541
2556 1 11 . 1 1 29 29 THR HA H 29 4.600 4.600 4.448 0.152 25541
2557 1 11 . 1 1 29 29 THR C C 29 172.290 172.290 174.707 -2.417 25541
2558 1 11 . 1 1 29 29 THR CA C 29 62.595 62.595 62.576 0.019 25541
2559 1 11 . 1 1 29 29 THR CB C 29 72.291 72.291 70.306 1.985 25541
2560 1 11 . 1 1 29 29 THR H H 29 7.587 7.587 7.573 0.014 25541
2561 1 11 . 1 1 30 30 SER N N 30 117.784 117.784 118.434 -0.650 25541
2562 1 11 . 1 1 30 30 SER HA H 30 4.296 4.296 4.567 -0.271 25541
2563 1 11 . 1 1 30 30 SER C C 30 172.473 172.473 173.370 -0.897 25541
2564 1 11 . 1 1 30 30 SER CA C 30 59.618 59.618 58.253 1.365 25541
2565 1 11 . 1 1 30 30 SER CB C 30 64.402 64.402 64.351 0.051 25541
2566 1 11 . 1 1 30 30 SER H H 30 8.698 8.698 8.407 0.291 25541
2567 1 11 . 1 1 31 31 CYS N N 31 121.196 121.196 119.389 1.807 25541
2568 1 11 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.626 0.161 25541
2569 1 11 . 1 1 31 31 CYS C C 31 170.861 170.861 172.406 -1.545 25541
2570 1 11 . 1 1 31 31 CYS CA C 31 57.372 57.372 58.962 -1.590 25541
2571 1 11 . 1 1 31 31 CYS CB C 31 28.364 28.364 28.773 -0.409 25541
2572 1 11 . 1 1 31 31 CYS H H 31 8.713 8.713 8.375 0.338 25541
2573 1 11 . 1 1 32 32 ASP N N 32 124.610 124.610 126.492 -1.882 25541
2574 1 11 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.684 -0.071 25541
2575 1 11 . 1 1 32 32 ASP C C 32 172.541 172.541 175.756 -3.215 25541
2576 1 11 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.049 -0.864 25541
2577 1 11 . 1 1 32 32 ASP CB C 32 41.137 41.137 42.947 -1.810 25541
2578 1 11 . 1 1 32 32 ASP H H 32 8.542 8.542 8.137 0.405 25541
2579 1 11 . 1 1 33 33 ILE N N 33 125.134 125.134 121.150 3.984 25541
2580 1 11 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.116 -0.430 25541
2581 1 11 . 1 1 33 33 ILE C C 33 175.743 175.743 176.127 -0.384 25541
2582 1 11 . 1 1 33 33 ILE CA C 33 64.710 64.710 62.499 2.211 25541
2583 1 11 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.391 0.424 25541
2584 1 11 . 1 1 33 33 ILE H H 33 8.459 8.459 8.595 -0.136 25541
2585 1 11 . 1 1 34 34 GLU N N 34 121.097 121.097 120.200 0.897 25541
2586 1 11 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.349 -0.218 25541
2587 1 11 . 1 1 34 34 GLU C C 34 176.406 176.406 178.246 -1.840 25541
2588 1 11 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.099 1.234 25541
2589 1 11 . 1 1 34 34 GLU CB C 34 29.675 29.675 30.275 -0.600 25541
2590 1 11 . 1 1 34 34 GLU H H 34 8.177 8.177 7.834 0.343 25541
2591 1 11 . 1 1 35 35 LEU N N 35 124.890 124.890 120.608 4.282 25541
2592 1 11 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.754 -0.143 25541
2593 1 11 . 1 1 35 35 LEU C C 35 176.399 176.399 178.902 -2.503 25541
2594 1 11 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.725 -0.657 25541
2595 1 11 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.666 -0.756 25541
2596 1 11 . 1 1 35 35 LEU H H 35 7.831 7.831 7.649 0.182 25541
2597 1 11 . 1 1 36 36 LEU N N 36 120.493 120.493 118.537 1.956 25541
2598 1 11 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.726 -0.067 25541
2599 1 11 . 1 1 36 36 LEU C C 36 176.280 176.280 178.916 -2.636 25541
2600 1 11 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.089 0.526 25541
2601 1 11 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.957 1.512 25541
2602 1 11 . 1 1 36 36 LEU H H 36 8.843 8.843 7.444 1.399 25541
2603 1 11 . 1 1 37 37 ALA N N 37 119.956 119.956 120.723 -0.767 25541
2604 1 11 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.938 0.059 25541
2605 1 11 . 1 1 37 37 ALA C C 37 177.606 177.606 179.488 -1.882 25541
2606 1 11 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.762 0.407 25541
2607 1 11 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.877 -0.257 25541
2608 1 11 . 1 1 37 37 ALA H H 37 7.610 7.610 8.190 -0.580 25541
2609 1 11 . 1 1 38 38 ALA N N 38 121.594 121.594 120.733 0.861 25541
2610 1 11 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.006 0.097 25541
2611 1 11 . 1 1 38 38 ALA C C 38 178.452 178.452 178.637 -0.185 25541
2612 1 11 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.583 0.272 25541
2613 1 11 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.267 -0.207 25541
2614 1 11 . 1 1 38 38 ALA H H 38 7.665 7.665 8.329 -0.664 25541
2615 1 11 . 1 1 39 39 CYS N N 39 119.263 119.263 117.915 1.348 25541
2616 1 11 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.786 -0.055 25541
2617 1 11 . 1 1 39 39 CYS C C 39 173.860 173.860 176.701 -2.841 25541
2618 1 11 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.733 1.090 25541
2619 1 11 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.646 -0.421 25541
2620 1 11 . 1 1 39 39 CYS H H 39 8.766 8.766 8.405 0.361 25541
2621 1 11 . 1 1 40 40 ARG N N 40 119.658 119.658 119.097 0.561 25541
2622 1 11 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.864 0.034 25541
2623 1 11 . 1 1 40 40 ARG C C 40 176.108 176.108 178.570 -2.462 25541
2624 1 11 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.637 0.845 25541
2625 1 11 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.598 0.266 25541
2626 1 11 . 1 1 40 40 ARG H H 40 8.327 8.327 8.290 0.037 25541
2627 1 11 . 1 1 41 41 GLU N N 41 119.358 119.358 118.102 1.256 25541
2628 1 11 . 1 1 41 41 GLU HA H 41 4.099 4.099 3.837 0.262 25541
2629 1 11 . 1 1 41 41 GLU C C 41 171.786 171.786 178.808 -7.022 25541
2630 1 11 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.424 -0.211 25541
2631 1 11 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.074 0.203 25541
2632 1 11 . 1 1 41 41 GLU H H 41 7.929 7.929 7.662 0.267 25541
2633 1 11 . 1 1 42 42 GLU N N 42 121.281 121.281 119.062 2.219 25541
2634 1 11 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.098 0.125 25541
2635 1 11 . 1 1 42 42 GLU C C 42 173.408 173.408 178.908 -5.500 25541
2636 1 11 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.123 0.195 25541
2637 1 11 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.038 -0.823 25541
2638 1 11 . 1 1 42 42 GLU H H 42 7.945 7.945 7.655 0.290 25541
2639 1 11 . 1 1 43 43 PHE N N 43 119.271 119.271 121.089 -1.818 25541
2640 1 11 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.024 0.053 25541
2641 1 11 . 1 1 43 43 PHE C C 43 175.299 175.299 177.411 -2.112 25541
2642 1 11 . 1 1 43 43 PHE CA C 43 61.549 61.549 61.853 -0.304 25541
2643 1 11 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.059 0.075 25541
2644 1 11 . 1 1 43 43 PHE H H 43 8.624 8.624 8.334 0.290 25541
2645 1 11 . 1 1 44 44 HIS N N 44 116.374 116.374 115.697 0.677 25541
2646 1 11 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.451 -0.185 25541
2647 1 11 . 1 1 44 44 HIS C C 44 174.771 174.771 177.835 -3.064 25541
2648 1 11 . 1 1 44 44 HIS CA C 44 59.343 59.343 58.544 0.799 25541
2649 1 11 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.819 -0.331 25541
2650 1 11 . 1 1 44 44 HIS H H 44 7.976 7.976 8.196 -0.220 25541
2651 1 11 . 1 1 45 45 ARG N N 45 120.170 120.170 119.568 0.602 25541
2652 1 11 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.056 -0.110 25541
2653 1 11 . 1 1 45 45 ARG C C 45 176.310 176.310 178.518 -2.208 25541
2654 1 11 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.324 -0.118 25541
2655 1 11 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.856 0.532 25541
2656 1 11 . 1 1 45 45 ARG H H 45 8.166 8.166 8.030 0.136 25541
2657 1 11 . 1 1 46 46 ARG N N 46 116.229 116.229 118.654 -2.425 25541
2658 1 11 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.108 -0.043 25541
2659 1 11 . 1 1 46 46 ARG C C 46 176.046 176.046 178.442 -2.396 25541
2660 1 11 . 1 1 46 46 ARG CA C 46 57.691 57.691 57.671 0.020 25541
2661 1 11 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.333 0.915 25541
2662 1 11 . 1 1 46 46 ARG H H 46 7.764 7.764 7.460 0.304 25541
2663 1 11 . 1 1 47 47 LEU N N 47 119.010 119.010 119.703 -0.693 25541
2664 1 11 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.077 0.058 25541
2665 1 11 . 1 1 47 47 LEU CA C 47 55.957 55.957 57.289 -1.332 25541
2666 1 11 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.353 0.671 25541
2667 1 11 . 1 1 47 47 LEU H H 47 7.557 7.557 7.582 -0.025 25541
2668 1 11 . 1 1 48 48 LYS N N 48 119.277 119.277 117.606 1.671 25541
2669 1 11 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.028 0.047 25541
2670 1 11 . 1 1 48 48 LYS C C 48 176.354 176.354 177.726 -1.372 25541
2671 1 11 . 1 1 48 48 LYS CA C 48 56.655 56.655 58.153 -1.498 25541
2672 1 11 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.674 -0.264 25541
2673 1 11 . 1 1 48 48 LYS H H 48 7.662 7.662 7.615 0.047 25541
2674 1 11 . 1 1 49 49 VAL N N 49 119.095 119.095 118.797 0.298 25541
2675 1 11 . 1 1 49 49 VAL HA H 49 3.972 3.972 3.956 0.016 25541
2676 1 11 . 1 1 49 49 VAL C C 49 174.195 174.195 174.945 -0.750 25541
2677 1 11 . 1 1 49 49 VAL CA C 49 62.214 62.214 60.690 1.524 25541
2678 1 11 . 1 1 49 49 VAL CB C 49 32.747 32.747 32.772 -0.025 25541
2679 1 11 . 1 1 49 49 VAL H H 49 7.688 7.688 7.260 0.428 25541
2680 1 11 . 1 1 50 50 TYR N N 50 123.606 123.606 127.653 -4.047 25541
2681 1 11 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.456 0.026 25541
2682 1 11 . 1 1 50 50 TYR CA C 50 57.855 57.855 56.533 1.322 25541
2683 1 11 . 1 1 50 50 TYR CB C 50 38.721 38.721 36.099 2.622 25541
2684 1 11 . 1 1 50 50 TYR H H 50 8.164 8.164 7.972 0.192 25541
2685 1 12 . 1 1 10 10 THR N N 10 114.351 114.351 113.595 0.756 25541
2686 1 12 . 1 1 10 10 THR HA H 10 4.241 4.241 4.541 -0.300 25541
2687 1 12 . 1 1 10 10 THR C C 10 171.741 171.741 173.166 -1.425 25541
2688 1 12 . 1 1 10 10 THR CA C 10 62.002 62.002 62.216 -0.214 25541
2689 1 12 . 1 1 10 10 THR CB C 10 69.796 69.796 69.668 0.128 25541
2690 1 12 . 1 1 10 10 THR H H 10 8.114 8.114 7.791 0.323 25541
2691 1 12 . 1 1 11 11 LYS N N 11 124.677 124.677 124.256 0.421 25541
2692 1 12 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.259 -0.095 25541
2693 1 12 . 1 1 11 11 LYS C C 11 172.964 172.964 174.555 -1.591 25541
2694 1 12 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.631 -0.509 25541
2695 1 12 . 1 1 11 11 LYS CB C 11 32.819 32.819 33.595 -0.776 25541
2696 1 12 . 1 1 11 11 LYS H H 11 8.436 8.436 8.262 0.174 25541
2697 1 12 . 1 1 12 12 LYS N N 12 123.337 123.337 121.508 1.829 25541
2698 1 12 . 1 1 12 12 LYS HA H 12 4.093 4.093 4.155 -0.062 25541
2699 1 12 . 1 1 12 12 LYS C C 12 173.147 173.147 174.457 -1.310 25541
2700 1 12 . 1 1 12 12 LYS CA C 12 56.327 56.327 55.062 1.265 25541
2701 1 12 . 1 1 12 12 LYS CB C 12 33.223 33.223 33.521 -0.298 25541
2702 1 12 . 1 1 12 12 LYS H H 12 8.239 8.239 7.869 0.370 25541
2703 1 12 . 1 1 13 13 TYR N N 13 119.233 119.233 118.509 0.724 25541
2704 1 12 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.667 -0.266 25541
2705 1 12 . 1 1 13 13 TYR C C 13 172.016 172.016 174.171 -2.155 25541
2706 1 12 . 1 1 13 13 TYR CA C 13 57.325 57.325 57.197 0.128 25541
2707 1 12 . 1 1 13 13 TYR CB C 13 39.864 39.864 41.146 -1.282 25541
2708 1 12 . 1 1 13 13 TYR H H 13 8.274 8.274 8.082 0.192 25541
2709 1 12 . 1 1 14 14 ASP N N 14 120.486 120.486 124.221 -3.735 25541
2710 1 12 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.998 -0.321 25541
2711 1 12 . 1 1 14 14 ASP C C 14 173.276 173.276 176.268 -2.992 25541
2712 1 12 . 1 1 14 14 ASP CA C 14 52.719 52.719 54.192 -1.473 25541
2713 1 12 . 1 1 14 14 ASP CB C 14 40.205 40.205 41.322 -1.117 25541
2714 1 12 . 1 1 14 14 ASP H H 14 8.603 8.603 8.785 -0.182 25541
2715 1 12 . 1 1 15 15 LEU N N 15 126.405 126.405 125.152 1.253 25541
2716 1 12 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.028 -1.263 25541
2717 1 12 . 1 1 15 15 LEU C C 15 175.592 175.592 177.156 -1.564 25541
2718 1 12 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.459 -1.204 25541
2719 1 12 . 1 1 15 15 LEU CB C 15 39.967 39.967 40.955 -0.988 25541
2720 1 12 . 1 1 15 15 LEU H H 15 8.901 8.901 8.586 0.315 25541
2721 1 12 . 1 1 16 16 SER N N 16 116.540 116.540 115.276 1.264 25541
2722 1 12 . 1 1 16 16 SER HA H 16 4.100 4.100 4.227 -0.127 25541
2723 1 12 . 1 1 16 16 SER C C 16 173.247 173.247 175.075 -1.828 25541
2724 1 12 . 1 1 16 16 SER CA C 16 61.720 61.720 60.298 1.422 25541
2725 1 12 . 1 1 16 16 SER CB C 16 62.797 62.797 63.390 -0.593 25541
2726 1 12 . 1 1 16 16 SER H H 16 8.112 8.112 8.057 0.055 25541
2727 1 12 . 1 1 17 17 LYS N N 17 118.008 118.008 120.944 -2.936 25541
2728 1 12 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.616 -0.115 25541
2729 1 12 . 1 1 17 17 LYS C C 17 175.079 175.079 175.098 -0.019 25541
2730 1 12 . 1 1 17 17 LYS CA C 17 55.267 55.267 56.109 -0.842 25541
2731 1 12 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.779 -2.802 25541
2732 1 12 . 1 1 17 17 LYS H H 17 8.521 8.521 8.166 0.355 25541
2733 1 12 . 1 1 18 18 TRP N N 18 122.041 122.041 122.636 -0.595 25541
2734 1 12 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.829 -0.251 25541
2735 1 12 . 1 1 18 18 TRP C C 18 174.862 174.862 174.939 -0.077 25541
2736 1 12 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.226 1.145 25541
2737 1 12 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.375 -3.831 25541
2738 1 12 . 1 1 18 18 TRP H H 18 7.853 7.853 8.530 -0.677 25541
2739 1 12 . 1 1 19 19 LYS N N 19 123.185 123.185 121.769 1.416 25541
2740 1 12 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.700 -0.165 25541
2741 1 12 . 1 1 19 19 LYS C C 19 175.094 175.094 177.003 -1.909 25541
2742 1 12 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.957 0.470 25541
2743 1 12 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.751 -0.631 25541
2744 1 12 . 1 1 19 19 LYS H H 19 9.544 9.544 8.496 1.048 25541
2745 1 12 . 1 1 20 20 TYR N N 20 124.291 124.291 125.880 -1.589 25541
2746 1 12 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.036 -0.011 25541
2747 1 12 . 1 1 20 20 TYR C C 20 174.531 174.531 176.985 -2.454 25541
2748 1 12 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.360 0.789 25541
2749 1 12 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.343 -0.190 25541
2750 1 12 . 1 1 20 20 TYR H H 20 9.266 9.266 9.231 0.035 25541
2751 1 12 . 1 1 21 21 ALA N N 21 117.781 117.781 121.331 -3.550 25541
2752 1 12 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.208 -0.335 25541
2753 1 12 . 1 1 21 21 ALA C C 21 176.314 176.314 179.507 -3.193 25541
2754 1 12 . 1 1 21 21 ALA CA C 21 55.335 55.335 54.909 0.426 25541
2755 1 12 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.839 0.864 25541
2756 1 12 . 1 1 21 21 ALA H H 21 8.986 8.986 8.480 0.506 25541
2757 1 12 . 1 1 22 22 GLU N N 22 115.218 115.218 119.469 -4.251 25541
2758 1 12 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.160 -0.041 25541
2759 1 12 . 1 1 22 22 GLU C C 22 177.380 177.380 179.435 -2.055 25541
2760 1 12 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.460 -0.981 25541
2761 1 12 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.304 0.566 25541
2762 1 12 . 1 1 22 22 GLU H H 22 6.854 6.854 8.470 -1.616 25541
2763 1 12 . 1 1 23 23 LEU N N 23 122.132 122.132 119.466 2.666 25541
2764 1 12 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.003 0.153 25541
2765 1 12 . 1 1 23 23 LEU C C 23 174.830 174.830 179.450 -4.620 25541
2766 1 12 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.340 0.182 25541
2767 1 12 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.624 1.495 25541
2768 1 12 . 1 1 23 23 LEU H H 23 7.909 7.909 8.946 -1.037 25541
2769 1 12 . 1 1 24 24 ARG N N 24 118.051 118.051 118.525 -0.474 25541
2770 1 12 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.877 -0.240 25541
2771 1 12 . 1 1 24 24 ARG C C 24 175.240 175.240 178.114 -2.874 25541
2772 1 12 . 1 1 24 24 ARG CA C 24 58.976 58.976 59.499 -0.523 25541
2773 1 12 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.861 0.001 25541
2774 1 12 . 1 1 24 24 ARG H H 24 8.250 8.250 7.422 0.828 25541
2775 1 12 . 1 1 25 25 ASP N N 25 118.179 118.179 118.966 -0.787 25541
2776 1 12 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.417 -0.032 25541
2777 1 12 . 1 1 25 25 ASP C C 25 176.554 176.554 178.402 -1.848 25541
2778 1 12 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.569 -0.213 25541
2779 1 12 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.916 -0.875 25541
2780 1 12 . 1 1 25 25 ASP H H 25 8.507 8.507 8.600 -0.093 25541
2781 1 12 . 1 1 26 26 THR N N 26 118.299 118.299 115.985 2.314 25541
2782 1 12 . 1 1 26 26 THR HA H 26 3.891 3.891 4.056 -0.165 25541
2783 1 12 . 1 1 26 26 THR C C 26 173.365 173.365 176.704 -3.339 25541
2784 1 12 . 1 1 26 26 THR CA C 26 67.787 67.787 66.389 1.397 25541
2785 1 12 . 1 1 26 26 THR CB C 26 68.120 68.120 68.754 -0.634 25541
2786 1 12 . 1 1 26 26 THR H H 26 7.918 7.918 8.482 -0.564 25541
2787 1 12 . 1 1 27 27 ILE N N 27 122.576 122.576 119.702 2.874 25541
2788 1 12 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.840 -0.215 25541
2789 1 12 . 1 1 27 27 ILE C C 27 174.485 174.485 176.522 -2.037 25541
2790 1 12 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.245 0.466 25541
2791 1 12 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.683 -0.156 25541
2792 1 12 . 1 1 27 27 ILE H H 27 8.159 8.159 7.277 0.882 25541
2793 1 12 . 1 1 28 28 ASN N N 28 115.118 115.118 116.018 -0.900 25541
2794 1 12 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.761 -0.146 25541
2795 1 12 . 1 1 28 28 ASN C C 28 173.902 173.902 174.983 -1.081 25541
2796 1 12 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.837 0.623 25541
2797 1 12 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.526 -0.296 25541
2798 1 12 . 1 1 28 28 ASN H H 28 7.713 7.713 7.868 -0.155 25541
2799 1 12 . 1 1 29 29 THR N N 29 107.730 107.730 110.826 -3.096 25541
2800 1 12 . 1 1 29 29 THR HA H 29 4.600 4.600 4.445 0.155 25541
2801 1 12 . 1 1 29 29 THR C C 29 172.290 172.290 174.829 -2.539 25541
2802 1 12 . 1 1 29 29 THR CA C 29 62.595 62.595 62.395 0.200 25541
2803 1 12 . 1 1 29 29 THR CB C 29 72.291 72.291 70.168 2.123 25541
2804 1 12 . 1 1 29 29 THR H H 29 7.587 7.587 7.454 0.133 25541
2805 1 12 . 1 1 30 30 SER N N 30 117.784 117.784 117.245 0.539 25541
2806 1 12 . 1 1 30 30 SER HA H 30 4.296 4.296 4.684 -0.388 25541
2807 1 12 . 1 1 30 30 SER C C 30 172.473 172.473 173.422 -0.949 25541
2808 1 12 . 1 1 30 30 SER CA C 30 59.618 59.618 57.829 1.789 25541
2809 1 12 . 1 1 30 30 SER CB C 30 64.402 64.402 64.495 -0.093 25541
2810 1 12 . 1 1 30 30 SER H H 30 8.698 8.698 8.385 0.313 25541
2811 1 12 . 1 1 31 31 CYS N N 31 121.196 121.196 117.906 3.290 25541
2812 1 12 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.759 0.028 25541
2813 1 12 . 1 1 31 31 CYS C C 31 170.861 170.861 172.499 -1.638 25541
2814 1 12 . 1 1 31 31 CYS CA C 31 57.372 57.372 58.686 -1.314 25541
2815 1 12 . 1 1 31 31 CYS CB C 31 28.364 28.364 29.862 -1.498 25541
2816 1 12 . 1 1 31 31 CYS H H 31 8.713 8.713 8.259 0.454 25541
2817 1 12 . 1 1 32 32 ASP N N 32 124.610 124.610 123.280 1.330 25541
2818 1 12 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.755 -0.142 25541
2819 1 12 . 1 1 32 32 ASP C C 32 172.541 172.541 175.560 -3.019 25541
2820 1 12 . 1 1 32 32 ASP CA C 32 53.185 53.185 53.906 -0.721 25541
2821 1 12 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.156 -2.019 25541
2822 1 12 . 1 1 32 32 ASP H H 32 8.542 8.542 8.198 0.344 25541
2823 1 12 . 1 1 33 33 ILE N N 33 125.134 125.134 121.346 3.788 25541
2824 1 12 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.037 -0.351 25541
2825 1 12 . 1 1 33 33 ILE C C 33 175.743 175.743 176.076 -0.333 25541
2826 1 12 . 1 1 33 33 ILE CA C 33 64.710 64.710 62.901 1.809 25541
2827 1 12 . 1 1 33 33 ILE CB C 33 37.815 37.815 38.096 -0.281 25541
2828 1 12 . 1 1 33 33 ILE H H 33 8.459 8.459 8.557 -0.098 25541
2829 1 12 . 1 1 34 34 GLU N N 34 121.097 121.097 119.901 1.196 25541
2830 1 12 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.343 -0.211 25541
2831 1 12 . 1 1 34 34 GLU C C 34 176.406 176.406 178.058 -1.652 25541
2832 1 12 . 1 1 34 34 GLU CA C 34 59.333 59.333 57.944 1.389 25541
2833 1 12 . 1 1 34 34 GLU CB C 34 29.675 29.675 30.179 -0.504 25541
2834 1 12 . 1 1 34 34 GLU H H 34 8.177 8.177 7.801 0.376 25541
2835 1 12 . 1 1 35 35 LEU N N 35 124.890 124.890 120.776 4.114 25541
2836 1 12 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.872 -0.261 25541
2837 1 12 . 1 1 35 35 LEU C C 35 176.399 176.399 178.901 -2.502 25541
2838 1 12 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.836 -0.768 25541
2839 1 12 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.701 -0.791 25541
2840 1 12 . 1 1 35 35 LEU H H 35 7.831 7.831 7.745 0.086 25541
2841 1 12 . 1 1 36 36 LEU N N 36 120.493 120.493 118.664 1.829 25541
2842 1 12 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.754 -0.095 25541
2843 1 12 . 1 1 36 36 LEU C C 36 176.280 176.280 178.963 -2.683 25541
2844 1 12 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.100 0.515 25541
2845 1 12 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.969 1.500 25541
2846 1 12 . 1 1 36 36 LEU H H 36 8.843 8.843 7.468 1.375 25541
2847 1 12 . 1 1 37 37 ALA N N 37 119.956 119.956 120.734 -0.778 25541
2848 1 12 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.955 0.042 25541
2849 1 12 . 1 1 37 37 ALA C C 37 177.606 177.606 179.512 -1.906 25541
2850 1 12 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.765 0.404 25541
2851 1 12 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.870 -0.250 25541
2852 1 12 . 1 1 37 37 ALA H H 37 7.610 7.610 8.210 -0.600 25541
2853 1 12 . 1 1 38 38 ALA N N 38 121.594 121.594 120.674 0.920 25541
2854 1 12 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.016 0.087 25541
2855 1 12 . 1 1 38 38 ALA C C 38 178.452 178.452 178.660 -0.208 25541
2856 1 12 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.614 0.241 25541
2857 1 12 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.520 -0.460 25541
2858 1 12 . 1 1 38 38 ALA H H 38 7.665 7.665 8.473 -0.808 25541
2859 1 12 . 1 1 39 39 CYS N N 39 119.263 119.263 118.350 0.913 25541
2860 1 12 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.947 -0.216 25541
2861 1 12 . 1 1 39 39 CYS C C 39 173.860 173.860 176.724 -2.864 25541
2862 1 12 . 1 1 39 39 CYS CA C 39 63.823 63.823 60.824 2.999 25541
2863 1 12 . 1 1 39 39 CYS CB C 39 27.225 27.225 26.684 0.541 25541
2864 1 12 . 1 1 39 39 CYS H H 39 8.766 8.766 8.496 0.270 25541
2865 1 12 . 1 1 40 40 ARG N N 40 119.658 119.658 119.581 0.077 25541
2866 1 12 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.899 -0.001 25541
2867 1 12 . 1 1 40 40 ARG C C 40 176.108 176.108 178.642 -2.534 25541
2868 1 12 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.995 0.487 25541
2869 1 12 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.603 0.261 25541
2870 1 12 . 1 1 40 40 ARG H H 40 8.327 8.327 8.446 -0.119 25541
2871 1 12 . 1 1 41 41 GLU N N 41 119.358 119.358 117.913 1.445 25541
2872 1 12 . 1 1 41 41 GLU HA H 41 4.099 4.099 3.893 0.206 25541
2873 1 12 . 1 1 41 41 GLU C C 41 171.786 171.786 178.922 -7.136 25541
2874 1 12 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.493 -0.280 25541
2875 1 12 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.083 0.194 25541
2876 1 12 . 1 1 41 41 GLU H H 41 7.929 7.929 7.713 0.216 25541
2877 1 12 . 1 1 42 42 GLU N N 42 121.281 121.281 119.187 2.094 25541
2878 1 12 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.161 0.062 25541
2879 1 12 . 1 1 42 42 GLU C C 42 173.408 173.408 178.796 -5.388 25541
2880 1 12 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.120 0.199 25541
2881 1 12 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.139 -0.924 25541
2882 1 12 . 1 1 42 42 GLU H H 42 7.945 7.945 7.624 0.321 25541
2883 1 12 . 1 1 43 43 PHE N N 43 119.271 119.271 122.645 -3.374 25541
2884 1 12 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.016 0.061 25541
2885 1 12 . 1 1 43 43 PHE C C 43 175.299 175.299 177.475 -2.176 25541
2886 1 12 . 1 1 43 43 PHE CA C 43 61.549 61.549 62.704 -1.155 25541
2887 1 12 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.115 0.019 25541
2888 1 12 . 1 1 43 43 PHE H H 43 8.624 8.624 8.823 -0.199 25541
2889 1 12 . 1 1 44 44 HIS N N 44 116.374 116.374 116.399 -0.025 25541
2890 1 12 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.279 -0.013 25541
2891 1 12 . 1 1 44 44 HIS C C 44 174.771 174.771 178.153 -3.382 25541
2892 1 12 . 1 1 44 44 HIS CA C 44 59.343 59.343 59.307 0.036 25541
2893 1 12 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.739 -0.251 25541
2894 1 12 . 1 1 44 44 HIS H H 44 7.976 7.976 8.554 -0.578 25541
2895 1 12 . 1 1 45 45 ARG N N 45 120.170 120.170 119.297 0.873 25541
2896 1 12 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.139 -0.193 25541
2897 1 12 . 1 1 45 45 ARG C C 45 176.310 176.310 179.125 -2.815 25541
2898 1 12 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.005 0.201 25541
2899 1 12 . 1 1 45 45 ARG CB C 45 30.388 30.388 30.142 0.246 25541
2900 1 12 . 1 1 45 45 ARG H H 45 8.166 8.166 7.529 0.637 25541
2901 1 12 . 1 1 46 46 ARG N N 46 116.229 116.229 119.791 -3.562 25541
2902 1 12 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.038 0.027 25541
2903 1 12 . 1 1 46 46 ARG C C 46 176.046 176.046 178.002 -1.956 25541
2904 1 12 . 1 1 46 46 ARG CA C 46 57.691 57.691 58.820 -1.129 25541
2905 1 12 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.670 0.578 25541
2906 1 12 . 1 1 46 46 ARG H H 46 7.764 7.764 8.442 -0.678 25541
2907 1 12 . 1 1 47 47 LEU N N 47 119.010 119.010 117.276 1.734 25541
2908 1 12 . 1 1 47 47 LEU HA H 47 4.135 4.135 3.971 0.164 25541
2909 1 12 . 1 1 47 47 LEU CA C 47 55.957 55.957 56.714 -0.757 25541
2910 1 12 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.721 0.303 25541
2911 1 12 . 1 1 47 47 LEU H H 47 7.557 7.557 7.753 -0.196 25541
2912 1 12 . 1 1 48 48 LYS N N 48 119.277 119.277 118.660 0.617 25541
2913 1 12 . 1 1 48 48 LYS HA H 48 4.075 4.075 3.989 0.086 25541
2914 1 12 . 1 1 48 48 LYS C C 48 176.354 176.354 177.600 -1.246 25541
2915 1 12 . 1 1 48 48 LYS CA C 48 56.655 56.655 58.596 -1.941 25541
2916 1 12 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.644 -0.234 25541
2917 1 12 . 1 1 48 48 LYS H H 48 7.662 7.662 7.874 -0.212 25541
2918 1 12 . 1 1 49 49 VAL N N 49 119.095 119.095 114.489 4.606 25541
2919 1 12 . 1 1 49 49 VAL HA H 49 3.972 3.972 3.861 0.111 25541
2920 1 12 . 1 1 49 49 VAL C C 49 174.195 174.195 175.390 -1.195 25541
2921 1 12 . 1 1 49 49 VAL CA C 49 62.214 62.214 61.148 1.066 25541
2922 1 12 . 1 1 49 49 VAL CB C 49 32.747 32.747 31.481 1.266 25541
2923 1 12 . 1 1 49 49 VAL H H 49 7.688 7.688 7.429 0.259 25541
2924 1 12 . 1 1 50 50 TYR N N 50 123.606 123.606 113.351 10.255 25541
2925 1 12 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.180 0.302 25541
2926 1 12 . 1 1 50 50 TYR CA C 50 57.855 57.855 58.964 -1.109 25541
2927 1 12 . 1 1 50 50 TYR CB C 50 38.721 38.721 35.251 3.470 25541
2928 1 12 . 1 1 50 50 TYR H H 50 8.164 8.164 7.911 0.253 25541
2929 1 13 . 1 1 10 10 THR N N 10 114.351 114.351 113.547 0.804 25541
2930 1 13 . 1 1 10 10 THR HA H 10 4.241 4.241 4.481 -0.240 25541
2931 1 13 . 1 1 10 10 THR C C 10 171.741 171.741 172.937 -1.196 25541
2932 1 13 . 1 1 10 10 THR CA C 10 62.002 62.002 61.819 0.183 25541
2933 1 13 . 1 1 10 10 THR CB C 10 69.796 69.796 70.006 -0.210 25541
2934 1 13 . 1 1 10 10 THR H H 10 8.114 8.114 8.064 0.050 25541
2935 1 13 . 1 1 11 11 LYS N N 11 124.677 124.677 122.871 1.806 25541
2936 1 13 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.429 -0.265 25541
2937 1 13 . 1 1 11 11 LYS C C 11 172.964 172.964 175.368 -2.404 25541
2938 1 13 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.345 -0.223 25541
2939 1 13 . 1 1 11 11 LYS CB C 11 32.819 32.819 32.428 0.391 25541
2940 1 13 . 1 1 11 11 LYS H H 11 8.436 8.436 8.462 -0.026 25541
2941 1 13 . 1 1 12 12 LYS N N 12 123.337 123.337 123.876 -0.539 25541
2942 1 13 . 1 1 12 12 LYS HA H 12 4.093 4.093 4.112 -0.019 25541
2943 1 13 . 1 1 12 12 LYS C C 12 173.147 173.147 175.237 -2.090 25541
2944 1 13 . 1 1 12 12 LYS CA C 12 56.327 56.327 55.178 1.149 25541
2945 1 13 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.530 0.693 25541
2946 1 13 . 1 1 12 12 LYS H H 12 8.239 8.239 8.043 0.196 25541
2947 1 13 . 1 1 13 13 TYR N N 13 119.233 119.233 118.279 0.954 25541
2948 1 13 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.718 -0.317 25541
2949 1 13 . 1 1 13 13 TYR C C 13 172.016 172.016 174.976 -2.960 25541
2950 1 13 . 1 1 13 13 TYR CA C 13 57.325 57.325 57.326 -0.001 25541
2951 1 13 . 1 1 13 13 TYR CB C 13 39.864 39.864 40.530 -0.666 25541
2952 1 13 . 1 1 13 13 TYR H H 13 8.274 8.274 8.394 -0.120 25541
2953 1 13 . 1 1 14 14 ASP N N 14 120.486 120.486 121.787 -1.301 25541
2954 1 13 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.833 -0.156 25541
2955 1 13 . 1 1 14 14 ASP C C 14 173.276 173.276 176.796 -3.520 25541
2956 1 13 . 1 1 14 14 ASP CA C 14 52.719 52.719 53.799 -1.080 25541
2957 1 13 . 1 1 14 14 ASP CB C 14 40.205 40.205 40.936 -0.731 25541
2958 1 13 . 1 1 14 14 ASP H H 14 8.603 8.603 8.719 -0.116 25541
2959 1 13 . 1 1 15 15 LEU N N 15 126.405 126.405 125.318 1.087 25541
2960 1 13 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.026 -1.261 25541
2961 1 13 . 1 1 15 15 LEU C C 15 175.592 175.592 177.224 -1.632 25541
2962 1 13 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.333 -1.078 25541
2963 1 13 . 1 1 15 15 LEU CB C 15 39.967 39.967 40.604 -0.637 25541
2964 1 13 . 1 1 15 15 LEU H H 15 8.901 8.901 8.642 0.259 25541
2965 1 13 . 1 1 16 16 SER N N 16 116.540 116.540 115.357 1.183 25541
2966 1 13 . 1 1 16 16 SER HA H 16 4.100 4.100 4.181 -0.081 25541
2967 1 13 . 1 1 16 16 SER C C 16 173.247 173.247 174.588 -1.341 25541
2968 1 13 . 1 1 16 16 SER CA C 16 61.720 61.720 60.627 1.093 25541
2969 1 13 . 1 1 16 16 SER CB C 16 62.797 62.797 63.471 -0.674 25541
2970 1 13 . 1 1 16 16 SER H H 16 8.112 8.112 8.539 -0.427 25541
2971 1 13 . 1 1 17 17 LYS N N 17 118.008 118.008 118.399 -0.391 25541
2972 1 13 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.600 -0.099 25541
2973 1 13 . 1 1 17 17 LYS C C 17 175.079 175.079 175.059 0.020 25541
2974 1 13 . 1 1 17 17 LYS CA C 17 55.267 55.267 56.332 -1.065 25541
2975 1 13 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.283 -2.306 25541
2976 1 13 . 1 1 17 17 LYS H H 17 8.521 8.521 7.834 0.687 25541
2977 1 13 . 1 1 18 18 TRP N N 18 122.041 122.041 122.583 -0.542 25541
2978 1 13 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.835 -0.257 25541
2979 1 13 . 1 1 18 18 TRP C C 18 174.862 174.862 174.966 -0.104 25541
2980 1 13 . 1 1 18 18 TRP CA C 18 58.371 58.371 56.911 1.460 25541
2981 1 13 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.528 -3.984 25541
2982 1 13 . 1 1 18 18 TRP H H 18 7.853 7.853 8.406 -0.553 25541
2983 1 13 . 1 1 19 19 LYS N N 19 123.185 123.185 120.003 3.182 25541
2984 1 13 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.732 -0.197 25541
2985 1 13 . 1 1 19 19 LYS C C 19 175.094 175.094 177.028 -1.934 25541
2986 1 13 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.565 0.862 25541
2987 1 13 . 1 1 19 19 LYS CB C 19 33.120 33.120 34.399 -1.279 25541
2988 1 13 . 1 1 19 19 LYS H H 19 9.544 9.544 8.280 1.264 25541
2989 1 13 . 1 1 20 20 TYR N N 20 124.291 124.291 125.595 -1.304 25541
2990 1 13 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.073 -0.048 25541
2991 1 13 . 1 1 20 20 TYR C C 20 174.531 174.531 177.103 -2.572 25541
2992 1 13 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.517 0.631 25541
2993 1 13 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.331 -0.178 25541
2994 1 13 . 1 1 20 20 TYR H H 20 9.266 9.266 9.224 0.042 25541
2995 1 13 . 1 1 21 21 ALA N N 21 117.781 117.781 120.569 -2.788 25541
2996 1 13 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.297 -0.424 25541
2997 1 13 . 1 1 21 21 ALA C C 21 176.314 176.314 179.907 -3.593 25541
2998 1 13 . 1 1 21 21 ALA CA C 21 55.335 55.335 55.188 0.147 25541
2999 1 13 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.881 0.822 25541
3000 1 13 . 1 1 21 21 ALA H H 21 8.986 8.986 8.584 0.402 25541
3001 1 13 . 1 1 22 22 GLU N N 22 115.218 115.218 119.522 -4.304 25541
3002 1 13 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.181 -0.062 25541
3003 1 13 . 1 1 22 22 GLU C C 22 177.380 177.380 179.351 -1.971 25541
3004 1 13 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.295 -0.816 25541
3005 1 13 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.477 0.393 25541
3006 1 13 . 1 1 22 22 GLU H H 22 6.854 6.854 7.650 -0.796 25541
3007 1 13 . 1 1 23 23 LEU N N 23 122.132 122.132 120.371 1.761 25541
3008 1 13 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.116 0.040 25541
3009 1 13 . 1 1 23 23 LEU C C 23 174.830 174.830 179.598 -4.768 25541
3010 1 13 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.198 0.324 25541
3011 1 13 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.729 1.390 25541
3012 1 13 . 1 1 23 23 LEU H H 23 7.909 7.909 9.020 -1.111 25541
3013 1 13 . 1 1 24 24 ARG N N 24 118.051 118.051 118.724 -0.673 25541
3014 1 13 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.867 -0.230 25541
3015 1 13 . 1 1 24 24 ARG C C 24 175.240 175.240 178.354 -3.114 25541
3016 1 13 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.328 0.648 25541
3017 1 13 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.616 0.246 25541
3018 1 13 . 1 1 24 24 ARG H H 24 8.250 8.250 7.881 0.369 25541
3019 1 13 . 1 1 25 25 ASP N N 25 118.179 118.179 118.000 0.179 25541
3020 1 13 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.509 -0.124 25541
3021 1 13 . 1 1 25 25 ASP C C 25 176.554 176.554 177.977 -1.423 25541
3022 1 13 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.109 0.247 25541
3023 1 13 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.960 -0.918 25541
3024 1 13 . 1 1 25 25 ASP H H 25 8.507 8.507 8.300 0.207 25541
3025 1 13 . 1 1 26 26 THR N N 26 118.299 118.299 116.152 2.147 25541
3026 1 13 . 1 1 26 26 THR HA H 26 3.891 3.891 4.038 -0.147 25541
3027 1 13 . 1 1 26 26 THR C C 26 173.365 173.365 176.397 -3.032 25541
3028 1 13 . 1 1 26 26 THR CA C 26 67.787 67.787 66.561 1.226 25541
3029 1 13 . 1 1 26 26 THR CB C 26 68.120 68.120 68.923 -0.803 25541
3030 1 13 . 1 1 26 26 THR H H 26 7.918 7.918 8.311 -0.393 25541
3031 1 13 . 1 1 27 27 ILE N N 27 122.576 122.576 118.582 3.994 25541
3032 1 13 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.786 -0.161 25541
3033 1 13 . 1 1 27 27 ILE C C 27 174.485 174.485 176.337 -1.852 25541
3034 1 13 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.448 0.263 25541
3035 1 13 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.565 -0.038 25541
3036 1 13 . 1 1 27 27 ILE H H 27 8.159 8.159 7.405 0.754 25541
3037 1 13 . 1 1 28 28 ASN N N 28 115.118 115.118 116.197 -1.079 25541
3038 1 13 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.765 -0.150 25541
3039 1 13 . 1 1 28 28 ASN C C 28 173.902 173.902 174.899 -0.997 25541
3040 1 13 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.721 0.739 25541
3041 1 13 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.322 -0.091 25541
3042 1 13 . 1 1 28 28 ASN H H 28 7.713 7.713 7.674 0.039 25541
3043 1 13 . 1 1 29 29 THR N N 29 107.730 107.730 109.732 -2.002 25541
3044 1 13 . 1 1 29 29 THR HA H 29 4.600 4.600 4.412 0.188 25541
3045 1 13 . 1 1 29 29 THR C C 29 172.290 172.290 174.672 -2.382 25541
3046 1 13 . 1 1 29 29 THR CA C 29 62.595 62.595 62.786 -0.191 25541
3047 1 13 . 1 1 29 29 THR CB C 29 72.291 72.291 70.143 2.148 25541
3048 1 13 . 1 1 29 29 THR H H 29 7.587 7.587 7.558 0.029 25541
3049 1 13 . 1 1 30 30 SER N N 30 117.784 117.784 118.623 -0.839 25541
3050 1 13 . 1 1 30 30 SER HA H 30 4.296 4.296 4.625 -0.329 25541
3051 1 13 . 1 1 30 30 SER C C 30 172.473 172.473 173.271 -0.798 25541
3052 1 13 . 1 1 30 30 SER CA C 30 59.618 59.618 58.294 1.324 25541
3053 1 13 . 1 1 30 30 SER CB C 30 64.402 64.402 64.144 0.258 25541
3054 1 13 . 1 1 30 30 SER H H 30 8.698 8.698 8.383 0.315 25541
3055 1 13 . 1 1 31 31 CYS N N 31 121.196 121.196 117.083 4.113 25541
3056 1 13 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.727 0.060 25541
3057 1 13 . 1 1 31 31 CYS C C 31 170.861 170.861 172.343 -1.482 25541
3058 1 13 . 1 1 31 31 CYS CA C 31 57.372 57.372 58.530 -1.158 25541
3059 1 13 . 1 1 31 31 CYS CB C 31 28.364 28.364 30.542 -2.178 25541
3060 1 13 . 1 1 31 31 CYS H H 31 8.713 8.713 8.140 0.573 25541
3061 1 13 . 1 1 32 32 ASP N N 32 124.610 124.610 124.063 0.547 25541
3062 1 13 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.727 -0.114 25541
3063 1 13 . 1 1 32 32 ASP C C 32 172.541 172.541 175.712 -3.171 25541
3064 1 13 . 1 1 32 32 ASP CA C 32 53.185 53.185 53.951 -0.766 25541
3065 1 13 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.463 -2.326 25541
3066 1 13 . 1 1 32 32 ASP H H 32 8.542 8.542 8.374 0.168 25541
3067 1 13 . 1 1 33 33 ILE N N 33 125.134 125.134 122.887 2.247 25541
3068 1 13 . 1 1 33 33 ILE HA H 33 3.686 3.686 3.859 -0.173 25541
3069 1 13 . 1 1 33 33 ILE C C 33 175.743 175.743 176.230 -0.487 25541
3070 1 13 . 1 1 33 33 ILE CA C 33 64.710 64.710 63.136 1.574 25541
3071 1 13 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.956 -0.141 25541
3072 1 13 . 1 1 33 33 ILE H H 33 8.459 8.459 8.517 -0.058 25541
3073 1 13 . 1 1 34 34 GLU N N 34 121.097 121.097 118.801 2.296 25541
3074 1 13 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.331 -0.200 25541
3075 1 13 . 1 1 34 34 GLU C C 34 176.406 176.406 178.004 -1.598 25541
3076 1 13 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.275 1.058 25541
3077 1 13 . 1 1 34 34 GLU CB C 34 29.675 29.675 29.597 0.078 25541
3078 1 13 . 1 1 34 34 GLU H H 34 8.177 8.177 8.006 0.171 25541
3079 1 13 . 1 1 35 35 LEU N N 35 124.890 124.890 121.783 3.107 25541
3080 1 13 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.846 -0.235 25541
3081 1 13 . 1 1 35 35 LEU C C 35 176.399 176.399 179.092 -2.693 25541
3082 1 13 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.668 -0.600 25541
3083 1 13 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.577 -0.667 25541
3084 1 13 . 1 1 35 35 LEU H H 35 7.831 7.831 7.971 -0.140 25541
3085 1 13 . 1 1 36 36 LEU N N 36 120.493 120.493 118.534 1.959 25541
3086 1 13 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.750 -0.091 25541
3087 1 13 . 1 1 36 36 LEU C C 36 176.280 176.280 178.994 -2.714 25541
3088 1 13 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.175 0.440 25541
3089 1 13 . 1 1 36 36 LEU CB C 36 42.469 42.469 41.005 1.464 25541
3090 1 13 . 1 1 36 36 LEU H H 36 8.843 8.843 7.770 1.073 25541
3091 1 13 . 1 1 37 37 ALA N N 37 119.956 119.956 120.387 -0.431 25541
3092 1 13 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.921 0.076 25541
3093 1 13 . 1 1 37 37 ALA C C 37 177.606 177.606 179.182 -1.576 25541
3094 1 13 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.525 0.644 25541
3095 1 13 . 1 1 37 37 ALA CB C 37 17.620 17.620 18.038 -0.418 25541
3096 1 13 . 1 1 37 37 ALA H H 37 7.610 7.610 8.169 -0.559 25541
3097 1 13 . 1 1 38 38 ALA N N 38 121.594 121.594 120.599 0.995 25541
3098 1 13 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.128 -0.025 25541
3099 1 13 . 1 1 38 38 ALA C C 38 178.452 178.452 178.943 -0.491 25541
3100 1 13 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.491 0.364 25541
3101 1 13 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.364 -0.304 25541
3102 1 13 . 1 1 38 38 ALA H H 38 7.665 7.665 8.462 -0.797 25541
3103 1 13 . 1 1 39 39 CYS N N 39 119.263 119.263 118.130 1.133 25541
3104 1 13 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.845 -0.114 25541
3105 1 13 . 1 1 39 39 CYS C C 39 173.860 173.860 176.609 -2.749 25541
3106 1 13 . 1 1 39 39 CYS CA C 39 63.823 63.823 63.118 0.705 25541
3107 1 13 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.771 -0.546 25541
3108 1 13 . 1 1 39 39 CYS H H 39 8.766 8.766 8.504 0.262 25541
3109 1 13 . 1 1 40 40 ARG N N 40 119.658 119.658 119.391 0.267 25541
3110 1 13 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.885 0.013 25541
3111 1 13 . 1 1 40 40 ARG C C 40 176.108 176.108 178.873 -2.765 25541
3112 1 13 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.965 0.517 25541
3113 1 13 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.836 0.028 25541
3114 1 13 . 1 1 40 40 ARG H H 40 8.327 8.327 8.427 -0.100 25541
3115 1 13 . 1 1 41 41 GLU N N 41 119.358 119.358 118.183 1.175 25541
3116 1 13 . 1 1 41 41 GLU HA H 41 4.099 4.099 4.127 -0.028 25541
3117 1 13 . 1 1 41 41 GLU C C 41 171.786 171.786 178.848 -7.062 25541
3118 1 13 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.437 -0.224 25541
3119 1 13 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.129 0.148 25541
3120 1 13 . 1 1 41 41 GLU H H 41 7.929 7.929 7.747 0.182 25541
3121 1 13 . 1 1 42 42 GLU N N 42 121.281 121.281 119.890 1.391 25541
3122 1 13 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.134 0.089 25541
3123 1 13 . 1 1 42 42 GLU C C 42 173.408 173.408 178.877 -5.469 25541
3124 1 13 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.778 -0.459 25541
3125 1 13 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.449 -1.234 25541
3126 1 13 . 1 1 42 42 GLU H H 42 7.945 7.945 7.713 0.232 25541
3127 1 13 . 1 1 43 43 PHE N N 43 119.271 119.271 121.394 -2.123 25541
3128 1 13 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.005 0.072 25541
3129 1 13 . 1 1 43 43 PHE C C 43 175.299 175.299 177.239 -1.940 25541
3130 1 13 . 1 1 43 43 PHE CA C 43 61.549 61.549 62.276 -0.727 25541
3131 1 13 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.024 0.110 25541
3132 1 13 . 1 1 43 43 PHE H H 43 8.624 8.624 8.729 -0.105 25541
3133 1 13 . 1 1 44 44 HIS N N 44 116.374 116.374 117.805 -1.431 25541
3134 1 13 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.198 0.068 25541
3135 1 13 . 1 1 44 44 HIS C C 44 174.771 174.771 177.808 -3.037 25541
3136 1 13 . 1 1 44 44 HIS CA C 44 59.343 59.343 59.558 -0.215 25541
3137 1 13 . 1 1 44 44 HIS CB C 44 29.488 29.488 30.118 -0.630 25541
3138 1 13 . 1 1 44 44 HIS H H 44 7.976 7.976 8.341 -0.365 25541
3139 1 13 . 1 1 45 45 ARG N N 45 120.170 120.170 118.834 1.336 25541
3140 1 13 . 1 1 45 45 ARG HA H 45 3.946 3.946 3.962 -0.016 25541
3141 1 13 . 1 1 45 45 ARG C C 45 176.310 176.310 178.653 -2.343 25541
3142 1 13 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.268 -0.062 25541
3143 1 13 . 1 1 45 45 ARG CB C 45 30.388 30.388 30.065 0.323 25541
3144 1 13 . 1 1 45 45 ARG H H 45 8.166 8.166 7.562 0.604 25541
3145 1 13 . 1 1 46 46 ARG N N 46 116.229 116.229 118.614 -2.385 25541
3146 1 13 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.013 0.052 25541
3147 1 13 . 1 1 46 46 ARG C C 46 176.046 176.046 178.512 -2.466 25541
3148 1 13 . 1 1 46 46 ARG CA C 46 57.691 57.691 58.537 -0.846 25541
3149 1 13 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.620 0.628 25541
3150 1 13 . 1 1 46 46 ARG H H 46 7.764 7.764 8.108 -0.344 25541
3151 1 13 . 1 1 47 47 LEU N N 47 119.010 119.010 118.362 0.648 25541
3152 1 13 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.035 0.100 25541
3153 1 13 . 1 1 47 47 LEU CA C 47 55.957 55.957 56.910 -0.953 25541
3154 1 13 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.995 0.029 25541
3155 1 13 . 1 1 47 47 LEU H H 47 7.557 7.557 7.696 -0.139 25541
3156 1 13 . 1 1 48 48 LYS N N 48 119.277 119.277 118.527 0.750 25541
3157 1 13 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.153 -0.078 25541
3158 1 13 . 1 1 48 48 LYS C C 48 176.354 176.354 177.014 -0.660 25541
3159 1 13 . 1 1 48 48 LYS CA C 48 56.655 56.655 57.813 -1.158 25541
3160 1 13 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.983 -0.573 25541
3161 1 13 . 1 1 48 48 LYS H H 48 7.662 7.662 7.602 0.060 25541
3162 1 13 . 1 1 49 49 VAL N N 49 119.095 119.095 116.095 3.000 25541
3163 1 13 . 1 1 49 49 VAL HA H 49 3.972 3.972 3.733 0.239 25541
3164 1 13 . 1 1 49 49 VAL C C 49 174.195 174.195 175.326 -1.131 25541
3165 1 13 . 1 1 49 49 VAL CA C 49 62.214 62.214 63.347 -1.133 25541
3166 1 13 . 1 1 49 49 VAL CB C 49 32.747 32.747 31.161 1.586 25541
3167 1 13 . 1 1 49 49 VAL H H 49 7.688 7.688 8.137 -0.449 25541
3168 1 13 . 1 1 50 50 TYR N N 50 123.606 123.606 123.946 -0.340 25541
3169 1 13 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.678 -0.196 25541
3170 1 13 . 1 1 50 50 TYR CA C 50 57.855 57.855 56.401 1.454 25541
3171 1 13 . 1 1 50 50 TYR CB C 50 38.721 38.721 38.416 0.305 25541
3172 1 13 . 1 1 50 50 TYR H H 50 8.164 8.164 8.094 0.070 25541
3173 1 14 . 1 1 10 10 THR N N 10 114.351 114.351 113.320 1.031 25541
3174 1 14 . 1 1 10 10 THR HA H 10 4.241 4.241 4.693 -0.452 25541
3175 1 14 . 1 1 10 10 THR C C 10 171.741 171.741 172.941 -1.200 25541
3176 1 14 . 1 1 10 10 THR CA C 10 62.002 62.002 61.514 0.488 25541
3177 1 14 . 1 1 10 10 THR CB C 10 69.796 69.796 70.780 -0.984 25541
3178 1 14 . 1 1 10 10 THR H H 10 8.114 8.114 8.102 0.012 25541
3179 1 14 . 1 1 11 11 LYS N N 11 124.677 124.677 119.673 5.004 25541
3180 1 14 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.452 -0.288 25541
3181 1 14 . 1 1 11 11 LYS C C 11 172.964 172.964 174.378 -1.414 25541
3182 1 14 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.312 -0.190 25541
3183 1 14 . 1 1 11 11 LYS CB C 11 32.819 32.819 33.990 -1.171 25541
3184 1 14 . 1 1 11 11 LYS H H 11 8.436 8.436 8.337 0.099 25541
3185 1 14 . 1 1 12 12 LYS N N 12 123.337 123.337 122.116 1.221 25541
3186 1 14 . 1 1 12 12 LYS HA H 12 4.093 4.093 4.044 0.049 25541
3187 1 14 . 1 1 12 12 LYS C C 12 173.147 173.147 174.313 -1.166 25541
3188 1 14 . 1 1 12 12 LYS CA C 12 56.327 56.327 54.960 1.367 25541
3189 1 14 . 1 1 12 12 LYS CB C 12 33.223 33.223 33.727 -0.504 25541
3190 1 14 . 1 1 12 12 LYS H H 12 8.239 8.239 7.892 0.347 25541
3191 1 14 . 1 1 13 13 TYR N N 13 119.233 119.233 118.281 0.952 25541
3192 1 14 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.688 -0.287 25541
3193 1 14 . 1 1 13 13 TYR C C 13 172.016 172.016 174.352 -2.336 25541
3194 1 14 . 1 1 13 13 TYR CA C 13 57.325 57.325 57.148 0.177 25541
3195 1 14 . 1 1 13 13 TYR CB C 13 39.864 39.864 40.474 -0.610 25541
3196 1 14 . 1 1 13 13 TYR H H 13 8.274 8.274 7.985 0.289 25541
3197 1 14 . 1 1 14 14 ASP N N 14 120.486 120.486 122.887 -2.401 25541
3198 1 14 . 1 1 14 14 ASP HA H 14 4.677 4.677 5.000 -0.323 25541
3199 1 14 . 1 1 14 14 ASP C C 14 173.276 173.276 176.166 -2.890 25541
3200 1 14 . 1 1 14 14 ASP CA C 14 52.719 52.719 53.619 -0.900 25541
3201 1 14 . 1 1 14 14 ASP CB C 14 40.205 40.205 40.939 -0.734 25541
3202 1 14 . 1 1 14 14 ASP H H 14 8.603 8.603 8.693 -0.090 25541
3203 1 14 . 1 1 15 15 LEU N N 15 126.405 126.405 127.073 -0.668 25541
3204 1 14 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.021 -1.256 25541
3205 1 14 . 1 1 15 15 LEU C C 15 175.592 175.592 177.060 -1.468 25541
3206 1 14 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.178 -0.923 25541
3207 1 14 . 1 1 15 15 LEU CB C 15 39.967 39.967 41.151 -1.184 25541
3208 1 14 . 1 1 15 15 LEU H H 15 8.901 8.901 8.552 0.349 25541
3209 1 14 . 1 1 16 16 SER N N 16 116.540 116.540 116.398 0.142 25541
3210 1 14 . 1 1 16 16 SER HA H 16 4.100 4.100 4.248 -0.148 25541
3211 1 14 . 1 1 16 16 SER C C 16 173.247 173.247 174.375 -1.128 25541
3212 1 14 . 1 1 16 16 SER CA C 16 61.720 61.720 60.480 1.240 25541
3213 1 14 . 1 1 16 16 SER CB C 16 62.797 62.797 63.483 -0.686 25541
3214 1 14 . 1 1 16 16 SER H H 16 8.112 8.112 8.233 -0.121 25541
3215 1 14 . 1 1 17 17 LYS N N 17 118.008 118.008 118.058 -0.050 25541
3216 1 14 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.583 -0.082 25541
3217 1 14 . 1 1 17 17 LYS C C 17 175.079 175.079 175.260 -0.181 25541
3218 1 14 . 1 1 17 17 LYS CA C 17 55.267 55.267 56.232 -0.965 25541
3219 1 14 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.410 -2.433 25541
3220 1 14 . 1 1 17 17 LYS H H 17 8.521 8.521 7.908 0.613 25541
3221 1 14 . 1 1 18 18 TRP N N 18 122.041 122.041 122.474 -0.433 25541
3222 1 14 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.875 -0.297 25541
3223 1 14 . 1 1 18 18 TRP C C 18 174.862 174.862 175.405 -0.543 25541
3224 1 14 . 1 1 18 18 TRP CA C 18 58.371 58.371 56.966 1.405 25541
3225 1 14 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.648 -4.104 25541
3226 1 14 . 1 1 18 18 TRP H H 18 7.853 7.853 8.448 -0.595 25541
3227 1 14 . 1 1 19 19 LYS N N 19 123.185 123.185 121.471 1.714 25541
3228 1 14 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.664 -0.129 25541
3229 1 14 . 1 1 19 19 LYS C C 19 175.094 175.094 177.069 -1.975 25541
3230 1 14 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.954 0.473 25541
3231 1 14 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.891 -0.771 25541
3232 1 14 . 1 1 19 19 LYS H H 19 9.544 9.544 8.341 1.203 25541
3233 1 14 . 1 1 20 20 TYR N N 20 124.291 124.291 125.879 -1.588 25541
3234 1 14 . 1 1 20 20 TYR HA H 20 4.025 4.025 3.966 0.059 25541
3235 1 14 . 1 1 20 20 TYR C C 20 174.531 174.531 177.147 -2.616 25541
3236 1 14 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.664 0.485 25541
3237 1 14 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.311 -0.158 25541
3238 1 14 . 1 1 20 20 TYR H H 20 9.266 9.266 9.180 0.086 25541
3239 1 14 . 1 1 21 21 ALA N N 21 117.781 117.781 121.243 -3.462 25541
3240 1 14 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.220 -0.347 25541
3241 1 14 . 1 1 21 21 ALA C C 21 176.314 176.314 179.496 -3.182 25541
3242 1 14 . 1 1 21 21 ALA CA C 21 55.335 55.335 55.074 0.261 25541
3243 1 14 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.868 0.835 25541
3244 1 14 . 1 1 21 21 ALA H H 21 8.986 8.986 8.638 0.348 25541
3245 1 14 . 1 1 22 22 GLU N N 22 115.218 115.218 119.011 -3.793 25541
3246 1 14 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.134 -0.015 25541
3247 1 14 . 1 1 22 22 GLU C C 22 177.380 177.380 179.356 -1.976 25541
3248 1 14 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.444 -0.965 25541
3249 1 14 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.346 0.524 25541
3250 1 14 . 1 1 22 22 GLU H H 22 6.854 6.854 8.480 -1.626 25541
3251 1 14 . 1 1 23 23 LEU N N 23 122.132 122.132 120.148 1.984 25541
3252 1 14 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.137 0.019 25541
3253 1 14 . 1 1 23 23 LEU C C 23 174.830 174.830 179.643 -4.813 25541
3254 1 14 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.292 0.230 25541
3255 1 14 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.701 1.418 25541
3256 1 14 . 1 1 23 23 LEU H H 23 7.909 7.909 9.041 -1.132 25541
3257 1 14 . 1 1 24 24 ARG N N 24 118.051 118.051 118.690 -0.639 25541
3258 1 14 . 1 1 24 24 ARG HA H 24 3.637 3.637 4.017 -0.380 25541
3259 1 14 . 1 1 24 24 ARG C C 24 175.240 175.240 178.522 -3.282 25541
3260 1 14 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.356 0.620 25541
3261 1 14 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.496 0.366 25541
3262 1 14 . 1 1 24 24 ARG H H 24 8.250 8.250 8.103 0.147 25541
3263 1 14 . 1 1 25 25 ASP N N 25 118.179 118.179 119.565 -1.386 25541
3264 1 14 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.563 -0.178 25541
3265 1 14 . 1 1 25 25 ASP C C 25 176.554 176.554 179.113 -2.559 25541
3266 1 14 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.121 0.235 25541
3267 1 14 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.520 -0.478 25541
3268 1 14 . 1 1 25 25 ASP H H 25 8.507 8.507 8.496 0.011 25541
3269 1 14 . 1 1 26 26 THR N N 26 118.299 118.299 117.929 0.370 25541
3270 1 14 . 1 1 26 26 THR HA H 26 3.891 3.891 4.034 -0.143 25541
3271 1 14 . 1 1 26 26 THR C C 26 173.365 173.365 176.543 -3.178 25541
3272 1 14 . 1 1 26 26 THR CA C 26 67.787 67.787 66.893 0.894 25541
3273 1 14 . 1 1 26 26 THR CB C 26 68.120 68.120 68.873 -0.753 25541
3274 1 14 . 1 1 26 26 THR H H 26 7.918 7.918 8.538 -0.620 25541
3275 1 14 . 1 1 27 27 ILE N N 27 122.576 122.576 119.388 3.188 25541
3276 1 14 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.850 -0.225 25541
3277 1 14 . 1 1 27 27 ILE C C 27 174.485 174.485 176.552 -2.067 25541
3278 1 14 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.381 0.330 25541
3279 1 14 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.711 -0.184 25541
3280 1 14 . 1 1 27 27 ILE H H 27 8.159 8.159 7.477 0.682 25541
3281 1 14 . 1 1 28 28 ASN N N 28 115.118 115.118 115.822 -0.704 25541
3282 1 14 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.751 -0.136 25541
3283 1 14 . 1 1 28 28 ASN C C 28 173.902 173.902 175.128 -1.226 25541
3284 1 14 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.915 0.545 25541
3285 1 14 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.574 -0.344 25541
3286 1 14 . 1 1 28 28 ASN H H 28 7.713 7.713 7.745 -0.032 25541
3287 1 14 . 1 1 29 29 THR N N 29 107.730 107.730 110.067 -2.337 25541
3288 1 14 . 1 1 29 29 THR HA H 29 4.600 4.600 4.445 0.155 25541
3289 1 14 . 1 1 29 29 THR C C 29 172.290 172.290 174.852 -2.562 25541
3290 1 14 . 1 1 29 29 THR CA C 29 62.595 62.595 62.627 -0.032 25541
3291 1 14 . 1 1 29 29 THR CB C 29 72.291 72.291 70.154 2.137 25541
3292 1 14 . 1 1 29 29 THR H H 29 7.587 7.587 7.430 0.157 25541
3293 1 14 . 1 1 30 30 SER N N 30 117.784 117.784 117.589 0.195 25541
3294 1 14 . 1 1 30 30 SER HA H 30 4.296 4.296 4.554 -0.258 25541
3295 1 14 . 1 1 30 30 SER C C 30 172.473 172.473 173.095 -0.622 25541
3296 1 14 . 1 1 30 30 SER CA C 30 59.618 59.618 58.636 0.982 25541
3297 1 14 . 1 1 30 30 SER CB C 30 64.402 64.402 64.164 0.238 25541
3298 1 14 . 1 1 30 30 SER H H 30 8.698 8.698 8.408 0.290 25541
3299 1 14 . 1 1 31 31 CYS N N 31 121.196 121.196 119.641 1.555 25541
3300 1 14 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.696 0.091 25541
3301 1 14 . 1 1 31 31 CYS C C 31 170.861 170.861 172.551 -1.690 25541
3302 1 14 . 1 1 31 31 CYS CA C 31 57.372 57.372 59.284 -1.912 25541
3303 1 14 . 1 1 31 31 CYS CB C 31 28.364 28.364 28.629 -0.265 25541
3304 1 14 . 1 1 31 31 CYS H H 31 8.713 8.713 8.378 0.335 25541
3305 1 14 . 1 1 32 32 ASP N N 32 124.610 124.610 126.043 -1.433 25541
3306 1 14 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.787 -0.174 25541
3307 1 14 . 1 1 32 32 ASP C C 32 172.541 172.541 175.619 -3.078 25541
3308 1 14 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.095 -0.910 25541
3309 1 14 . 1 1 32 32 ASP CB C 32 41.137 41.137 42.888 -1.751 25541
3310 1 14 . 1 1 32 32 ASP H H 32 8.542 8.542 8.127 0.415 25541
3311 1 14 . 1 1 33 33 ILE N N 33 125.134 125.134 121.447 3.687 25541
3312 1 14 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.063 -0.377 25541
3313 1 14 . 1 1 33 33 ILE C C 33 175.743 175.743 176.092 -0.349 25541
3314 1 14 . 1 1 33 33 ILE CA C 33 64.710 64.710 62.862 1.848 25541
3315 1 14 . 1 1 33 33 ILE CB C 33 37.815 37.815 38.090 -0.275 25541
3316 1 14 . 1 1 33 33 ILE H H 33 8.459 8.459 8.564 -0.105 25541
3317 1 14 . 1 1 34 34 GLU N N 34 121.097 121.097 120.118 0.979 25541
3318 1 14 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.262 -0.131 25541
3319 1 14 . 1 1 34 34 GLU C C 34 176.406 176.406 177.960 -1.554 25541
3320 1 14 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.143 1.190 25541
3321 1 14 . 1 1 34 34 GLU CB C 34 29.675 29.675 30.427 -0.752 25541
3322 1 14 . 1 1 34 34 GLU H H 34 8.177 8.177 7.862 0.315 25541
3323 1 14 . 1 1 35 35 LEU N N 35 124.890 124.890 120.873 4.017 25541
3324 1 14 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.877 -0.266 25541
3325 1 14 . 1 1 35 35 LEU C C 35 176.399 176.399 178.874 -2.475 25541
3326 1 14 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.888 -0.820 25541
3327 1 14 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.725 -0.815 25541
3328 1 14 . 1 1 35 35 LEU H H 35 7.831 7.831 7.894 -0.063 25541
3329 1 14 . 1 1 36 36 LEU N N 36 120.493 120.493 118.731 1.762 25541
3330 1 14 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.753 -0.094 25541
3331 1 14 . 1 1 36 36 LEU C C 36 176.280 176.280 178.949 -2.669 25541
3332 1 14 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.149 0.466 25541
3333 1 14 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.977 1.492 25541
3334 1 14 . 1 1 36 36 LEU H H 36 8.843 8.843 7.491 1.352 25541
3335 1 14 . 1 1 37 37 ALA N N 37 119.956 119.956 120.725 -0.769 25541
3336 1 14 . 1 1 37 37 ALA HA H 37 3.997 3.997 4.010 -0.013 25541
3337 1 14 . 1 1 37 37 ALA C C 37 177.606 177.606 179.549 -1.943 25541
3338 1 14 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.820 0.349 25541
3339 1 14 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.893 -0.273 25541
3340 1 14 . 1 1 37 37 ALA H H 37 7.610 7.610 8.244 -0.634 25541
3341 1 14 . 1 1 38 38 ALA N N 38 121.594 121.594 121.176 0.418 25541
3342 1 14 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.335 -0.232 25541
3343 1 14 . 1 1 38 38 ALA C C 38 178.452 178.452 178.875 -0.423 25541
3344 1 14 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.311 0.544 25541
3345 1 14 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.525 -0.465 25541
3346 1 14 . 1 1 38 38 ALA H H 38 7.665 7.665 8.412 -0.747 25541
3347 1 14 . 1 1 39 39 CYS N N 39 119.263 119.263 118.195 1.068 25541
3348 1 14 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.860 -0.129 25541
3349 1 14 . 1 1 39 39 CYS C C 39 173.860 173.860 176.616 -2.756 25541
3350 1 14 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.612 1.210 25541
3351 1 14 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.678 -0.453 25541
3352 1 14 . 1 1 39 39 CYS H H 39 8.766 8.766 8.542 0.224 25541
3353 1 14 . 1 1 40 40 ARG N N 40 119.658 119.658 119.411 0.247 25541
3354 1 14 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.763 0.135 25541
3355 1 14 . 1 1 40 40 ARG C C 40 176.108 176.108 178.639 -2.531 25541
3356 1 14 . 1 1 40 40 ARG CA C 40 60.482 60.482 60.009 0.473 25541
3357 1 14 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.953 -0.089 25541
3358 1 14 . 1 1 40 40 ARG H H 40 8.327 8.327 8.508 -0.181 25541
3359 1 14 . 1 1 41 41 GLU N N 41 119.358 119.358 118.335 1.023 25541
3360 1 14 . 1 1 41 41 GLU HA H 41 4.099 4.099 4.080 0.019 25541
3361 1 14 . 1 1 41 41 GLU C C 41 171.786 171.786 178.977 -7.191 25541
3362 1 14 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.764 -0.551 25541
3363 1 14 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.338 -0.061 25541
3364 1 14 . 1 1 41 41 GLU H H 41 7.929 7.929 7.811 0.118 25541
3365 1 14 . 1 1 42 42 GLU N N 42 121.281 121.281 118.951 2.330 25541
3366 1 14 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.115 0.108 25541
3367 1 14 . 1 1 42 42 GLU C C 42 173.408 173.408 178.836 -5.428 25541
3368 1 14 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.240 0.079 25541
3369 1 14 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.030 -0.815 25541
3370 1 14 . 1 1 42 42 GLU H H 42 7.945 7.945 7.721 0.224 25541
3371 1 14 . 1 1 43 43 PHE N N 43 119.271 119.271 121.111 -1.840 25541
3372 1 14 . 1 1 43 43 PHE HA H 43 4.077 4.077 3.947 0.130 25541
3373 1 14 . 1 1 43 43 PHE C C 43 175.299 175.299 177.409 -2.110 25541
3374 1 14 . 1 1 43 43 PHE CA C 43 61.549 61.549 61.482 0.067 25541
3375 1 14 . 1 1 43 43 PHE CB C 43 39.134 39.134 38.896 0.238 25541
3376 1 14 . 1 1 43 43 PHE H H 43 8.624 8.624 8.492 0.132 25541
3377 1 14 . 1 1 44 44 HIS N N 44 116.374 116.374 115.992 0.382 25541
3378 1 14 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.533 -0.267 25541
3379 1 14 . 1 1 44 44 HIS C C 44 174.771 174.771 177.968 -3.197 25541
3380 1 14 . 1 1 44 44 HIS CA C 44 59.343 59.343 60.240 -0.897 25541
3381 1 14 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.637 -0.149 25541
3382 1 14 . 1 1 44 44 HIS H H 44 7.976 7.976 7.945 0.031 25541
3383 1 14 . 1 1 45 45 ARG N N 45 120.170 120.170 119.690 0.480 25541
3384 1 14 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.078 -0.132 25541
3385 1 14 . 1 1 45 45 ARG C C 45 176.310 176.310 178.550 -2.240 25541
3386 1 14 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.527 -0.321 25541
3387 1 14 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.895 0.493 25541
3388 1 14 . 1 1 45 45 ARG H H 45 8.166 8.166 8.078 0.088 25541
3389 1 14 . 1 1 46 46 ARG N N 46 116.229 116.229 118.637 -2.408 25541
3390 1 14 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.154 -0.089 25541
3391 1 14 . 1 1 46 46 ARG C C 46 176.046 176.046 178.137 -2.091 25541
3392 1 14 . 1 1 46 46 ARG CA C 46 57.691 57.691 58.049 -0.358 25541
3393 1 14 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.094 1.154 25541
3394 1 14 . 1 1 46 46 ARG H H 46 7.764 7.764 7.638 0.126 25541
3395 1 14 . 1 1 47 47 LEU N N 47 119.010 119.010 119.737 -0.727 25541
3396 1 14 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.230 -0.095 25541
3397 1 14 . 1 1 47 47 LEU CA C 47 55.957 55.957 56.512 -0.555 25541
3398 1 14 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.489 0.535 25541
3399 1 14 . 1 1 47 47 LEU H H 47 7.557 7.557 7.429 0.128 25541
3400 1 14 . 1 1 48 48 LYS N N 48 119.277 119.277 120.802 -1.525 25541
3401 1 14 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.096 -0.021 25541
3402 1 14 . 1 1 48 48 LYS C C 48 176.354 176.354 177.488 -1.134 25541
3403 1 14 . 1 1 48 48 LYS CA C 48 56.655 56.655 58.666 -2.011 25541
3404 1 14 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.880 -0.470 25541
3405 1 14 . 1 1 48 48 LYS H H 48 7.662 7.662 7.860 -0.198 25541
3406 1 14 . 1 1 49 49 VAL N N 49 119.095 119.095 120.717 -1.622 25541
3407 1 14 . 1 1 49 49 VAL HA H 49 3.972 3.972 3.889 0.083 25541
3408 1 14 . 1 1 49 49 VAL C C 49 174.195 174.195 174.200 -0.005 25541
3409 1 14 . 1 1 49 49 VAL CA C 49 62.214 62.214 63.775 -1.560 25541
3410 1 14 . 1 1 49 49 VAL CB C 49 32.747 32.747 31.407 1.340 25541
3411 1 14 . 1 1 49 49 VAL H H 49 7.688 7.688 8.008 -0.320 25541
3412 1 14 . 1 1 50 50 TYR N N 50 123.606 123.606 126.758 -3.152 25541
3413 1 14 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.625 -0.143 25541
3414 1 14 . 1 1 50 50 TYR CA C 50 57.855 57.855 57.695 0.160 25541
3415 1 14 . 1 1 50 50 TYR CB C 50 38.721 38.721 39.334 -0.613 25541
3416 1 14 . 1 1 50 50 TYR H H 50 8.164 8.164 8.411 -0.247 25541
3417 1 15 . 1 1 10 10 THR N N 10 114.351 114.351 114.249 0.102 25541
3418 1 15 . 1 1 10 10 THR HA H 10 4.241 4.241 4.391 -0.150 25541
3419 1 15 . 1 1 10 10 THR C C 10 171.741 171.741 172.967 -1.226 25541
3420 1 15 . 1 1 10 10 THR CA C 10 62.002 62.002 62.334 -0.332 25541
3421 1 15 . 1 1 10 10 THR CB C 10 69.796 69.796 70.071 -0.275 25541
3422 1 15 . 1 1 10 10 THR H H 10 8.114 8.114 7.760 0.354 25541
3423 1 15 . 1 1 11 11 LYS N N 11 124.677 124.677 125.518 -0.841 25541
3424 1 15 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.473 -0.309 25541
3425 1 15 . 1 1 11 11 LYS C C 11 172.964 172.964 175.218 -2.254 25541
3426 1 15 . 1 1 11 11 LYS CA C 11 56.122 56.122 55.621 0.501 25541
3427 1 15 . 1 1 11 11 LYS CB C 11 32.819 32.819 32.926 -0.107 25541
3428 1 15 . 1 1 11 11 LYS H H 11 8.436 8.436 8.419 0.017 25541
3429 1 15 . 1 1 12 12 LYS N N 12 123.337 123.337 124.154 -0.817 25541
3430 1 15 . 1 1 12 12 LYS HA H 12 4.093 4.093 4.113 -0.020 25541
3431 1 15 . 1 1 12 12 LYS C C 12 173.147 173.147 175.682 -2.535 25541
3432 1 15 . 1 1 12 12 LYS CA C 12 56.327 56.327 55.417 0.910 25541
3433 1 15 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.365 0.858 25541
3434 1 15 . 1 1 12 12 LYS H H 12 8.239 8.239 8.138 0.101 25541
3435 1 15 . 1 1 13 13 TYR N N 13 119.233 119.233 117.778 1.455 25541
3436 1 15 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.647 -0.246 25541
3437 1 15 . 1 1 13 13 TYR C C 13 172.016 172.016 174.860 -2.844 25541
3438 1 15 . 1 1 13 13 TYR CA C 13 57.325 57.325 57.215 0.110 25541
3439 1 15 . 1 1 13 13 TYR CB C 13 39.864 39.864 40.992 -1.128 25541
3440 1 15 . 1 1 13 13 TYR H H 13 8.274 8.274 8.325 -0.051 25541
3441 1 15 . 1 1 14 14 ASP N N 14 120.486 120.486 122.385 -1.899 25541
3442 1 15 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.818 -0.141 25541
3443 1 15 . 1 1 14 14 ASP C C 14 173.276 173.276 176.276 -3.000 25541
3444 1 15 . 1 1 14 14 ASP CA C 14 52.719 52.719 53.918 -1.199 25541
3445 1 15 . 1 1 14 14 ASP CB C 14 40.205 40.205 40.941 -0.737 25541
3446 1 15 . 1 1 14 14 ASP H H 14 8.603 8.603 8.773 -0.170 25541
3447 1 15 . 1 1 15 15 LEU N N 15 126.405 126.405 125.712 0.693 25541
3448 1 15 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.043 -1.278 25541
3449 1 15 . 1 1 15 15 LEU C C 15 175.592 175.592 177.311 -1.719 25541
3450 1 15 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.249 -0.994 25541
3451 1 15 . 1 1 15 15 LEU CB C 15 39.967 39.967 41.153 -1.186 25541
3452 1 15 . 1 1 15 15 LEU H H 15 8.901 8.901 8.620 0.281 25541
3453 1 15 . 1 1 16 16 SER N N 16 116.540 116.540 115.608 0.932 25541
3454 1 15 . 1 1 16 16 SER HA H 16 4.100 4.100 4.200 -0.100 25541
3455 1 15 . 1 1 16 16 SER C C 16 173.247 173.247 174.874 -1.627 25541
3456 1 15 . 1 1 16 16 SER CA C 16 61.720 61.720 60.435 1.285 25541
3457 1 15 . 1 1 16 16 SER CB C 16 62.797 62.797 63.181 -0.384 25541
3458 1 15 . 1 1 16 16 SER H H 16 8.112 8.112 8.136 -0.024 25541
3459 1 15 . 1 1 17 17 LYS N N 17 118.008 118.008 120.809 -2.801 25541
3460 1 15 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.593 -0.092 25541
3461 1 15 . 1 1 17 17 LYS C C 17 175.079 175.079 175.169 -0.090 25541
3462 1 15 . 1 1 17 17 LYS CA C 17 55.267 55.267 55.730 -0.463 25541
3463 1 15 . 1 1 17 17 LYS CB C 17 31.977 31.977 33.958 -1.981 25541
3464 1 15 . 1 1 17 17 LYS H H 17 8.521 8.521 8.223 0.298 25541
3465 1 15 . 1 1 18 18 TRP N N 18 122.041 122.041 122.491 -0.450 25541
3466 1 15 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.781 -0.203 25541
3467 1 15 . 1 1 18 18 TRP C C 18 174.862 174.862 174.925 -0.063 25541
3468 1 15 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.450 0.921 25541
3469 1 15 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.219 -3.675 25541
3470 1 15 . 1 1 18 18 TRP H H 18 7.853 7.853 8.511 -0.658 25541
3471 1 15 . 1 1 19 19 LYS N N 19 123.185 123.185 121.003 2.182 25541
3472 1 15 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.744 -0.209 25541
3473 1 15 . 1 1 19 19 LYS C C 19 175.094 175.094 176.885 -1.791 25541
3474 1 15 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.979 0.448 25541
3475 1 15 . 1 1 19 19 LYS CB C 19 33.120 33.120 34.181 -1.061 25541
3476 1 15 . 1 1 19 19 LYS H H 19 9.544 9.544 8.384 1.160 25541
3477 1 15 . 1 1 20 20 TYR N N 20 124.291 124.291 125.595 -1.304 25541
3478 1 15 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.070 -0.045 25541
3479 1 15 . 1 1 20 20 TYR C C 20 174.531 174.531 177.336 -2.805 25541
3480 1 15 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.749 0.399 25541
3481 1 15 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.447 -0.294 25541
3482 1 15 . 1 1 20 20 TYR H H 20 9.266 9.266 9.227 0.039 25541
3483 1 15 . 1 1 21 21 ALA N N 21 117.781 117.781 119.379 -1.598 25541
3484 1 15 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.330 -0.457 25541
3485 1 15 . 1 1 21 21 ALA C C 21 176.314 176.314 179.971 -3.657 25541
3486 1 15 . 1 1 21 21 ALA CA C 21 55.335 55.335 55.004 0.331 25541
3487 1 15 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.875 0.828 25541
3488 1 15 . 1 1 21 21 ALA H H 21 8.986 8.986 8.690 0.296 25541
3489 1 15 . 1 1 22 22 GLU N N 22 115.218 115.218 119.904 -4.686 25541
3490 1 15 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.227 -0.108 25541
3491 1 15 . 1 1 22 22 GLU C C 22 177.380 177.380 179.217 -1.837 25541
3492 1 15 . 1 1 22 22 GLU CA C 22 58.479 58.479 58.978 -0.499 25541
3493 1 15 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.674 0.196 25541
3494 1 15 . 1 1 22 22 GLU H H 22 6.854 6.854 7.862 -1.008 25541
3495 1 15 . 1 1 23 23 LEU N N 23 122.132 122.132 120.132 2.000 25541
3496 1 15 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.006 0.150 25541
3497 1 15 . 1 1 23 23 LEU C C 23 174.830 174.830 180.000 -5.170 25541
3498 1 15 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.307 0.215 25541
3499 1 15 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.565 1.554 25541
3500 1 15 . 1 1 23 23 LEU H H 23 7.909 7.909 9.026 -1.117 25541
3501 1 15 . 1 1 24 24 ARG N N 24 118.051 118.051 118.913 -0.862 25541
3502 1 15 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.849 -0.212 25541
3503 1 15 . 1 1 24 24 ARG C C 24 175.240 175.240 178.013 -2.773 25541
3504 1 15 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.822 0.154 25541
3505 1 15 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.883 -0.021 25541
3506 1 15 . 1 1 24 24 ARG H H 24 8.250 8.250 7.832 0.418 25541
3507 1 15 . 1 1 25 25 ASP N N 25 118.179 118.179 118.471 -0.292 25541
3508 1 15 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.390 -0.005 25541
3509 1 15 . 1 1 25 25 ASP C C 25 176.554 176.554 178.504 -1.950 25541
3510 1 15 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.332 0.024 25541
3511 1 15 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.855 -0.813 25541
3512 1 15 . 1 1 25 25 ASP H H 25 8.507 8.507 8.190 0.317 25541
3513 1 15 . 1 1 26 26 THR N N 26 118.299 118.299 116.029 2.270 25541
3514 1 15 . 1 1 26 26 THR HA H 26 3.891 3.891 3.968 -0.077 25541
3515 1 15 . 1 1 26 26 THR C C 26 173.365 173.365 176.466 -3.101 25541
3516 1 15 . 1 1 26 26 THR CA C 26 67.787 67.787 66.451 1.336 25541
3517 1 15 . 1 1 26 26 THR CB C 26 68.120 68.120 69.072 -0.952 25541
3518 1 15 . 1 1 26 26 THR H H 26 7.918 7.918 8.337 -0.419 25541
3519 1 15 . 1 1 27 27 ILE N N 27 122.576 122.576 118.511 4.065 25541
3520 1 15 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.831 -0.206 25541
3521 1 15 . 1 1 27 27 ILE C C 27 174.485 174.485 176.497 -2.012 25541
3522 1 15 . 1 1 27 27 ILE CA C 27 64.711 64.711 63.945 0.766 25541
3523 1 15 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.667 -0.140 25541
3524 1 15 . 1 1 27 27 ILE H H 27 8.159 8.159 7.323 0.836 25541
3525 1 15 . 1 1 28 28 ASN N N 28 115.118 115.118 115.796 -0.678 25541
3526 1 15 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.762 -0.147 25541
3527 1 15 . 1 1 28 28 ASN C C 28 173.902 173.902 175.107 -1.205 25541
3528 1 15 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.813 0.647 25541
3529 1 15 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.654 -0.424 25541
3530 1 15 . 1 1 28 28 ASN H H 28 7.713 7.713 7.981 -0.268 25541
3531 1 15 . 1 1 29 29 THR N N 29 107.730 107.730 108.510 -0.780 25541
3532 1 15 . 1 1 29 29 THR HA H 29 4.600 4.600 4.404 0.196 25541
3533 1 15 . 1 1 29 29 THR C C 29 172.290 172.290 174.852 -2.562 25541
3534 1 15 . 1 1 29 29 THR CA C 29 62.595 62.595 62.327 0.268 25541
3535 1 15 . 1 1 29 29 THR CB C 29 72.291 72.291 70.338 1.953 25541
3536 1 15 . 1 1 29 29 THR H H 29 7.587 7.587 7.511 0.076 25541
3537 1 15 . 1 1 30 30 SER N N 30 117.784 117.784 117.589 0.195 25541
3538 1 15 . 1 1 30 30 SER HA H 30 4.296 4.296 4.555 -0.259 25541
3539 1 15 . 1 1 30 30 SER C C 30 172.473 172.473 173.061 -0.588 25541
3540 1 15 . 1 1 30 30 SER CA C 30 59.618 59.618 58.359 1.258 25541
3541 1 15 . 1 1 30 30 SER CB C 30 64.402 64.402 64.344 0.058 25541
3542 1 15 . 1 1 30 30 SER H H 30 8.698 8.698 8.493 0.205 25541
3543 1 15 . 1 1 31 31 CYS N N 31 121.196 121.196 119.828 1.368 25541
3544 1 15 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.639 0.148 25541
3545 1 15 . 1 1 31 31 CYS C C 31 170.861 170.861 172.387 -1.526 25541
3546 1 15 . 1 1 31 31 CYS CA C 31 57.372 57.372 59.002 -1.631 25541
3547 1 15 . 1 1 31 31 CYS CB C 31 28.364 28.364 28.537 -0.173 25541
3548 1 15 . 1 1 31 31 CYS H H 31 8.713 8.713 8.456 0.257 25541
3549 1 15 . 1 1 32 32 ASP N N 32 124.610 124.610 126.297 -1.687 25541
3550 1 15 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.662 -0.049 25541
3551 1 15 . 1 1 32 32 ASP C C 32 172.541 172.541 175.696 -3.155 25541
3552 1 15 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.109 -0.924 25541
3553 1 15 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.289 -2.152 25541
3554 1 15 . 1 1 32 32 ASP H H 32 8.542 8.542 8.220 0.322 25541
3555 1 15 . 1 1 33 33 ILE N N 33 125.134 125.134 121.408 3.726 25541
3556 1 15 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.041 -0.355 25541
3557 1 15 . 1 1 33 33 ILE C C 33 175.743 175.743 176.414 -0.671 25541
3558 1 15 . 1 1 33 33 ILE CA C 33 64.710 64.710 62.635 2.075 25541
3559 1 15 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.294 0.521 25541
3560 1 15 . 1 1 33 33 ILE H H 33 8.459 8.459 8.541 -0.082 25541
3561 1 15 . 1 1 34 34 GLU N N 34 121.097 121.097 120.147 0.950 25541
3562 1 15 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.261 -0.130 25541
3563 1 15 . 1 1 34 34 GLU C C 34 176.406 176.406 178.404 -1.998 25541
3564 1 15 . 1 1 34 34 GLU CA C 34 59.333 59.333 57.474 1.859 25541
3565 1 15 . 1 1 34 34 GLU CB C 34 29.675 29.675 30.129 -0.454 25541
3566 1 15 . 1 1 34 34 GLU H H 34 8.177 8.177 8.233 -0.056 25541
3567 1 15 . 1 1 35 35 LEU N N 35 124.890 124.890 120.961 3.929 25541
3568 1 15 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.797 -0.186 25541
3569 1 15 . 1 1 35 35 LEU C C 35 176.399 176.399 178.960 -2.561 25541
3570 1 15 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.788 -0.720 25541
3571 1 15 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.508 -0.598 25541
3572 1 15 . 1 1 35 35 LEU H H 35 7.831 7.831 7.739 0.092 25541
3573 1 15 . 1 1 36 36 LEU N N 36 120.493 120.493 118.684 1.809 25541
3574 1 15 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.711 -0.052 25541
3575 1 15 . 1 1 36 36 LEU C C 36 176.280 176.280 178.941 -2.661 25541
3576 1 15 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.096 0.519 25541
3577 1 15 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.951 1.518 25541
3578 1 15 . 1 1 36 36 LEU H H 36 8.843 8.843 7.458 1.385 25541
3579 1 15 . 1 1 37 37 ALA N N 37 119.956 119.956 120.676 -0.720 25541
3580 1 15 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.958 0.039 25541
3581 1 15 . 1 1 37 37 ALA C C 37 177.606 177.606 179.502 -1.896 25541
3582 1 15 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.789 0.380 25541
3583 1 15 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.855 -0.235 25541
3584 1 15 . 1 1 37 37 ALA H H 37 7.610 7.610 8.224 -0.614 25541
3585 1 15 . 1 1 38 38 ALA N N 38 121.594 121.594 121.332 0.262 25541
3586 1 15 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.381 -0.278 25541
3587 1 15 . 1 1 38 38 ALA C C 38 178.452 178.452 178.941 -0.489 25541
3588 1 15 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.195 0.660 25541
3589 1 15 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.374 -0.314 25541
3590 1 15 . 1 1 38 38 ALA H H 38 7.665 7.665 8.181 -0.516 25541
3591 1 15 . 1 1 39 39 CYS N N 39 119.263 119.263 117.764 1.499 25541
3592 1 15 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.747 -0.016 25541
3593 1 15 . 1 1 39 39 CYS C C 39 173.860 173.860 176.616 -2.756 25541
3594 1 15 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.406 1.417 25541
3595 1 15 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.508 -0.283 25541
3596 1 15 . 1 1 39 39 CYS H H 39 8.766 8.766 8.466 0.300 25541
3597 1 15 . 1 1 40 40 ARG N N 40 119.658 119.658 119.216 0.442 25541
3598 1 15 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.681 0.217 25541
3599 1 15 . 1 1 40 40 ARG C C 40 176.108 176.108 178.193 -2.085 25541
3600 1 15 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.483 1.000 25541
3601 1 15 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.708 0.156 25541
3602 1 15 . 1 1 40 40 ARG H H 40 8.327 8.327 8.364 -0.037 25541
3603 1 15 . 1 1 41 41 GLU N N 41 119.358 119.358 117.659 1.699 25541
3604 1 15 . 1 1 41 41 GLU HA H 41 4.099 4.099 3.857 0.242 25541
3605 1 15 . 1 1 41 41 GLU C C 41 171.786 171.786 178.767 -6.981 25541
3606 1 15 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.352 -0.139 25541
3607 1 15 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.342 -0.065 25541
3608 1 15 . 1 1 41 41 GLU H H 41 7.929 7.929 7.608 0.321 25541
3609 1 15 . 1 1 42 42 GLU N N 42 121.281 121.281 119.057 2.224 25541
3610 1 15 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.074 0.149 25541
3611 1 15 . 1 1 42 42 GLU C C 42 173.408 173.408 178.726 -5.318 25541
3612 1 15 . 1 1 42 42 GLU CA C 42 58.319 58.319 57.985 0.334 25541
3613 1 15 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.045 -0.830 25541
3614 1 15 . 1 1 42 42 GLU H H 42 7.945 7.945 7.566 0.379 25541
3615 1 15 . 1 1 43 43 PHE N N 43 119.271 119.271 120.978 -1.707 25541
3616 1 15 . 1 1 43 43 PHE HA H 43 4.077 4.077 3.902 0.175 25541
3617 1 15 . 1 1 43 43 PHE C C 43 175.299 175.299 177.333 -2.034 25541
3618 1 15 . 1 1 43 43 PHE CA C 43 61.549 61.549 61.754 -0.205 25541
3619 1 15 . 1 1 43 43 PHE CB C 43 39.134 39.134 38.929 0.205 25541
3620 1 15 . 1 1 43 43 PHE H H 43 8.624 8.624 8.590 0.034 25541
3621 1 15 . 1 1 44 44 HIS N N 44 116.374 116.374 115.955 0.419 25541
3622 1 15 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.314 -0.048 25541
3623 1 15 . 1 1 44 44 HIS C C 44 174.771 174.771 177.750 -2.979 25541
3624 1 15 . 1 1 44 44 HIS CA C 44 59.343 59.343 58.166 1.177 25541
3625 1 15 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.679 -0.191 25541
3626 1 15 . 1 1 44 44 HIS H H 44 7.976 7.976 7.814 0.162 25541
3627 1 15 . 1 1 45 45 ARG N N 45 120.170 120.170 119.385 0.785 25541
3628 1 15 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.029 -0.083 25541
3629 1 15 . 1 1 45 45 ARG C C 45 176.310 176.310 178.319 -2.009 25541
3630 1 15 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.018 0.188 25541
3631 1 15 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.932 0.456 25541
3632 1 15 . 1 1 45 45 ARG H H 45 8.166 8.166 8.037 0.129 25541
3633 1 15 . 1 1 46 46 ARG N N 46 116.229 116.229 118.265 -2.036 25541
3634 1 15 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.097 -0.032 25541
3635 1 15 . 1 1 46 46 ARG C C 46 176.046 176.046 178.648 -2.602 25541
3636 1 15 . 1 1 46 46 ARG CA C 46 57.691 57.691 57.627 0.064 25541
3637 1 15 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.329 0.919 25541
3638 1 15 . 1 1 46 46 ARG H H 46 7.764 7.764 7.427 0.337 25541
3639 1 15 . 1 1 47 47 LEU N N 47 119.010 119.010 118.912 0.098 25541
3640 1 15 . 1 1 47 47 LEU HA H 47 4.135 4.135 3.817 0.318 25541
3641 1 15 . 1 1 47 47 LEU CA C 47 55.957 55.957 56.715 -0.758 25541
3642 1 15 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.054 0.970 25541
3643 1 15 . 1 1 47 47 LEU H H 47 7.557 7.557 7.352 0.205 25541
3644 1 15 . 1 1 48 48 LYS N N 48 119.277 119.277 117.386 1.891 25541
3645 1 15 . 1 1 48 48 LYS HA H 48 4.075 4.075 3.889 0.186 25541
3646 1 15 . 1 1 48 48 LYS C C 48 176.354 176.354 176.710 -0.356 25541
3647 1 15 . 1 1 48 48 LYS CA C 48 56.655 56.655 58.408 -1.753 25541
3648 1 15 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.809 -0.399 25541
3649 1 15 . 1 1 48 48 LYS H H 48 7.662 7.662 7.382 0.280 25541
3650 1 15 . 1 1 49 49 VAL N N 49 119.095 119.095 116.960 2.135 25541
3651 1 15 . 1 1 49 49 VAL HA H 49 3.972 3.972 4.026 -0.054 25541
3652 1 15 . 1 1 49 49 VAL C C 49 174.195 174.195 173.915 0.280 25541
3653 1 15 . 1 1 49 49 VAL CA C 49 62.214 62.214 60.979 1.235 25541
3654 1 15 . 1 1 49 49 VAL CB C 49 32.747 32.747 33.385 -0.638 25541
3655 1 15 . 1 1 49 49 VAL H H 49 7.688 7.688 7.251 0.437 25541
3656 1 15 . 1 1 50 50 TYR N N 50 123.606 123.606 124.340 -0.734 25541
3657 1 15 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.805 -0.323 25541
3658 1 15 . 1 1 50 50 TYR CA C 50 57.855 57.855 56.812 1.043 25541
3659 1 15 . 1 1 50 50 TYR CB C 50 38.721 38.721 37.918 0.803 25541
3660 1 15 . 1 1 50 50 TYR H H 50 8.164 8.164 8.432 -0.268 25541
3661 1 16 . 1 1 10 10 THR N N 10 114.351 114.351 114.846 -0.495 25541
3662 1 16 . 1 1 10 10 THR HA H 10 4.241 4.241 4.502 -0.261 25541
3663 1 16 . 1 1 10 10 THR C C 10 171.741 171.741 173.076 -1.335 25541
3664 1 16 . 1 1 10 10 THR CA C 10 62.002 62.002 61.968 0.034 25541
3665 1 16 . 1 1 10 10 THR CB C 10 69.796 69.796 69.708 0.088 25541
3666 1 16 . 1 1 10 10 THR H H 10 8.114 8.114 8.023 0.091 25541
3667 1 16 . 1 1 11 11 LYS N N 11 124.677 124.677 122.841 1.836 25541
3668 1 16 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.453 -0.289 25541
3669 1 16 . 1 1 11 11 LYS C C 11 172.964 172.964 174.795 -1.831 25541
3670 1 16 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.305 -0.183 25541
3671 1 16 . 1 1 11 11 LYS CB C 11 32.819 32.819 33.990 -1.171 25541
3672 1 16 . 1 1 11 11 LYS H H 11 8.436 8.436 8.514 -0.078 25541
3673 1 16 . 1 1 12 12 LYS N N 12 123.337 123.337 122.587 0.750 25541
3674 1 16 . 1 1 12 12 LYS HA H 12 4.093 4.093 3.951 0.142 25541
3675 1 16 . 1 1 12 12 LYS C C 12 173.147 173.147 175.353 -2.206 25541
3676 1 16 . 1 1 12 12 LYS CA C 12 56.327 56.327 55.571 0.756 25541
3677 1 16 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.692 0.531 25541
3678 1 16 . 1 1 12 12 LYS H H 12 8.239 8.239 8.111 0.128 25541
3679 1 16 . 1 1 13 13 TYR N N 13 119.233 119.233 117.769 1.464 25541
3680 1 16 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.665 -0.264 25541
3681 1 16 . 1 1 13 13 TYR C C 13 172.016 172.016 174.112 -2.096 25541
3682 1 16 . 1 1 13 13 TYR CA C 13 57.325 57.325 57.201 0.124 25541
3683 1 16 . 1 1 13 13 TYR CB C 13 39.864 39.864 40.758 -0.894 25541
3684 1 16 . 1 1 13 13 TYR H H 13 8.274 8.274 8.046 0.228 25541
3685 1 16 . 1 1 14 14 ASP N N 14 120.486 120.486 124.130 -3.644 25541
3686 1 16 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.977 -0.300 25541
3687 1 16 . 1 1 14 14 ASP C C 14 173.276 173.276 176.412 -3.136 25541
3688 1 16 . 1 1 14 14 ASP CA C 14 52.719 52.719 53.896 -1.177 25541
3689 1 16 . 1 1 14 14 ASP CB C 14 40.205 40.205 40.886 -0.681 25541
3690 1 16 . 1 1 14 14 ASP H H 14 8.603 8.603 8.773 -0.170 25541
3691 1 16 . 1 1 15 15 LEU N N 15 126.405 126.405 126.105 0.300 25541
3692 1 16 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.029 -1.264 25541
3693 1 16 . 1 1 15 15 LEU C C 15 175.592 175.592 177.541 -1.949 25541
3694 1 16 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.539 -1.284 25541
3695 1 16 . 1 1 15 15 LEU CB C 15 39.967 39.967 41.222 -1.255 25541
3696 1 16 . 1 1 15 15 LEU H H 15 8.901 8.901 8.679 0.222 25541
3697 1 16 . 1 1 16 16 SER N N 16 116.540 116.540 117.288 -0.748 25541
3698 1 16 . 1 1 16 16 SER HA H 16 4.100 4.100 4.312 -0.212 25541
3699 1 16 . 1 1 16 16 SER C C 16 173.247 173.247 174.359 -1.112 25541
3700 1 16 . 1 1 16 16 SER CA C 16 61.720 61.720 60.506 1.214 25541
3701 1 16 . 1 1 16 16 SER CB C 16 62.797 62.797 63.297 -0.500 25541
3702 1 16 . 1 1 16 16 SER H H 16 8.112 8.112 8.220 -0.108 25541
3703 1 16 . 1 1 17 17 LYS N N 17 118.008 118.008 117.935 0.073 25541
3704 1 16 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.601 -0.100 25541
3705 1 16 . 1 1 17 17 LYS C C 17 175.079 175.079 175.144 -0.065 25541
3706 1 16 . 1 1 17 17 LYS CA C 17 55.267 55.267 56.233 -0.966 25541
3707 1 16 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.130 -2.154 25541
3708 1 16 . 1 1 17 17 LYS H H 17 8.521 8.521 7.873 0.648 25541
3709 1 16 . 1 1 18 18 TRP N N 18 122.041 122.041 122.388 -0.347 25541
3710 1 16 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.826 -0.248 25541
3711 1 16 . 1 1 18 18 TRP C C 18 174.862 174.862 175.321 -0.459 25541
3712 1 16 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.015 1.356 25541
3713 1 16 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.321 -3.777 25541
3714 1 16 . 1 1 18 18 TRP H H 18 7.853 7.853 8.466 -0.613 25541
3715 1 16 . 1 1 19 19 LYS N N 19 123.185 123.185 120.885 2.300 25541
3716 1 16 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.708 -0.173 25541
3717 1 16 . 1 1 19 19 LYS C C 19 175.094 175.094 177.101 -2.007 25541
3718 1 16 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.736 0.691 25541
3719 1 16 . 1 1 19 19 LYS CB C 19 33.120 33.120 34.124 -1.004 25541
3720 1 16 . 1 1 19 19 LYS H H 19 9.544 9.544 8.463 1.081 25541
3721 1 16 . 1 1 20 20 TYR N N 20 124.291 124.291 125.579 -1.288 25541
3722 1 16 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.057 -0.032 25541
3723 1 16 . 1 1 20 20 TYR C C 20 174.531 174.531 177.240 -2.709 25541
3724 1 16 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.762 0.387 25541
3725 1 16 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.513 -0.360 25541
3726 1 16 . 1 1 20 20 TYR H H 20 9.266 9.266 9.230 0.036 25541
3727 1 16 . 1 1 21 21 ALA N N 21 117.781 117.781 120.785 -3.004 25541
3728 1 16 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.286 -0.413 25541
3729 1 16 . 1 1 21 21 ALA C C 21 176.314 176.314 179.822 -3.508 25541
3730 1 16 . 1 1 21 21 ALA CA C 21 55.335 55.335 55.142 0.193 25541
3731 1 16 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.925 0.778 25541
3732 1 16 . 1 1 21 21 ALA H H 21 8.986 8.986 8.513 0.473 25541
3733 1 16 . 1 1 22 22 GLU N N 22 115.218 115.218 119.727 -4.509 25541
3734 1 16 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.146 -0.027 25541
3735 1 16 . 1 1 22 22 GLU C C 22 177.380 177.380 179.380 -2.000 25541
3736 1 16 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.460 -0.981 25541
3737 1 16 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.375 0.495 25541
3738 1 16 . 1 1 22 22 GLU H H 22 6.854 6.854 7.643 -0.789 25541
3739 1 16 . 1 1 23 23 LEU N N 23 122.132 122.132 119.874 2.258 25541
3740 1 16 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.078 0.078 25541
3741 1 16 . 1 1 23 23 LEU C C 23 174.830 174.830 180.062 -5.232 25541
3742 1 16 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.160 0.361 25541
3743 1 16 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.644 1.475 25541
3744 1 16 . 1 1 23 23 LEU H H 23 7.909 7.909 9.000 -1.091 25541
3745 1 16 . 1 1 24 24 ARG N N 24 118.051 118.051 118.640 -0.589 25541
3746 1 16 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.899 -0.262 25541
3747 1 16 . 1 1 24 24 ARG C C 24 175.240 175.240 178.212 -2.972 25541
3748 1 16 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.739 0.237 25541
3749 1 16 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.729 0.133 25541
3750 1 16 . 1 1 24 24 ARG H H 24 8.250 8.250 7.712 0.538 25541
3751 1 16 . 1 1 25 25 ASP N N 25 118.179 118.179 118.885 -0.706 25541
3752 1 16 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.426 -0.041 25541
3753 1 16 . 1 1 25 25 ASP C C 25 176.554 176.554 178.144 -1.590 25541
3754 1 16 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.334 0.022 25541
3755 1 16 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.865 -0.823 25541
3756 1 16 . 1 1 25 25 ASP H H 25 8.507 8.507 8.424 0.083 25541
3757 1 16 . 1 1 26 26 THR N N 26 118.299 118.299 116.087 2.212 25541
3758 1 16 . 1 1 26 26 THR HA H 26 3.891 3.891 4.008 -0.117 25541
3759 1 16 . 1 1 26 26 THR C C 26 173.365 173.365 176.535 -3.170 25541
3760 1 16 . 1 1 26 26 THR CA C 26 67.787 67.787 66.086 1.701 25541
3761 1 16 . 1 1 26 26 THR CB C 26 68.120 68.120 69.088 -0.968 25541
3762 1 16 . 1 1 26 26 THR H H 26 7.918 7.918 8.318 -0.400 25541
3763 1 16 . 1 1 27 27 ILE N N 27 122.576 122.576 119.197 3.379 25541
3764 1 16 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.789 -0.164 25541
3765 1 16 . 1 1 27 27 ILE C C 27 174.485 174.485 176.498 -2.013 25541
3766 1 16 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.460 0.251 25541
3767 1 16 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.683 -0.156 25541
3768 1 16 . 1 1 27 27 ILE H H 27 8.159 8.159 7.450 0.709 25541
3769 1 16 . 1 1 28 28 ASN N N 28 115.118 115.118 116.083 -0.965 25541
3770 1 16 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.748 -0.133 25541
3771 1 16 . 1 1 28 28 ASN C C 28 173.902 173.902 174.938 -1.036 25541
3772 1 16 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.806 0.654 25541
3773 1 16 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.324 -0.094 25541
3774 1 16 . 1 1 28 28 ASN H H 28 7.713 7.713 7.838 -0.125 25541
3775 1 16 . 1 1 29 29 THR N N 29 107.730 107.730 109.407 -1.677 25541
3776 1 16 . 1 1 29 29 THR HA H 29 4.600 4.600 4.431 0.169 25541
3777 1 16 . 1 1 29 29 THR C C 29 172.290 172.290 174.806 -2.516 25541
3778 1 16 . 1 1 29 29 THR CA C 29 62.595 62.595 62.914 -0.319 25541
3779 1 16 . 1 1 29 29 THR CB C 29 72.291 72.291 70.223 2.068 25541
3780 1 16 . 1 1 29 29 THR H H 29 7.587 7.587 7.594 -0.007 25541
3781 1 16 . 1 1 30 30 SER N N 30 117.784 117.784 118.083 -0.299 25541
3782 1 16 . 1 1 30 30 SER HA H 30 4.296 4.296 4.551 -0.255 25541
3783 1 16 . 1 1 30 30 SER C C 30 172.473 172.473 173.251 -0.778 25541
3784 1 16 . 1 1 30 30 SER CA C 30 59.618 59.618 58.675 0.943 25541
3785 1 16 . 1 1 30 30 SER CB C 30 64.402 64.402 64.339 0.063 25541
3786 1 16 . 1 1 30 30 SER H H 30 8.698 8.698 8.573 0.125 25541
3787 1 16 . 1 1 31 31 CYS N N 31 121.196 121.196 119.686 1.510 25541
3788 1 16 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.629 0.158 25541
3789 1 16 . 1 1 31 31 CYS C C 31 170.861 170.861 172.389 -1.528 25541
3790 1 16 . 1 1 31 31 CYS CA C 31 57.372 57.372 59.108 -1.736 25541
3791 1 16 . 1 1 31 31 CYS CB C 31 28.364 28.364 28.500 -0.136 25541
3792 1 16 . 1 1 31 31 CYS H H 31 8.713 8.713 8.459 0.254 25541
3793 1 16 . 1 1 32 32 ASP N N 32 124.610 124.610 126.077 -1.467 25541
3794 1 16 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.728 -0.115 25541
3795 1 16 . 1 1 32 32 ASP C C 32 172.541 172.541 175.443 -2.902 25541
3796 1 16 . 1 1 32 32 ASP CA C 32 53.185 53.185 53.973 -0.788 25541
3797 1 16 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.160 -2.023 25541
3798 1 16 . 1 1 32 32 ASP H H 32 8.542 8.542 8.241 0.301 25541
3799 1 16 . 1 1 33 33 ILE N N 33 125.134 125.134 121.557 3.577 25541
3800 1 16 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.002 -0.316 25541
3801 1 16 . 1 1 33 33 ILE C C 33 175.743 175.743 176.240 -0.497 25541
3802 1 16 . 1 1 33 33 ILE CA C 33 64.710 64.710 62.983 1.728 25541
3803 1 16 . 1 1 33 33 ILE CB C 33 37.815 37.815 38.012 -0.197 25541
3804 1 16 . 1 1 33 33 ILE H H 33 8.459 8.459 8.606 -0.147 25541
3805 1 16 . 1 1 34 34 GLU N N 34 121.097 121.097 119.608 1.489 25541
3806 1 16 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.270 -0.139 25541
3807 1 16 . 1 1 34 34 GLU C C 34 176.406 176.406 178.039 -1.633 25541
3808 1 16 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.215 1.118 25541
3809 1 16 . 1 1 34 34 GLU CB C 34 29.675 29.675 29.844 -0.169 25541
3810 1 16 . 1 1 34 34 GLU H H 34 8.177 8.177 7.854 0.323 25541
3811 1 16 . 1 1 35 35 LEU N N 35 124.890 124.890 121.223 3.667 25541
3812 1 16 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.804 -0.193 25541
3813 1 16 . 1 1 35 35 LEU C C 35 176.399 176.399 178.839 -2.440 25541
3814 1 16 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.646 -0.578 25541
3815 1 16 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.569 -0.659 25541
3816 1 16 . 1 1 35 35 LEU H H 35 7.831 7.831 8.049 -0.218 25541
3817 1 16 . 1 1 36 36 LEU N N 36 120.493 120.493 118.655 1.838 25541
3818 1 16 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.712 -0.053 25541
3819 1 16 . 1 1 36 36 LEU C C 36 176.280 176.280 178.928 -2.648 25541
3820 1 16 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.135 0.480 25541
3821 1 16 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.959 1.510 25541
3822 1 16 . 1 1 36 36 LEU H H 36 8.843 8.843 7.470 1.373 25541
3823 1 16 . 1 1 37 37 ALA N N 37 119.956 119.956 120.581 -0.625 25541
3824 1 16 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.982 0.015 25541
3825 1 16 . 1 1 37 37 ALA C C 37 177.606 177.606 179.517 -1.911 25541
3826 1 16 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.779 0.390 25541
3827 1 16 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.875 -0.255 25541
3828 1 16 . 1 1 37 37 ALA H H 37 7.610 7.610 8.238 -0.628 25541
3829 1 16 . 1 1 38 38 ALA N N 38 121.594 121.594 120.922 0.672 25541
3830 1 16 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.041 0.062 25541
3831 1 16 . 1 1 38 38 ALA C C 38 178.452 178.452 178.684 -0.232 25541
3832 1 16 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.690 0.165 25541
3833 1 16 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.315 -0.255 25541
3834 1 16 . 1 1 38 38 ALA H H 38 7.665 7.665 8.095 -0.429 25541
3835 1 16 . 1 1 39 39 CYS N N 39 119.263 119.263 117.854 1.409 25541
3836 1 16 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.819 -0.088 25541
3837 1 16 . 1 1 39 39 CYS C C 39 173.860 173.860 176.745 -2.885 25541
3838 1 16 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.665 1.158 25541
3839 1 16 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.605 -0.380 25541
3840 1 16 . 1 1 39 39 CYS H H 39 8.766 8.766 8.536 0.230 25541
3841 1 16 . 1 1 40 40 ARG N N 40 119.658 119.658 119.369 0.289 25541
3842 1 16 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.867 0.031 25541
3843 1 16 . 1 1 40 40 ARG C C 40 176.108 176.108 178.757 -2.649 25541
3844 1 16 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.937 0.545 25541
3845 1 16 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.875 -0.011 25541
3846 1 16 . 1 1 40 40 ARG H H 40 8.327 8.327 8.530 -0.203 25541
3847 1 16 . 1 1 41 41 GLU N N 41 119.358 119.358 118.247 1.111 25541
3848 1 16 . 1 1 41 41 GLU HA H 41 4.099 4.099 4.075 0.024 25541
3849 1 16 . 1 1 41 41 GLU C C 41 171.786 171.786 178.822 -7.036 25541
3850 1 16 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.592 -0.378 25541
3851 1 16 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.173 0.104 25541
3852 1 16 . 1 1 41 41 GLU H H 41 7.929 7.929 7.770 0.159 25541
3853 1 16 . 1 1 42 42 GLU N N 42 121.281 121.281 119.290 1.991 25541
3854 1 16 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.137 0.086 25541
3855 1 16 . 1 1 42 42 GLU C C 42 173.408 173.408 178.971 -5.563 25541
3856 1 16 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.205 0.114 25541
3857 1 16 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.035 -0.820 25541
3858 1 16 . 1 1 42 42 GLU H H 42 7.945 7.945 7.626 0.319 25541
3859 1 16 . 1 1 43 43 PHE N N 43 119.271 119.271 121.205 -1.934 25541
3860 1 16 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.013 0.064 25541
3861 1 16 . 1 1 43 43 PHE C C 43 175.299 175.299 177.170 -1.871 25541
3862 1 16 . 1 1 43 43 PHE CA C 43 61.549 61.549 61.781 -0.232 25541
3863 1 16 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.025 0.109 25541
3864 1 16 . 1 1 43 43 PHE H H 43 8.624 8.624 8.844 -0.220 25541
3865 1 16 . 1 1 44 44 HIS N N 44 116.374 116.374 117.688 -1.314 25541
3866 1 16 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.287 -0.021 25541
3867 1 16 . 1 1 44 44 HIS C C 44 174.771 174.771 177.554 -2.783 25541
3868 1 16 . 1 1 44 44 HIS CA C 44 59.343 59.343 58.917 0.426 25541
3869 1 16 . 1 1 44 44 HIS CB C 44 29.488 29.488 30.114 -0.626 25541
3870 1 16 . 1 1 44 44 HIS H H 44 7.976 7.976 7.938 0.038 25541
3871 1 16 . 1 1 45 45 ARG N N 45 120.170 120.170 118.281 1.889 25541
3872 1 16 . 1 1 45 45 ARG HA H 45 3.946 3.946 3.982 -0.036 25541
3873 1 16 . 1 1 45 45 ARG C C 45 176.310 176.310 177.774 -1.464 25541
3874 1 16 . 1 1 45 45 ARG CA C 45 59.206 59.206 58.869 0.337 25541
3875 1 16 . 1 1 45 45 ARG CB C 45 30.388 30.388 30.025 0.363 25541
3876 1 16 . 1 1 45 45 ARG H H 45 8.166 8.166 7.950 0.216 25541
3877 1 16 . 1 1 46 46 ARG N N 46 116.229 116.229 117.338 -1.109 25541
3878 1 16 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.165 -0.100 25541
3879 1 16 . 1 1 46 46 ARG C C 46 176.046 176.046 178.043 -1.997 25541
3880 1 16 . 1 1 46 46 ARG CA C 46 57.691 57.691 57.113 0.578 25541
3881 1 16 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.412 0.836 25541
3882 1 16 . 1 1 46 46 ARG H H 46 7.764 7.764 7.289 0.475 25541
3883 1 16 . 1 1 47 47 LEU N N 47 119.010 119.010 120.642 -1.632 25541
3884 1 16 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.042 0.093 25541
3885 1 16 . 1 1 47 47 LEU CA C 47 55.957 55.957 57.485 -1.528 25541
3886 1 16 . 1 1 47 47 LEU CB C 47 42.024 42.024 42.166 -0.143 25541
3887 1 16 . 1 1 47 47 LEU H H 47 7.557 7.557 7.497 0.060 25541
3888 1 16 . 1 1 48 48 LYS N N 48 119.277 119.277 119.935 -0.658 25541
3889 1 16 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.194 -0.119 25541
3890 1 16 . 1 1 48 48 LYS C C 48 176.354 176.354 175.387 0.967 25541
3891 1 16 . 1 1 48 48 LYS CA C 48 56.655 56.655 56.365 0.290 25541
3892 1 16 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.002 0.408 25541
3893 1 16 . 1 1 48 48 LYS H H 48 7.662 7.662 7.513 0.149 25541
3894 1 16 . 1 1 49 49 VAL N N 49 119.095 119.095 119.823 -0.728 25541
3895 1 16 . 1 1 49 49 VAL HA H 49 3.972 3.972 4.329 -0.357 25541
3896 1 16 . 1 1 49 49 VAL C C 49 174.195 174.195 176.401 -2.206 25541
3897 1 16 . 1 1 49 49 VAL CA C 49 62.214 62.214 60.430 1.784 25541
3898 1 16 . 1 1 49 49 VAL CB C 49 32.747 32.747 34.112 -1.365 25541
3899 1 16 . 1 1 49 49 VAL H H 49 7.688 7.688 7.992 -0.304 25541
3900 1 16 . 1 1 50 50 TYR N N 50 123.606 123.606 124.079 -0.473 25541
3901 1 16 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.620 -0.138 25541
3902 1 16 . 1 1 50 50 TYR CA C 50 57.855 57.855 57.609 0.246 25541
3903 1 16 . 1 1 50 50 TYR CB C 50 38.721 38.721 36.163 2.558 25541
3904 1 16 . 1 1 50 50 TYR H H 50 8.164 8.164 8.632 -0.468 25541
3905 1 17 . 1 1 10 10 THR N N 10 114.351 114.351 113.891 0.460 25541
3906 1 17 . 1 1 10 10 THR HA H 10 4.241 4.241 4.398 -0.157 25541
3907 1 17 . 1 1 10 10 THR C C 10 171.741 171.741 173.884 -2.143 25541
3908 1 17 . 1 1 10 10 THR CA C 10 62.002 62.002 62.072 -0.070 25541
3909 1 17 . 1 1 10 10 THR CB C 10 69.796 69.796 69.776 0.020 25541
3910 1 17 . 1 1 10 10 THR H H 10 8.114 8.114 8.230 -0.116 25541
3911 1 17 . 1 1 11 11 LYS N N 11 124.677 124.677 126.020 -1.343 25541
3912 1 17 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.184 -0.020 25541
3913 1 17 . 1 1 11 11 LYS C C 11 172.964 172.964 176.141 -3.177 25541
3914 1 17 . 1 1 11 11 LYS CA C 11 56.122 56.122 55.946 0.176 25541
3915 1 17 . 1 1 11 11 LYS CB C 11 32.819 32.819 32.191 0.628 25541
3916 1 17 . 1 1 11 11 LYS H H 11 8.436 8.436 8.368 0.068 25541
3917 1 17 . 1 1 12 12 LYS N N 12 123.337 123.337 122.287 1.050 25541
3918 1 17 . 1 1 12 12 LYS HA H 12 4.093 4.093 3.448 0.645 25541
3919 1 17 . 1 1 12 12 LYS C C 12 173.147 173.147 174.122 -0.975 25541
3920 1 17 . 1 1 12 12 LYS CA C 12 56.327 56.327 57.490 -1.163 25541
3921 1 17 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.233 0.990 25541
3922 1 17 . 1 1 12 12 LYS H H 12 8.239 8.239 7.755 0.484 25541
3923 1 17 . 1 1 13 13 TYR N N 13 119.233 119.233 116.007 3.226 25541
3924 1 17 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.649 -0.248 25541
3925 1 17 . 1 1 13 13 TYR C C 13 172.016 172.016 174.727 -2.711 25541
3926 1 17 . 1 1 13 13 TYR CA C 13 57.325 57.325 56.789 0.536 25541
3927 1 17 . 1 1 13 13 TYR CB C 13 39.864 39.864 41.315 -1.451 25541
3928 1 17 . 1 1 13 13 TYR H H 13 8.274 8.274 8.024 0.250 25541
3929 1 17 . 1 1 14 14 ASP N N 14 120.486 120.486 122.772 -2.286 25541
3930 1 17 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.975 -0.298 25541
3931 1 17 . 1 1 14 14 ASP C C 14 173.276 173.276 176.083 -2.807 25541
3932 1 17 . 1 1 14 14 ASP CA C 14 52.719 52.719 53.739 -1.020 25541
3933 1 17 . 1 1 14 14 ASP CB C 14 40.205 40.205 40.816 -0.610 25541
3934 1 17 . 1 1 14 14 ASP H H 14 8.603 8.603 8.693 -0.090 25541
3935 1 17 . 1 1 15 15 LEU N N 15 126.405 126.405 127.144 -0.739 25541
3936 1 17 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.047 -1.282 25541
3937 1 17 . 1 1 15 15 LEU C C 15 175.592 175.592 176.959 -1.367 25541
3938 1 17 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.024 -0.769 25541
3939 1 17 . 1 1 15 15 LEU CB C 15 39.967 39.967 40.704 -0.737 25541
3940 1 17 . 1 1 15 15 LEU H H 15 8.901 8.901 8.659 0.242 25541
3941 1 17 . 1 1 16 16 SER N N 16 116.540 116.540 115.926 0.614 25541
3942 1 17 . 1 1 16 16 SER HA H 16 4.100 4.100 4.200 -0.100 25541
3943 1 17 . 1 1 16 16 SER C C 16 173.247 173.247 174.339 -1.092 25541
3944 1 17 . 1 1 16 16 SER CA C 16 61.720 61.720 60.852 0.868 25541
3945 1 17 . 1 1 16 16 SER CB C 16 62.797 62.797 63.560 -0.763 25541
3946 1 17 . 1 1 16 16 SER H H 16 8.112 8.112 8.262 -0.150 25541
3947 1 17 . 1 1 17 17 LYS N N 17 118.008 118.008 118.561 -0.553 25541
3948 1 17 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.568 -0.067 25541
3949 1 17 . 1 1 17 17 LYS C C 17 175.079 175.079 175.074 0.005 25541
3950 1 17 . 1 1 17 17 LYS CA C 17 55.267 55.267 55.708 -0.441 25541
3951 1 17 . 1 1 17 17 LYS CB C 17 31.977 31.977 33.994 -2.017 25541
3952 1 17 . 1 1 17 17 LYS H H 17 8.521 8.521 7.951 0.570 25541
3953 1 17 . 1 1 18 18 TRP N N 18 122.041 122.041 123.327 -1.286 25541
3954 1 17 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.870 -0.292 25541
3955 1 17 . 1 1 18 18 TRP C C 18 174.862 174.862 174.990 -0.128 25541
3956 1 17 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.462 0.909 25541
3957 1 17 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.228 -3.684 25541
3958 1 17 . 1 1 18 18 TRP H H 18 7.853 7.853 8.670 -0.817 25541
3959 1 17 . 1 1 19 19 LYS N N 19 123.185 123.185 121.060 2.125 25541
3960 1 17 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.693 -0.158 25541
3961 1 17 . 1 1 19 19 LYS C C 19 175.094 175.094 177.030 -1.936 25541
3962 1 17 . 1 1 19 19 LYS CA C 19 55.427 55.427 55.178 0.249 25541
3963 1 17 . 1 1 19 19 LYS CB C 19 33.120 33.120 34.832 -1.712 25541
3964 1 17 . 1 1 19 19 LYS H H 19 9.544 9.544 8.305 1.239 25541
3965 1 17 . 1 1 20 20 TYR N N 20 124.291 124.291 125.040 -0.749 25541
3966 1 17 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.043 -0.018 25541
3967 1 17 . 1 1 20 20 TYR C C 20 174.531 174.531 177.184 -2.653 25541
3968 1 17 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.571 0.578 25541
3969 1 17 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.286 -0.133 25541
3970 1 17 . 1 1 20 20 TYR H H 20 9.266 9.266 9.198 0.068 25541
3971 1 17 . 1 1 21 21 ALA N N 21 117.781 117.781 121.379 -3.598 25541
3972 1 17 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.250 -0.377 25541
3973 1 17 . 1 1 21 21 ALA C C 21 176.314 176.314 179.673 -3.359 25541
3974 1 17 . 1 1 21 21 ALA CA C 21 55.335 55.335 55.290 0.045 25541
3975 1 17 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.724 0.979 25541
3976 1 17 . 1 1 21 21 ALA H H 21 8.986 8.986 8.591 0.395 25541
3977 1 17 . 1 1 22 22 GLU N N 22 115.218 115.218 119.130 -3.912 25541
3978 1 17 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.142 -0.023 25541
3979 1 17 . 1 1 22 22 GLU C C 22 177.380 177.380 179.391 -2.011 25541
3980 1 17 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.427 -0.948 25541
3981 1 17 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.363 0.507 25541
3982 1 17 . 1 1 22 22 GLU H H 22 6.854 6.854 8.477 -1.623 25541
3983 1 17 . 1 1 23 23 LEU N N 23 122.132 122.132 120.284 1.848 25541
3984 1 17 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.131 0.025 25541
3985 1 17 . 1 1 23 23 LEU C C 23 174.830 174.830 179.694 -4.864 25541
3986 1 17 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.192 0.330 25541
3987 1 17 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.734 1.385 25541
3988 1 17 . 1 1 23 23 LEU H H 23 7.909 7.909 9.041 -1.132 25541
3989 1 17 . 1 1 24 24 ARG N N 24 118.051 118.051 118.541 -0.490 25541
3990 1 17 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.921 -0.284 25541
3991 1 17 . 1 1 24 24 ARG C C 24 175.240 175.240 178.447 -3.207 25541
3992 1 17 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.776 0.200 25541
3993 1 17 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.682 0.180 25541
3994 1 17 . 1 1 24 24 ARG H H 24 8.250 8.250 8.142 0.108 25541
3995 1 17 . 1 1 25 25 ASP N N 25 118.179 118.179 118.782 -0.603 25541
3996 1 17 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.476 -0.091 25541
3997 1 17 . 1 1 25 25 ASP C C 25 176.554 176.554 178.185 -1.631 25541
3998 1 17 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.364 -0.008 25541
3999 1 17 . 1 1 25 25 ASP CB C 25 40.042 40.042 41.092 -1.050 25541
4000 1 17 . 1 1 25 25 ASP H H 25 8.507 8.507 8.352 0.155 25541
4001 1 17 . 1 1 26 26 THR N N 26 118.299 118.299 116.959 1.340 25541
4002 1 17 . 1 1 26 26 THR HA H 26 3.891 3.891 4.017 -0.126 25541
4003 1 17 . 1 1 26 26 THR C C 26 173.365 173.365 176.562 -3.197 25541
4004 1 17 . 1 1 26 26 THR CA C 26 67.787 67.787 66.237 1.550 25541
4005 1 17 . 1 1 26 26 THR CB C 26 68.120 68.120 69.079 -0.959 25541
4006 1 17 . 1 1 26 26 THR H H 26 7.918 7.918 8.363 -0.445 25541
4007 1 17 . 1 1 27 27 ILE N N 27 122.576 122.576 118.209 4.367 25541
4008 1 17 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.864 -0.239 25541
4009 1 17 . 1 1 27 27 ILE C C 27 174.485 174.485 176.407 -1.922 25541
4010 1 17 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.063 0.648 25541
4011 1 17 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.757 -0.230 25541
4012 1 17 . 1 1 27 27 ILE H H 27 8.159 8.159 7.482 0.677 25541
4013 1 17 . 1 1 28 28 ASN N N 28 115.118 115.118 116.043 -0.925 25541
4014 1 17 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.744 -0.129 25541
4015 1 17 . 1 1 28 28 ASN C C 28 173.902 173.902 175.084 -1.182 25541
4016 1 17 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.770 0.690 25541
4017 1 17 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.442 -0.212 25541
4018 1 17 . 1 1 28 28 ASN H H 28 7.713 7.713 7.760 -0.047 25541
4019 1 17 . 1 1 29 29 THR N N 29 107.730 107.730 108.286 -0.556 25541
4020 1 17 . 1 1 29 29 THR HA H 29 4.600 4.600 4.401 0.199 25541
4021 1 17 . 1 1 29 29 THR C C 29 172.290 172.290 174.903 -2.613 25541
4022 1 17 . 1 1 29 29 THR CA C 29 62.595 62.595 62.270 0.325 25541
4023 1 17 . 1 1 29 29 THR CB C 29 72.291 72.291 70.179 2.112 25541
4024 1 17 . 1 1 29 29 THR H H 29 7.587 7.587 7.496 0.091 25541
4025 1 17 . 1 1 30 30 SER N N 30 117.784 117.784 118.069 -0.285 25541
4026 1 17 . 1 1 30 30 SER HA H 30 4.296 4.296 4.558 -0.262 25541
4027 1 17 . 1 1 30 30 SER C C 30 172.473 172.473 173.076 -0.603 25541
4028 1 17 . 1 1 30 30 SER CA C 30 59.618 59.618 58.864 0.754 25541
4029 1 17 . 1 1 30 30 SER CB C 30 64.402 64.402 64.264 0.138 25541
4030 1 17 . 1 1 30 30 SER H H 30 8.698 8.698 8.369 0.329 25541
4031 1 17 . 1 1 31 31 CYS N N 31 121.196 121.196 119.569 1.627 25541
4032 1 17 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.697 0.090 25541
4033 1 17 . 1 1 31 31 CYS C C 31 170.861 170.861 172.603 -1.742 25541
4034 1 17 . 1 1 31 31 CYS CA C 31 57.372 57.372 59.347 -1.975 25541
4035 1 17 . 1 1 31 31 CYS CB C 31 28.364 28.364 28.667 -0.303 25541
4036 1 17 . 1 1 31 31 CYS H H 31 8.713 8.713 8.388 0.325 25541
4037 1 17 . 1 1 32 32 ASP N N 32 124.610 124.610 125.932 -1.322 25541
4038 1 17 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.784 -0.171 25541
4039 1 17 . 1 1 32 32 ASP C C 32 172.541 172.541 175.600 -3.059 25541
4040 1 17 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.169 -0.983 25541
4041 1 17 . 1 1 32 32 ASP CB C 32 41.137 41.137 42.907 -1.770 25541
4042 1 17 . 1 1 32 32 ASP H H 32 8.542 8.542 8.127 0.415 25541
4043 1 17 . 1 1 33 33 ILE N N 33 125.134 125.134 121.722 3.412 25541
4044 1 17 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.038 -0.352 25541
4045 1 17 . 1 1 33 33 ILE C C 33 175.743 175.743 176.098 -0.355 25541
4046 1 17 . 1 1 33 33 ILE CA C 33 64.710 64.710 63.002 1.708 25541
4047 1 17 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.905 -0.090 25541
4048 1 17 . 1 1 33 33 ILE H H 33 8.459 8.459 8.583 -0.124 25541
4049 1 17 . 1 1 34 34 GLU N N 34 121.097 121.097 119.862 1.235 25541
4050 1 17 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.363 -0.232 25541
4051 1 17 . 1 1 34 34 GLU C C 34 176.406 176.406 178.045 -1.639 25541
4052 1 17 . 1 1 34 34 GLU CA C 34 59.333 59.333 57.873 1.460 25541
4053 1 17 . 1 1 34 34 GLU CB C 34 29.675 29.675 30.189 -0.514 25541
4054 1 17 . 1 1 34 34 GLU H H 34 8.177 8.177 7.775 0.402 25541
4055 1 17 . 1 1 35 35 LEU N N 35 124.890 124.890 121.023 3.867 25541
4056 1 17 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.885 -0.274 25541
4057 1 17 . 1 1 35 35 LEU C C 35 176.399 176.399 178.876 -2.477 25541
4058 1 17 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.866 -0.798 25541
4059 1 17 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.765 -0.855 25541
4060 1 17 . 1 1 35 35 LEU H H 35 7.831 7.831 7.771 0.060 25541
4061 1 17 . 1 1 36 36 LEU N N 36 120.493 120.493 118.726 1.767 25541
4062 1 17 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.729 -0.070 25541
4063 1 17 . 1 1 36 36 LEU C C 36 176.280 176.280 178.910 -2.630 25541
4064 1 17 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.172 0.443 25541
4065 1 17 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.965 1.504 25541
4066 1 17 . 1 1 36 36 LEU H H 36 8.843 8.843 7.491 1.352 25541
4067 1 17 . 1 1 37 37 ALA N N 37 119.956 119.956 120.645 -0.689 25541
4068 1 17 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.949 0.048 25541
4069 1 17 . 1 1 37 37 ALA C C 37 177.606 177.606 179.489 -1.883 25541
4070 1 17 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.772 0.397 25541
4071 1 17 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.871 -0.251 25541
4072 1 17 . 1 1 37 37 ALA H H 37 7.610 7.610 8.242 -0.632 25541
4073 1 17 . 1 1 38 38 ALA N N 38 121.594 121.594 121.371 0.223 25541
4074 1 17 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.533 -0.430 25541
4075 1 17 . 1 1 38 38 ALA C C 38 178.452 178.452 179.042 -0.590 25541
4076 1 17 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.064 0.791 25541
4077 1 17 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.454 -0.394 25541
4078 1 17 . 1 1 38 38 ALA H H 38 7.665 7.665 8.126 -0.461 25541
4079 1 17 . 1 1 39 39 CYS N N 39 119.263 119.263 117.934 1.329 25541
4080 1 17 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.805 -0.074 25541
4081 1 17 . 1 1 39 39 CYS C C 39 173.860 173.860 176.731 -2.871 25541
4082 1 17 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.488 1.335 25541
4083 1 17 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.483 -0.258 25541
4084 1 17 . 1 1 39 39 CYS H H 39 8.766 8.766 8.494 0.272 25541
4085 1 17 . 1 1 40 40 ARG N N 40 119.658 119.658 119.210 0.448 25541
4086 1 17 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.862 0.036 25541
4087 1 17 . 1 1 40 40 ARG C C 40 176.108 176.108 178.467 -2.359 25541
4088 1 17 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.631 0.851 25541
4089 1 17 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.689 0.175 25541
4090 1 17 . 1 1 40 40 ARG H H 40 8.327 8.327 8.477 -0.150 25541
4091 1 17 . 1 1 41 41 GLU N N 41 119.358 119.358 118.261 1.097 25541
4092 1 17 . 1 1 41 41 GLU HA H 41 4.099 4.099 3.827 0.272 25541
4093 1 17 . 1 1 41 41 GLU C C 41 171.786 171.786 178.751 -6.965 25541
4094 1 17 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.346 -0.133 25541
4095 1 17 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.276 0.001 25541
4096 1 17 . 1 1 41 41 GLU H H 41 7.929 7.929 7.738 0.191 25541
4097 1 17 . 1 1 42 42 GLU N N 42 121.281 121.281 119.308 1.973 25541
4098 1 17 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.122 0.101 25541
4099 1 17 . 1 1 42 42 GLU C C 42 173.408 173.408 178.907 -5.499 25541
4100 1 17 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.617 -0.298 25541
4101 1 17 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.480 -1.266 25541
4102 1 17 . 1 1 42 42 GLU H H 42 7.945 7.945 7.701 0.244 25541
4103 1 17 . 1 1 43 43 PHE N N 43 119.271 119.271 121.123 -1.852 25541
4104 1 17 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.051 0.026 25541
4105 1 17 . 1 1 43 43 PHE C C 43 175.299 175.299 177.478 -2.179 25541
4106 1 17 . 1 1 43 43 PHE CA C 43 61.549 61.549 62.058 -0.509 25541
4107 1 17 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.234 -0.100 25541
4108 1 17 . 1 1 43 43 PHE H H 43 8.624 8.624 8.465 0.159 25541
4109 1 17 . 1 1 44 44 HIS N N 44 116.374 116.374 116.979 -0.605 25541
4110 1 17 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.318 -0.052 25541
4111 1 17 . 1 1 44 44 HIS C C 44 174.771 174.771 177.890 -3.119 25541
4112 1 17 . 1 1 44 44 HIS CA C 44 59.343 59.343 59.143 0.200 25541
4113 1 17 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.748 -0.260 25541
4114 1 17 . 1 1 44 44 HIS H H 44 7.976 7.976 8.082 -0.106 25541
4115 1 17 . 1 1 45 45 ARG N N 45 120.170 120.170 118.239 1.931 25541
4116 1 17 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.060 -0.114 25541
4117 1 17 . 1 1 45 45 ARG C C 45 176.310 176.310 178.441 -2.131 25541
4118 1 17 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.484 -0.278 25541
4119 1 17 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.771 0.617 25541
4120 1 17 . 1 1 45 45 ARG H H 45 8.166 8.166 7.811 0.355 25541
4121 1 17 . 1 1 46 46 ARG N N 46 116.229 116.229 118.595 -2.366 25541
4122 1 17 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.149 -0.084 25541
4123 1 17 . 1 1 46 46 ARG C C 46 176.046 176.046 177.820 -1.774 25541
4124 1 17 . 1 1 46 46 ARG CA C 46 57.691 57.691 57.596 0.095 25541
4125 1 17 . 1 1 46 46 ARG CB C 46 30.248 30.248 28.945 1.303 25541
4126 1 17 . 1 1 46 46 ARG H H 46 7.764 7.764 7.445 0.319 25541
4127 1 17 . 1 1 47 47 LEU N N 47 119.010 119.010 119.523 -0.513 25541
4128 1 17 . 1 1 47 47 LEU HA H 47 4.135 4.135 3.932 0.203 25541
4129 1 17 . 1 1 47 47 LEU CA C 47 55.957 55.957 57.000 -1.043 25541
4130 1 17 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.703 0.320 25541
4131 1 17 . 1 1 47 47 LEU H H 47 7.557 7.557 7.503 0.054 25541
4132 1 17 . 1 1 48 48 LYS N N 48 119.277 119.277 119.615 -0.338 25541
4133 1 17 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.127 -0.052 25541
4134 1 17 . 1 1 48 48 LYS C C 48 176.354 176.354 177.349 -0.995 25541
4135 1 17 . 1 1 48 48 LYS CA C 48 56.655 56.655 58.832 -2.177 25541
4136 1 17 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.955 -0.545 25541
4137 1 17 . 1 1 48 48 LYS H H 48 7.662 7.662 7.366 0.296 25541
4138 1 17 . 1 1 49 49 VAL N N 49 119.095 119.095 121.093 -1.998 25541
4139 1 17 . 1 1 49 49 VAL HA H 49 3.972 3.972 3.806 0.166 25541
4140 1 17 . 1 1 49 49 VAL C C 49 174.195 174.195 175.091 -0.896 25541
4141 1 17 . 1 1 49 49 VAL CA C 49 62.214 62.214 64.030 -1.816 25541
4142 1 17 . 1 1 49 49 VAL CB C 49 32.747 32.747 32.042 0.705 25541
4143 1 17 . 1 1 49 49 VAL H H 49 7.688 7.688 7.553 0.135 25541
4144 1 17 . 1 1 50 50 TYR N N 50 123.606 123.606 126.109 -2.503 25541
4145 1 17 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.092 0.390 25541
4146 1 17 . 1 1 50 50 TYR CA C 50 57.855 57.855 59.174 -1.319 25541
4147 1 17 . 1 1 50 50 TYR CB C 50 38.721 38.721 36.464 2.257 25541
4148 1 17 . 1 1 50 50 TYR H H 50 8.164 8.164 8.460 -0.296 25541
4149 1 18 . 1 1 10 10 THR N N 10 114.351 114.351 115.268 -0.917 25541
4150 1 18 . 1 1 10 10 THR HA H 10 4.241 4.241 4.441 -0.200 25541
4151 1 18 . 1 1 10 10 THR C C 10 171.741 171.741 173.279 -1.538 25541
4152 1 18 . 1 1 10 10 THR CA C 10 62.002 62.002 62.140 -0.138 25541
4153 1 18 . 1 1 10 10 THR CB C 10 69.796 69.796 70.113 -0.317 25541
4154 1 18 . 1 1 10 10 THR H H 10 8.114 8.114 7.883 0.231 25541
4155 1 18 . 1 1 11 11 LYS N N 11 124.677 124.677 125.147 -0.470 25541
4156 1 18 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.411 -0.247 25541
4157 1 18 . 1 1 11 11 LYS C C 11 172.964 172.964 175.333 -2.369 25541
4158 1 18 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.654 -0.532 25541
4159 1 18 . 1 1 11 11 LYS CB C 11 32.819 32.819 33.363 -0.544 25541
4160 1 18 . 1 1 11 11 LYS H H 11 8.436 8.436 8.401 0.035 25541
4161 1 18 . 1 1 12 12 LYS N N 12 123.337 123.337 123.632 -0.295 25541
4162 1 18 . 1 1 12 12 LYS HA H 12 4.093 4.093 4.085 0.008 25541
4163 1 18 . 1 1 12 12 LYS C C 12 173.147 173.147 175.405 -2.258 25541
4164 1 18 . 1 1 12 12 LYS CA C 12 56.327 56.327 55.089 1.238 25541
4165 1 18 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.833 0.390 25541
4166 1 18 . 1 1 12 12 LYS H H 12 8.239 8.239 8.079 0.160 25541
4167 1 18 . 1 1 13 13 TYR N N 13 119.233 119.233 118.380 0.853 25541
4168 1 18 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.637 -0.236 25541
4169 1 18 . 1 1 13 13 TYR C C 13 172.016 172.016 174.376 -2.360 25541
4170 1 18 . 1 1 13 13 TYR CA C 13 57.325 57.325 56.817 0.508 25541
4171 1 18 . 1 1 13 13 TYR CB C 13 39.864 39.864 40.993 -1.129 25541
4172 1 18 . 1 1 13 13 TYR H H 13 8.274 8.274 8.212 0.062 25541
4173 1 18 . 1 1 14 14 ASP N N 14 120.486 120.486 122.389 -1.903 25541
4174 1 18 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.855 -0.178 25541
4175 1 18 . 1 1 14 14 ASP C C 14 173.276 173.276 176.072 -2.796 25541
4176 1 18 . 1 1 14 14 ASP CA C 14 52.719 52.719 54.007 -1.288 25541
4177 1 18 . 1 1 14 14 ASP CB C 14 40.205 40.205 40.824 -0.619 25541
4178 1 18 . 1 1 14 14 ASP H H 14 8.603 8.603 8.754 -0.151 25541
4179 1 18 . 1 1 15 15 LEU N N 15 126.405 126.405 125.020 1.385 25541
4180 1 18 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.067 -1.302 25541
4181 1 18 . 1 1 15 15 LEU C C 15 175.592 175.592 177.096 -1.504 25541
4182 1 18 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.133 -0.878 25541
4183 1 18 . 1 1 15 15 LEU CB C 15 39.967 39.967 41.091 -1.124 25541
4184 1 18 . 1 1 15 15 LEU H H 15 8.901 8.901 8.570 0.331 25541
4185 1 18 . 1 1 16 16 SER N N 16 116.540 116.540 116.077 0.463 25541
4186 1 18 . 1 1 16 16 SER HA H 16 4.100 4.100 4.236 -0.136 25541
4187 1 18 . 1 1 16 16 SER C C 16 173.247 173.247 174.717 -1.470 25541
4188 1 18 . 1 1 16 16 SER CA C 16 61.720 61.720 60.782 0.938 25541
4189 1 18 . 1 1 16 16 SER CB C 16 62.797 62.797 63.405 -0.608 25541
4190 1 18 . 1 1 16 16 SER H H 16 8.112 8.112 8.537 -0.425 25541
4191 1 18 . 1 1 17 17 LYS N N 17 118.008 118.008 120.008 -2.000 25541
4192 1 18 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.670 -0.169 25541
4193 1 18 . 1 1 17 17 LYS C C 17 175.079 175.079 175.089 -0.010 25541
4194 1 18 . 1 1 17 17 LYS CA C 17 55.267 55.267 55.828 -0.561 25541
4195 1 18 . 1 1 17 17 LYS CB C 17 31.977 31.977 33.917 -1.940 25541
4196 1 18 . 1 1 17 17 LYS H H 17 8.521 8.521 8.303 0.218 25541
4197 1 18 . 1 1 18 18 TRP N N 18 122.041 122.041 122.846 -0.805 25541
4198 1 18 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.771 -0.193 25541
4199 1 18 . 1 1 18 18 TRP C C 18 174.862 174.862 174.593 0.269 25541
4200 1 18 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.222 1.149 25541
4201 1 18 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.067 -3.523 25541
4202 1 18 . 1 1 18 18 TRP H H 18 7.853 7.853 8.436 -0.583 25541
4203 1 18 . 1 1 19 19 LYS N N 19 123.185 123.185 120.801 2.384 25541
4204 1 18 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.632 -0.097 25541
4205 1 18 . 1 1 19 19 LYS C C 19 175.094 175.094 177.341 -2.247 25541
4206 1 18 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.877 0.550 25541
4207 1 18 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.630 -0.510 25541
4208 1 18 . 1 1 19 19 LYS H H 19 9.544 9.544 8.328 1.216 25541
4209 1 18 . 1 1 20 20 TYR N N 20 124.291 124.291 126.255 -1.964 25541
4210 1 18 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.079 -0.054 25541
4211 1 18 . 1 1 20 20 TYR C C 20 174.531 174.531 177.318 -2.787 25541
4212 1 18 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.563 0.586 25541
4213 1 18 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.484 -0.331 25541
4214 1 18 . 1 1 20 20 TYR H H 20 9.266 9.266 9.208 0.058 25541
4215 1 18 . 1 1 21 21 ALA N N 21 117.781 117.781 121.546 -3.765 25541
4216 1 18 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.239 -0.366 25541
4217 1 18 . 1 1 21 21 ALA C C 21 176.314 176.314 179.579 -3.265 25541
4218 1 18 . 1 1 21 21 ALA CA C 21 55.335 55.335 55.236 0.099 25541
4219 1 18 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.794 0.909 25541
4220 1 18 . 1 1 21 21 ALA H H 21 8.986 8.986 8.556 0.430 25541
4221 1 18 . 1 1 22 22 GLU N N 22 115.218 115.218 119.123 -3.905 25541
4222 1 18 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.126 -0.007 25541
4223 1 18 . 1 1 22 22 GLU C C 22 177.380 177.380 179.431 -2.051 25541
4224 1 18 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.441 -0.962 25541
4225 1 18 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.278 0.592 25541
4226 1 18 . 1 1 22 22 GLU H H 22 6.854 6.854 8.602 -1.748 25541
4227 1 18 . 1 1 23 23 LEU N N 23 122.132 122.132 120.283 1.849 25541
4228 1 18 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.068 0.088 25541
4229 1 18 . 1 1 23 23 LEU C C 23 174.830 174.830 179.371 -4.541 25541
4230 1 18 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.481 0.041 25541
4231 1 18 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.760 1.359 25541
4232 1 18 . 1 1 23 23 LEU H H 23 7.909 7.909 8.967 -1.058 25541
4233 1 18 . 1 1 24 24 ARG N N 24 118.051 118.051 118.441 -0.390 25541
4234 1 18 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.884 -0.247 25541
4235 1 18 . 1 1 24 24 ARG C C 24 175.240 175.240 178.342 -3.102 25541
4236 1 18 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.739 0.238 25541
4237 1 18 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.741 0.121 25541
4238 1 18 . 1 1 24 24 ARG H H 24 8.250 8.250 7.795 0.455 25541
4239 1 18 . 1 1 25 25 ASP N N 25 118.179 118.179 118.319 -0.140 25541
4240 1 18 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.517 -0.132 25541
4241 1 18 . 1 1 25 25 ASP C C 25 176.554 176.554 178.119 -1.565 25541
4242 1 18 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.216 0.140 25541
4243 1 18 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.925 -0.883 25541
4244 1 18 . 1 1 25 25 ASP H H 25 8.507 8.507 8.529 -0.022 25541
4245 1 18 . 1 1 26 26 THR N N 26 118.299 118.299 116.255 2.044 25541
4246 1 18 . 1 1 26 26 THR HA H 26 3.891 3.891 4.046 -0.155 25541
4247 1 18 . 1 1 26 26 THR C C 26 173.365 173.365 176.448 -3.083 25541
4248 1 18 . 1 1 26 26 THR CA C 26 67.787 67.787 66.536 1.251 25541
4249 1 18 . 1 1 26 26 THR CB C 26 68.120 68.120 68.887 -0.767 25541
4250 1 18 . 1 1 26 26 THR H H 26 7.918 7.918 8.382 -0.464 25541
4251 1 18 . 1 1 27 27 ILE N N 27 122.576 122.576 118.930 3.646 25541
4252 1 18 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.814 -0.190 25541
4253 1 18 . 1 1 27 27 ILE C C 27 174.485 174.485 176.284 -1.799 25541
4254 1 18 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.271 0.440 25541
4255 1 18 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.672 -0.145 25541
4256 1 18 . 1 1 27 27 ILE H H 27 8.159 8.159 7.423 0.736 25541
4257 1 18 . 1 1 28 28 ASN N N 28 115.118 115.118 116.403 -1.285 25541
4258 1 18 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.729 -0.114 25541
4259 1 18 . 1 1 28 28 ASN C C 28 173.902 173.902 174.940 -1.038 25541
4260 1 18 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.747 0.713 25541
4261 1 18 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.231 -0.001 25541
4262 1 18 . 1 1 28 28 ASN H H 28 7.713 7.713 7.733 -0.020 25541
4263 1 18 . 1 1 29 29 THR N N 29 107.730 107.730 109.134 -1.404 25541
4264 1 18 . 1 1 29 29 THR HA H 29 4.600 4.600 4.431 0.169 25541
4265 1 18 . 1 1 29 29 THR C C 29 172.290 172.290 174.861 -2.571 25541
4266 1 18 . 1 1 29 29 THR CA C 29 62.595 62.595 62.891 -0.296 25541
4267 1 18 . 1 1 29 29 THR CB C 29 72.291 72.291 70.037 2.254 25541
4268 1 18 . 1 1 29 29 THR H H 29 7.587 7.587 7.526 0.061 25541
4269 1 18 . 1 1 30 30 SER N N 30 117.784 117.784 118.603 -0.819 25541
4270 1 18 . 1 1 30 30 SER HA H 30 4.296 4.296 4.547 -0.251 25541
4271 1 18 . 1 1 30 30 SER C C 30 172.473 172.473 173.241 -0.768 25541
4272 1 18 . 1 1 30 30 SER CA C 30 59.618 59.618 58.202 1.417 25541
4273 1 18 . 1 1 30 30 SER CB C 30 64.402 64.402 64.399 0.003 25541
4274 1 18 . 1 1 30 30 SER H H 30 8.698 8.698 8.429 0.269 25541
4275 1 18 . 1 1 31 31 CYS N N 31 121.196 121.196 119.760 1.436 25541
4276 1 18 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.620 0.167 25541
4277 1 18 . 1 1 31 31 CYS C C 31 170.861 170.861 172.289 -1.428 25541
4278 1 18 . 1 1 31 31 CYS CA C 31 57.372 57.372 58.800 -1.428 25541
4279 1 18 . 1 1 31 31 CYS CB C 31 28.364 28.364 28.710 -0.346 25541
4280 1 18 . 1 1 31 31 CYS H H 31 8.713 8.713 8.446 0.267 25541
4281 1 18 . 1 1 32 32 ASP N N 32 124.610 124.610 126.685 -2.075 25541
4282 1 18 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.722 -0.109 25541
4283 1 18 . 1 1 32 32 ASP C C 32 172.541 172.541 175.488 -2.947 25541
4284 1 18 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.045 -0.860 25541
4285 1 18 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.324 -2.187 25541
4286 1 18 . 1 1 32 32 ASP H H 32 8.542 8.542 8.328 0.214 25541
4287 1 18 . 1 1 33 33 ILE N N 33 125.134 125.134 122.719 2.415 25541
4288 1 18 . 1 1 33 33 ILE HA H 33 3.686 3.686 3.869 -0.183 25541
4289 1 18 . 1 1 33 33 ILE C C 33 175.743 175.743 176.177 -0.434 25541
4290 1 18 . 1 1 33 33 ILE CA C 33 64.710 64.710 63.072 1.638 25541
4291 1 18 . 1 1 33 33 ILE CB C 33 37.815 37.815 38.001 -0.186 25541
4292 1 18 . 1 1 33 33 ILE H H 33 8.459 8.459 8.509 -0.050 25541
4293 1 18 . 1 1 34 34 GLU N N 34 121.097 121.097 118.849 2.248 25541
4294 1 18 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.298 -0.167 25541
4295 1 18 . 1 1 34 34 GLU C C 34 176.406 176.406 178.034 -1.628 25541
4296 1 18 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.216 1.117 25541
4297 1 18 . 1 1 34 34 GLU CB C 34 29.675 29.675 29.223 0.452 25541
4298 1 18 . 1 1 34 34 GLU H H 34 8.177 8.177 7.978 0.199 25541
4299 1 18 . 1 1 35 35 LEU N N 35 124.890 124.890 121.638 3.252 25541
4300 1 18 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.839 -0.228 25541
4301 1 18 . 1 1 35 35 LEU C C 35 176.399 176.399 179.010 -2.611 25541
4302 1 18 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.646 -0.578 25541
4303 1 18 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.566 -0.656 25541
4304 1 18 . 1 1 35 35 LEU H H 35 7.831 7.831 7.914 -0.083 25541
4305 1 18 . 1 1 36 36 LEU N N 36 120.493 120.493 118.510 1.983 25541
4306 1 18 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.741 -0.082 25541
4307 1 18 . 1 1 36 36 LEU C C 36 176.280 176.280 178.937 -2.657 25541
4308 1 18 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.090 0.525 25541
4309 1 18 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.984 1.485 25541
4310 1 18 . 1 1 36 36 LEU H H 36 8.843 8.843 7.699 1.144 25541
4311 1 18 . 1 1 37 37 ALA N N 37 119.956 119.956 120.594 -0.638 25541
4312 1 18 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.926 0.071 25541
4313 1 18 . 1 1 37 37 ALA C C 37 177.606 177.606 179.520 -1.914 25541
4314 1 18 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.775 0.394 25541
4315 1 18 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.868 -0.248 25541
4316 1 18 . 1 1 37 37 ALA H H 37 7.610 7.610 8.141 -0.531 25541
4317 1 18 . 1 1 38 38 ALA N N 38 121.594 121.594 120.964 0.630 25541
4318 1 18 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.062 0.041 25541
4319 1 18 . 1 1 38 38 ALA C C 38 178.452 178.452 178.815 -0.363 25541
4320 1 18 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.641 0.214 25541
4321 1 18 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.371 -0.311 25541
4322 1 18 . 1 1 38 38 ALA H H 38 7.665 7.665 8.170 -0.505 25541
4323 1 18 . 1 1 39 39 CYS N N 39 119.263 119.263 118.105 1.158 25541
4324 1 18 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.822 -0.091 25541
4325 1 18 . 1 1 39 39 CYS C C 39 173.860 173.860 176.710 -2.850 25541
4326 1 18 . 1 1 39 39 CYS CA C 39 63.823 63.823 63.424 0.399 25541
4327 1 18 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.618 -0.393 25541
4328 1 18 . 1 1 39 39 CYS H H 39 8.766 8.766 8.563 0.203 25541
4329 1 18 . 1 1 40 40 ARG N N 40 119.658 119.658 118.525 1.133 25541
4330 1 18 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.801 0.097 25541
4331 1 18 . 1 1 40 40 ARG C C 40 176.108 176.108 178.539 -2.431 25541
4332 1 18 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.525 0.957 25541
4333 1 18 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.647 0.217 25541
4334 1 18 . 1 1 40 40 ARG H H 40 8.327 8.327 8.294 0.033 25541
4335 1 18 . 1 1 41 41 GLU N N 41 119.358 119.358 118.300 1.058 25541
4336 1 18 . 1 1 41 41 GLU HA H 41 4.099 4.099 3.879 0.220 25541
4337 1 18 . 1 1 41 41 GLU C C 41 171.786 171.786 178.706 -6.920 25541
4338 1 18 . 1 1 41 41 GLU CA C 41 59.213 59.213 58.984 0.229 25541
4339 1 18 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.556 -0.279 25541
4340 1 18 . 1 1 41 41 GLU H H 41 7.929 7.929 7.468 0.461 25541
4341 1 18 . 1 1 42 42 GLU N N 42 121.281 121.281 119.748 1.533 25541
4342 1 18 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.097 0.126 25541
4343 1 18 . 1 1 42 42 GLU C C 42 173.408 173.408 178.765 -5.357 25541
4344 1 18 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.477 -0.158 25541
4345 1 18 . 1 1 42 42 GLU CB C 42 28.215 28.215 28.900 -0.685 25541
4346 1 18 . 1 1 42 42 GLU H H 42 7.945 7.945 7.811 0.134 25541
4347 1 18 . 1 1 43 43 PHE N N 43 119.271 119.271 120.997 -1.726 25541
4348 1 18 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.096 -0.019 25541
4349 1 18 . 1 1 43 43 PHE C C 43 175.299 175.299 177.122 -1.823 25541
4350 1 18 . 1 1 43 43 PHE CA C 43 61.549 61.549 62.046 -0.497 25541
4351 1 18 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.288 -0.154 25541
4352 1 18 . 1 1 43 43 PHE H H 43 8.624 8.624 8.572 0.052 25541
4353 1 18 . 1 1 44 44 HIS N N 44 116.374 116.374 116.881 -0.507 25541
4354 1 18 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.357 -0.091 25541
4355 1 18 . 1 1 44 44 HIS C C 44 174.771 174.771 177.889 -3.118 25541
4356 1 18 . 1 1 44 44 HIS CA C 44 59.343 59.343 58.717 0.626 25541
4357 1 18 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.784 -0.296 25541
4358 1 18 . 1 1 44 44 HIS H H 44 7.976 7.976 7.676 0.300 25541
4359 1 18 . 1 1 45 45 ARG N N 45 120.170 120.170 118.824 1.346 25541
4360 1 18 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.065 -0.119 25541
4361 1 18 . 1 1 45 45 ARG C C 45 176.310 176.310 177.688 -1.378 25541
4362 1 18 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.087 0.119 25541
4363 1 18 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.887 0.501 25541
4364 1 18 . 1 1 45 45 ARG H H 45 8.166 8.166 7.480 0.686 25541
4365 1 18 . 1 1 46 46 ARG N N 46 116.229 116.229 116.001 0.228 25541
4366 1 18 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.099 -0.034 25541
4367 1 18 . 1 1 46 46 ARG C C 46 176.046 176.046 178.144 -2.098 25541
4368 1 18 . 1 1 46 46 ARG CA C 46 57.691 57.691 57.968 -0.277 25541
4369 1 18 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.736 0.512 25541
4370 1 18 . 1 1 46 46 ARG H H 46 7.764 7.764 7.477 0.287 25541
4371 1 18 . 1 1 47 47 LEU N N 47 119.010 119.010 119.340 -0.330 25541
4372 1 18 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.086 0.049 25541
4373 1 18 . 1 1 47 47 LEU CA C 47 55.957 55.957 56.923 -0.966 25541
4374 1 18 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.955 0.069 25541
4375 1 18 . 1 1 47 47 LEU H H 47 7.557 7.557 7.586 -0.029 25541
4376 1 18 . 1 1 48 48 LYS N N 48 119.277 119.277 119.519 -0.242 25541
4377 1 18 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.216 -0.141 25541
4378 1 18 . 1 1 48 48 LYS C C 48 176.354 176.354 177.364 -1.010 25541
4379 1 18 . 1 1 48 48 LYS CA C 48 56.655 56.655 56.706 -0.051 25541
4380 1 18 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.539 -0.129 25541
4381 1 18 . 1 1 48 48 LYS H H 48 7.662 7.662 7.504 0.158 25541
4382 1 18 . 1 1 49 49 VAL N N 49 119.095 119.095 120.960 -1.865 25541
4383 1 18 . 1 1 49 49 VAL HA H 49 3.972 3.972 3.991 -0.019 25541
4384 1 18 . 1 1 49 49 VAL C C 49 174.195 174.195 174.202 -0.007 25541
4385 1 18 . 1 1 49 49 VAL CA C 49 62.214 62.214 62.766 -0.552 25541
4386 1 18 . 1 1 49 49 VAL CB C 49 32.747 32.747 32.315 0.432 25541
4387 1 18 . 1 1 49 49 VAL H H 49 7.688 7.688 7.948 -0.260 25541
4388 1 18 . 1 1 50 50 TYR N N 50 123.606 123.606 128.254 -4.648 25541
4389 1 18 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.518 -0.035 25541
4390 1 18 . 1 1 50 50 TYR CA C 50 57.855 57.855 56.327 1.528 25541
4391 1 18 . 1 1 50 50 TYR CB C 50 38.721 38.721 39.751 -1.030 25541
4392 1 18 . 1 1 50 50 TYR H H 50 8.164 8.164 8.350 -0.186 25541
4393 1 19 . 1 1 10 10 THR N N 10 114.351 114.351 114.113 0.238 25541
4394 1 19 . 1 1 10 10 THR HA H 10 4.241 4.241 4.479 -0.238 25541
4395 1 19 . 1 1 10 10 THR C C 10 171.741 171.741 173.052 -1.311 25541
4396 1 19 . 1 1 10 10 THR CA C 10 62.002 62.002 62.441 -0.439 25541
4397 1 19 . 1 1 10 10 THR CB C 10 69.796 69.796 70.155 -0.359 25541
4398 1 19 . 1 1 10 10 THR H H 10 8.114 8.114 7.923 0.191 25541
4399 1 19 . 1 1 11 11 LYS N N 11 124.677 124.677 126.538 -1.861 25541
4400 1 19 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.430 -0.266 25541
4401 1 19 . 1 1 11 11 LYS C C 11 172.964 172.964 175.635 -2.671 25541
4402 1 19 . 1 1 11 11 LYS CA C 11 56.122 56.122 55.854 0.268 25541
4403 1 19 . 1 1 11 11 LYS CB C 11 32.819 32.819 32.707 0.112 25541
4404 1 19 . 1 1 11 11 LYS H H 11 8.436 8.436 8.456 -0.020 25541
4405 1 19 . 1 1 12 12 LYS N N 12 123.337 123.337 122.780 0.557 25541
4406 1 19 . 1 1 12 12 LYS HA H 12 4.093 4.093 4.159 -0.066 25541
4407 1 19 . 1 1 12 12 LYS C C 12 173.147 173.147 174.801 -1.654 25541
4408 1 19 . 1 1 12 12 LYS CA C 12 56.327 56.327 54.859 1.468 25541
4409 1 19 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.851 0.372 25541
4410 1 19 . 1 1 12 12 LYS H H 12 8.239 8.239 8.303 -0.064 25541
4411 1 19 . 1 1 13 13 TYR N N 13 119.233 119.233 118.452 0.781 25541
4412 1 19 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.796 -0.395 25541
4413 1 19 . 1 1 13 13 TYR C C 13 172.016 172.016 174.715 -2.699 25541
4414 1 19 . 1 1 13 13 TYR CA C 13 57.325 57.325 56.709 0.616 25541
4415 1 19 . 1 1 13 13 TYR CB C 13 39.864 39.864 40.382 -0.518 25541
4416 1 19 . 1 1 13 13 TYR H H 13 8.274 8.274 7.654 0.620 25541
4417 1 19 . 1 1 14 14 ASP N N 14 120.486 120.486 122.164 -1.678 25541
4418 1 19 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.966 -0.289 25541
4419 1 19 . 1 1 14 14 ASP C C 14 173.276 173.276 176.302 -3.026 25541
4420 1 19 . 1 1 14 14 ASP CA C 14 52.719 52.719 54.056 -1.337 25541
4421 1 19 . 1 1 14 14 ASP CB C 14 40.205 40.205 40.871 -0.666 25541
4422 1 19 . 1 1 14 14 ASP H H 14 8.603 8.603 8.741 -0.138 25541
4423 1 19 . 1 1 15 15 LEU N N 15 126.405 126.405 127.450 -1.045 25541
4424 1 19 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.077 -1.312 25541
4425 1 19 . 1 1 15 15 LEU C C 15 175.592 175.592 177.261 -1.669 25541
4426 1 19 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.269 -1.014 25541
4427 1 19 . 1 1 15 15 LEU CB C 15 39.967 39.967 41.458 -1.490 25541
4428 1 19 . 1 1 15 15 LEU H H 15 8.901 8.901 8.610 0.291 25541
4429 1 19 . 1 1 16 16 SER N N 16 116.540 116.540 116.182 0.358 25541
4430 1 19 . 1 1 16 16 SER HA H 16 4.100 4.100 4.231 -0.131 25541
4431 1 19 . 1 1 16 16 SER C C 16 173.247 173.247 174.798 -1.551 25541
4432 1 19 . 1 1 16 16 SER CA C 16 61.720 61.720 60.724 0.996 25541
4433 1 19 . 1 1 16 16 SER CB C 16 62.797 62.797 63.385 -0.588 25541
4434 1 19 . 1 1 16 16 SER H H 16 8.112 8.112 8.160 -0.048 25541
4435 1 19 . 1 1 17 17 LYS N N 17 118.008 118.008 121.011 -3.003 25541
4436 1 19 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.576 -0.075 25541
4437 1 19 . 1 1 17 17 LYS C C 17 175.079 175.079 175.178 -0.099 25541
4438 1 19 . 1 1 17 17 LYS CA C 17 55.267 55.267 56.094 -0.827 25541
4439 1 19 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.437 -2.460 25541
4440 1 19 . 1 1 17 17 LYS H H 17 8.521 8.521 8.202 0.319 25541
4441 1 19 . 1 1 18 18 TRP N N 18 122.041 122.041 122.522 -0.481 25541
4442 1 19 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.721 -0.143 25541
4443 1 19 . 1 1 18 18 TRP C C 18 174.862 174.862 174.821 0.041 25541
4444 1 19 . 1 1 18 18 TRP CA C 18 58.371 58.371 56.935 1.435 25541
4445 1 19 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.013 -3.469 25541
4446 1 19 . 1 1 18 18 TRP H H 18 7.853 7.853 8.466 -0.613 25541
4447 1 19 . 1 1 19 19 LYS N N 19 123.185 123.185 120.479 2.706 25541
4448 1 19 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.675 -0.140 25541
4449 1 19 . 1 1 19 19 LYS C C 19 175.094 175.094 177.279 -2.185 25541
4450 1 19 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.381 1.046 25541
4451 1 19 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.920 -0.800 25541
4452 1 19 . 1 1 19 19 LYS H H 19 9.544 9.544 8.400 1.144 25541
4453 1 19 . 1 1 20 20 TYR N N 20 124.291 124.291 126.562 -2.271 25541
4454 1 19 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.005 0.020 25541
4455 1 19 . 1 1 20 20 TYR C C 20 174.531 174.531 177.231 -2.700 25541
4456 1 19 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.585 0.564 25541
4457 1 19 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.490 -0.337 25541
4458 1 19 . 1 1 20 20 TYR H H 20 9.266 9.266 9.177 0.089 25541
4459 1 19 . 1 1 21 21 ALA N N 21 117.781 117.781 121.261 -3.480 25541
4460 1 19 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.215 -0.342 25541
4461 1 19 . 1 1 21 21 ALA C C 21 176.314 176.314 179.425 -3.111 25541
4462 1 19 . 1 1 21 21 ALA CA C 21 55.335 55.335 54.876 0.459 25541
4463 1 19 . 1 1 21 21 ALA CB C 21 18.703 18.703 18.011 0.692 25541
4464 1 19 . 1 1 21 21 ALA H H 21 8.986 8.986 8.589 0.397 25541
4465 1 19 . 1 1 22 22 GLU N N 22 115.218 115.218 119.242 -4.024 25541
4466 1 19 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.157 -0.038 25541
4467 1 19 . 1 1 22 22 GLU C C 22 177.380 177.380 179.456 -2.076 25541
4468 1 19 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.415 -0.936 25541
4469 1 19 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.252 0.618 25541
4470 1 19 . 1 1 22 22 GLU H H 22 6.854 6.854 8.483 -1.629 25541
4471 1 19 . 1 1 23 23 LEU N N 23 122.132 122.132 119.634 2.498 25541
4472 1 19 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.060 0.096 25541
4473 1 19 . 1 1 23 23 LEU C C 23 174.830 174.830 179.705 -4.875 25541
4474 1 19 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.428 0.094 25541
4475 1 19 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.669 1.450 25541
4476 1 19 . 1 1 23 23 LEU H H 23 7.909 7.909 8.995 -1.086 25541
4477 1 19 . 1 1 24 24 ARG N N 24 118.051 118.051 118.993 -0.942 25541
4478 1 19 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.957 -0.320 25541
4479 1 19 . 1 1 24 24 ARG C C 24 175.240 175.240 178.375 -3.135 25541
4480 1 19 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.784 0.192 25541
4481 1 19 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.726 0.136 25541
4482 1 19 . 1 1 24 24 ARG H H 24 8.250 8.250 7.651 0.599 25541
4483 1 19 . 1 1 25 25 ASP N N 25 118.179 118.179 119.353 -1.174 25541
4484 1 19 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.472 -0.087 25541
4485 1 19 . 1 1 25 25 ASP C C 25 176.554 176.554 178.375 -1.821 25541
4486 1 19 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.215 0.141 25541
4487 1 19 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.378 -0.336 25541
4488 1 19 . 1 1 25 25 ASP H H 25 8.507 8.507 8.674 -0.167 25541
4489 1 19 . 1 1 26 26 THR N N 26 118.299 118.299 116.155 2.144 25541
4490 1 19 . 1 1 26 26 THR HA H 26 3.891 3.891 4.061 -0.170 25541
4491 1 19 . 1 1 26 26 THR C C 26 173.365 173.365 176.398 -3.033 25541
4492 1 19 . 1 1 26 26 THR CA C 26 67.787 67.787 66.390 1.397 25541
4493 1 19 . 1 1 26 26 THR CB C 26 68.120 68.120 68.999 -0.879 25541
4494 1 19 . 1 1 26 26 THR H H 26 7.918 7.918 8.378 -0.460 25541
4495 1 19 . 1 1 27 27 ILE N N 27 122.576 122.576 119.168 3.408 25541
4496 1 19 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.817 -0.192 25541
4497 1 19 . 1 1 27 27 ILE C C 27 174.485 174.485 176.310 -1.825 25541
4498 1 19 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.305 0.406 25541
4499 1 19 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.657 -0.130 25541
4500 1 19 . 1 1 27 27 ILE H H 27 8.159 8.159 7.403 0.756 25541
4501 1 19 . 1 1 28 28 ASN N N 28 115.118 115.118 116.234 -1.116 25541
4502 1 19 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.721 -0.106 25541
4503 1 19 . 1 1 28 28 ASN C C 28 173.902 173.902 175.012 -1.110 25541
4504 1 19 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.791 0.669 25541
4505 1 19 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.184 0.046 25541
4506 1 19 . 1 1 28 28 ASN H H 28 7.713 7.713 7.830 -0.117 25541
4507 1 19 . 1 1 29 29 THR N N 29 107.730 107.730 108.261 -0.531 25541
4508 1 19 . 1 1 29 29 THR HA H 29 4.600 4.600 4.411 0.189 25541
4509 1 19 . 1 1 29 29 THR C C 29 172.290 172.290 174.976 -2.686 25541
4510 1 19 . 1 1 29 29 THR CA C 29 62.595 62.595 62.262 0.333 25541
4511 1 19 . 1 1 29 29 THR CB C 29 72.291 72.291 70.043 2.248 25541
4512 1 19 . 1 1 29 29 THR H H 29 7.587 7.587 7.528 0.059 25541
4513 1 19 . 1 1 30 30 SER N N 30 117.784 117.784 118.675 -0.891 25541
4514 1 19 . 1 1 30 30 SER HA H 30 4.296 4.296 4.609 -0.313 25541
4515 1 19 . 1 1 30 30 SER C C 30 172.473 172.473 173.346 -0.873 25541
4516 1 19 . 1 1 30 30 SER CA C 30 59.618 59.618 58.646 0.972 25541
4517 1 19 . 1 1 30 30 SER CB C 30 64.402 64.402 64.220 0.182 25541
4518 1 19 . 1 1 30 30 SER H H 30 8.698 8.698 8.437 0.261 25541
4519 1 19 . 1 1 31 31 CYS N N 31 121.196 121.196 119.593 1.603 25541
4520 1 19 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.703 0.084 25541
4521 1 19 . 1 1 31 31 CYS C C 31 170.861 170.861 172.453 -1.592 25541
4522 1 19 . 1 1 31 31 CYS CA C 31 57.372 57.372 59.357 -1.985 25541
4523 1 19 . 1 1 31 31 CYS CB C 31 28.364 28.364 28.630 -0.266 25541
4524 1 19 . 1 1 31 31 CYS H H 31 8.713 8.713 8.379 0.334 25541
4525 1 19 . 1 1 32 32 ASP N N 32 124.610 124.610 126.127 -1.517 25541
4526 1 19 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.768 -0.155 25541
4527 1 19 . 1 1 32 32 ASP C C 32 172.541 172.541 175.616 -3.075 25541
4528 1 19 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.113 -0.928 25541
4529 1 19 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.061 -1.924 25541
4530 1 19 . 1 1 32 32 ASP H H 32 8.542 8.542 8.195 0.347 25541
4531 1 19 . 1 1 33 33 ILE N N 33 125.134 125.134 121.515 3.619 25541
4532 1 19 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.022 -0.336 25541
4533 1 19 . 1 1 33 33 ILE C C 33 175.743 175.743 176.291 -0.548 25541
4534 1 19 . 1 1 33 33 ILE CA C 33 64.710 64.710 62.876 1.834 25541
4535 1 19 . 1 1 33 33 ILE CB C 33 37.815 37.815 38.088 -0.273 25541
4536 1 19 . 1 1 33 33 ILE H H 33 8.459 8.459 8.614 -0.155 25541
4537 1 19 . 1 1 34 34 GLU N N 34 121.097 121.097 119.833 1.264 25541
4538 1 19 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.206 -0.075 25541
4539 1 19 . 1 1 34 34 GLU C C 34 176.406 176.406 178.187 -1.781 25541
4540 1 19 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.584 0.749 25541
4541 1 19 . 1 1 34 34 GLU CB C 34 29.675 29.675 29.970 -0.295 25541
4542 1 19 . 1 1 34 34 GLU H H 34 8.177 8.177 8.028 0.149 25541
4543 1 19 . 1 1 35 35 LEU N N 35 124.890 124.890 121.318 3.572 25541
4544 1 19 . 1 1 35 35 LEU HA H 35 3.611 3.611 4.030 -0.419 25541
4545 1 19 . 1 1 35 35 LEU C C 35 176.399 176.399 178.927 -2.528 25541
4546 1 19 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.853 -0.785 25541
4547 1 19 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.703 -0.793 25541
4548 1 19 . 1 1 35 35 LEU H H 35 7.831 7.831 8.188 -0.357 25541
4549 1 19 . 1 1 36 36 LEU N N 36 120.493 120.493 118.739 1.754 25541
4550 1 19 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.768 -0.109 25541
4551 1 19 . 1 1 36 36 LEU C C 36 176.280 176.280 178.959 -2.679 25541
4552 1 19 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.147 0.468 25541
4553 1 19 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.991 1.478 25541
4554 1 19 . 1 1 36 36 LEU H H 36 8.843 8.843 7.525 1.318 25541
4555 1 19 . 1 1 37 37 ALA N N 37 119.956 119.956 120.278 -0.322 25541
4556 1 19 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.892 0.105 25541
4557 1 19 . 1 1 37 37 ALA C C 37 177.606 177.606 179.361 -1.755 25541
4558 1 19 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.682 0.487 25541
4559 1 19 . 1 1 37 37 ALA CB C 37 17.620 17.620 18.003 -0.383 25541
4560 1 19 . 1 1 37 37 ALA H H 37 7.610 7.610 8.387 -0.777 25541
4561 1 19 . 1 1 38 38 ALA N N 38 121.594 121.594 121.958 -0.364 25541
4562 1 19 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.431 -0.328 25541
4563 1 19 . 1 1 38 38 ALA C C 38 178.452 178.452 178.962 -0.510 25541
4564 1 19 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.368 0.487 25541
4565 1 19 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.477 -0.417 25541
4566 1 19 . 1 1 38 38 ALA H H 38 7.665 7.665 8.135 -0.470 25541
4567 1 19 . 1 1 39 39 CYS N N 39 119.263 119.263 117.819 1.444 25541
4568 1 19 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.808 -0.077 25541
4569 1 19 . 1 1 39 39 CYS C C 39 173.860 173.860 176.931 -3.071 25541
4570 1 19 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.837 0.986 25541
4571 1 19 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.630 -0.405 25541
4572 1 19 . 1 1 39 39 CYS H H 39 8.766 8.766 8.673 0.093 25541
4573 1 19 . 1 1 40 40 ARG N N 40 119.658 119.658 119.230 0.428 25541
4574 1 19 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.819 0.079 25541
4575 1 19 . 1 1 40 40 ARG C C 40 176.108 176.108 178.615 -2.507 25541
4576 1 19 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.750 0.732 25541
4577 1 19 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.886 -0.022 25541
4578 1 19 . 1 1 40 40 ARG H H 40 8.327 8.327 8.514 -0.187 25541
4579 1 19 . 1 1 41 41 GLU N N 41 119.358 119.358 118.843 0.515 25541
4580 1 19 . 1 1 41 41 GLU HA H 41 4.099 4.099 4.086 0.013 25541
4581 1 19 . 1 1 41 41 GLU C C 41 171.786 171.786 178.829 -7.043 25541
4582 1 19 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.891 -0.678 25541
4583 1 19 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.615 -0.338 25541
4584 1 19 . 1 1 41 41 GLU H H 41 7.929 7.929 7.851 0.078 25541
4585 1 19 . 1 1 42 42 GLU N N 42 121.281 121.281 119.080 2.201 25541
4586 1 19 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.143 0.080 25541
4587 1 19 . 1 1 42 42 GLU C C 42 173.408 173.408 178.663 -5.255 25541
4588 1 19 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.455 -0.136 25541
4589 1 19 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.044 -0.829 25541
4590 1 19 . 1 1 42 42 GLU H H 42 7.945 7.945 7.638 0.307 25541
4591 1 19 . 1 1 43 43 PHE N N 43 119.271 119.271 121.423 -2.152 25541
4592 1 19 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.013 0.064 25541
4593 1 19 . 1 1 43 43 PHE C C 43 175.299 175.299 177.242 -1.943 25541
4594 1 19 . 1 1 43 43 PHE CA C 43 61.549 61.549 61.734 -0.185 25541
4595 1 19 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.167 -0.033 25541
4596 1 19 . 1 1 43 43 PHE H H 43 8.624 8.624 8.297 0.327 25541
4597 1 19 . 1 1 44 44 HIS N N 44 116.374 116.374 117.358 -0.984 25541
4598 1 19 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.454 -0.188 25541
4599 1 19 . 1 1 44 44 HIS C C 44 174.771 174.771 178.098 -3.327 25541
4600 1 19 . 1 1 44 44 HIS CA C 44 59.343 59.343 60.689 -1.346 25541
4601 1 19 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.630 -0.142 25541
4602 1 19 . 1 1 44 44 HIS H H 44 7.976 7.976 8.193 -0.217 25541
4603 1 19 . 1 1 45 45 ARG N N 45 120.170 120.170 117.726 2.444 25541
4604 1 19 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.160 -0.214 25541
4605 1 19 . 1 1 45 45 ARG C C 45 176.310 176.310 177.631 -1.321 25541
4606 1 19 . 1 1 45 45 ARG CA C 45 59.206 59.206 58.693 0.513 25541
4607 1 19 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.780 0.608 25541
4608 1 19 . 1 1 45 45 ARG H H 45 8.166 8.166 7.628 0.538 25541
4609 1 19 . 1 1 46 46 ARG N N 46 116.229 116.229 118.296 -2.067 25541
4610 1 19 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.118 -0.053 25541
4611 1 19 . 1 1 46 46 ARG C C 46 176.046 176.046 178.650 -2.604 25541
4612 1 19 . 1 1 46 46 ARG CA C 46 57.691 57.691 58.384 -0.693 25541
4613 1 19 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.754 0.494 25541
4614 1 19 . 1 1 46 46 ARG H H 46 7.764 7.764 7.549 0.215 25541
4615 1 19 . 1 1 47 47 LEU N N 47 119.010 119.010 120.548 -1.538 25541
4616 1 19 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.105 0.030 25541
4617 1 19 . 1 1 47 47 LEU CA C 47 55.957 55.957 57.919 -1.962 25541
4618 1 19 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.472 0.552 25541
4619 1 19 . 1 1 47 47 LEU H H 47 7.557 7.557 7.713 -0.156 25541
4620 1 19 . 1 1 48 48 LYS N N 48 119.277 119.277 117.134 2.143 25541
4621 1 19 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.099 -0.024 25541
4622 1 19 . 1 1 48 48 LYS C C 48 176.354 176.354 177.799 -1.445 25541
4623 1 19 . 1 1 48 48 LYS CA C 48 56.655 56.655 57.747 -1.092 25541
4624 1 19 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.642 -0.232 25541
4625 1 19 . 1 1 48 48 LYS H H 48 7.662 7.662 7.429 0.233 25541
4626 1 19 . 1 1 49 49 VAL N N 49 119.095 119.095 120.314 -1.219 25541
4627 1 19 . 1 1 49 49 VAL HA H 49 3.972 3.972 4.049 -0.077 25541
4628 1 19 . 1 1 49 49 VAL C C 49 174.195 174.195 176.603 -2.408 25541
4629 1 19 . 1 1 49 49 VAL CA C 49 62.214 62.214 62.435 -0.222 25541
4630 1 19 . 1 1 49 49 VAL CB C 49 32.747 32.747 32.574 0.173 25541
4631 1 19 . 1 1 49 49 VAL H H 49 7.688 7.688 8.040 -0.352 25541
4632 1 19 . 1 1 50 50 TYR N N 50 123.606 123.606 121.378 2.228 25541
4633 1 19 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.309 0.173 25541
4634 1 19 . 1 1 50 50 TYR CA C 50 57.855 57.855 57.814 0.041 25541
4635 1 19 . 1 1 50 50 TYR CB C 50 38.721 38.721 35.737 2.984 25541
4636 1 19 . 1 1 50 50 TYR H H 50 8.164 8.164 8.611 -0.447 25541
4637 1 20 . 1 1 10 10 THR N N 10 114.351 114.351 116.032 -1.681 25541
4638 1 20 . 1 1 10 10 THR HA H 10 4.241 4.241 4.374 -0.133 25541
4639 1 20 . 1 1 10 10 THR C C 10 171.741 171.741 172.430 -0.689 25541
4640 1 20 . 1 1 10 10 THR CA C 10 62.002 62.002 62.637 -0.635 25541
4641 1 20 . 1 1 10 10 THR CB C 10 69.796 69.796 69.920 -0.124 25541
4642 1 20 . 1 1 10 10 THR H H 10 8.114 8.114 7.823 0.291 25541
4643 1 20 . 1 1 11 11 LYS N N 11 124.677 124.677 125.388 -0.711 25541
4644 1 20 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.462 -0.298 25541
4645 1 20 . 1 1 11 11 LYS C C 11 172.964 172.964 175.011 -2.047 25541
4646 1 20 . 1 1 11 11 LYS CA C 11 56.122 56.122 55.707 0.415 25541
4647 1 20 . 1 1 11 11 LYS CB C 11 32.819 32.819 33.911 -1.093 25541
4648 1 20 . 1 1 11 11 LYS H H 11 8.436 8.436 8.468 -0.032 25541
4649 1 20 . 1 1 12 12 LYS N N 12 123.337 123.337 122.882 0.455 25541
4650 1 20 . 1 1 12 12 LYS HA H 12 4.093 4.093 3.966 0.127 25541
4651 1 20 . 1 1 12 12 LYS C C 12 173.147 173.147 174.439 -1.292 25541
4652 1 20 . 1 1 12 12 LYS CA C 12 56.327 56.327 55.093 1.234 25541
4653 1 20 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.841 0.382 25541
4654 1 20 . 1 1 12 12 LYS H H 12 8.239 8.239 8.128 0.111 25541
4655 1 20 . 1 1 13 13 TYR N N 13 119.233 119.233 118.047 1.186 25541
4656 1 20 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.706 -0.305 25541
4657 1 20 . 1 1 13 13 TYR C C 13 172.016 172.016 174.246 -2.230 25541
4658 1 20 . 1 1 13 13 TYR CA C 13 57.325 57.325 55.979 1.346 25541
4659 1 20 . 1 1 13 13 TYR CB C 13 39.864 39.864 41.093 -1.229 25541
4660 1 20 . 1 1 13 13 TYR H H 13 8.274 8.274 7.665 0.609 25541
4661 1 20 . 1 1 14 14 ASP N N 14 120.486 120.486 121.721 -1.235 25541
4662 1 20 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.854 -0.177 25541
4663 1 20 . 1 1 14 14 ASP C C 14 173.276 173.276 176.140 -2.864 25541
4664 1 20 . 1 1 14 14 ASP CA C 14 52.719 52.719 53.703 -0.984 25541
4665 1 20 . 1 1 14 14 ASP CB C 14 40.205 40.205 40.343 -0.137 25541
4666 1 20 . 1 1 14 14 ASP H H 14 8.603 8.603 8.724 -0.121 25541
4667 1 20 . 1 1 15 15 LEU N N 15 126.405 126.405 125.170 1.235 25541
4668 1 20 . 1 1 15 15 LEU HA H 15 3.765 3.765 4.967 -1.202 25541
4669 1 20 . 1 1 15 15 LEU C C 15 175.592 175.592 177.413 -1.821 25541
4670 1 20 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.200 -0.945 25541
4671 1 20 . 1 1 15 15 LEU CB C 15 39.967 39.967 41.338 -1.371 25541
4672 1 20 . 1 1 15 15 LEU H H 15 8.901 8.901 8.519 0.382 25541
4673 1 20 . 1 1 16 16 SER N N 16 116.540 116.540 117.655 -1.115 25541
4674 1 20 . 1 1 16 16 SER HA H 16 4.100 4.100 4.284 -0.184 25541
4675 1 20 . 1 1 16 16 SER C C 16 173.247 173.247 174.257 -1.010 25541
4676 1 20 . 1 1 16 16 SER CA C 16 61.720 61.720 60.425 1.295 25541
4677 1 20 . 1 1 16 16 SER CB C 16 62.797 62.797 63.334 -0.537 25541
4678 1 20 . 1 1 16 16 SER H H 16 8.112 8.112 8.157 -0.045 25541
4679 1 20 . 1 1 17 17 LYS N N 17 118.008 118.008 117.962 0.046 25541
4680 1 20 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.569 -0.068 25541
4681 1 20 . 1 1 17 17 LYS C C 17 175.079 175.079 175.230 -0.151 25541
4682 1 20 . 1 1 17 17 LYS CA C 17 55.267 55.267 56.188 -0.921 25541
4683 1 20 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.252 -2.275 25541
4684 1 20 . 1 1 17 17 LYS H H 17 8.521 8.521 7.911 0.610 25541
4685 1 20 . 1 1 18 18 TRP N N 18 122.041 122.041 122.626 -0.585 25541
4686 1 20 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.854 -0.276 25541
4687 1 20 . 1 1 18 18 TRP C C 18 174.862 174.862 175.346 -0.484 25541
4688 1 20 . 1 1 18 18 TRP CA C 18 58.371 58.371 56.993 1.378 25541
4689 1 20 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.605 -4.061 25541
4690 1 20 . 1 1 18 18 TRP H H 18 7.853 7.853 8.462 -0.609 25541
4691 1 20 . 1 1 19 19 LYS N N 19 123.185 123.185 121.557 1.628 25541
4692 1 20 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.662 -0.127 25541
4693 1 20 . 1 1 19 19 LYS C C 19 175.094 175.094 177.143 -2.049 25541
4694 1 20 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.969 0.458 25541
4695 1 20 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.663 -0.543 25541
4696 1 20 . 1 1 19 19 LYS H H 19 9.544 9.544 8.465 1.079 25541
4697 1 20 . 1 1 20 20 TYR N N 20 124.291 124.291 125.291 -1.000 25541
4698 1 20 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.050 -0.025 25541
4699 1 20 . 1 1 20 20 TYR C C 20 174.531 174.531 177.088 -2.557 25541
4700 1 20 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.349 0.800 25541
4701 1 20 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.421 -0.268 25541
4702 1 20 . 1 1 20 20 TYR H H 20 9.266 9.266 9.182 0.084 25541
4703 1 20 . 1 1 21 21 ALA N N 21 117.781 117.781 121.591 -3.810 25541
4704 1 20 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.249 -0.376 25541
4705 1 20 . 1 1 21 21 ALA C C 21 176.314 176.314 179.502 -3.188 25541
4706 1 20 . 1 1 21 21 ALA CA C 21 55.335 55.335 54.982 0.353 25541
4707 1 20 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.867 0.836 25541
4708 1 20 . 1 1 21 21 ALA H H 21 8.986 8.986 8.501 0.485 25541
4709 1 20 . 1 1 22 22 GLU N N 22 115.218 115.218 119.315 -4.097 25541
4710 1 20 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.110 0.009 25541
4711 1 20 . 1 1 22 22 GLU C C 22 177.380 177.380 179.493 -2.113 25541
4712 1 20 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.644 -1.165 25541
4713 1 20 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.306 0.564 25541
4714 1 20 . 1 1 22 22 GLU H H 22 6.854 6.854 8.586 -1.732 25541
4715 1 20 . 1 1 23 23 LEU N N 23 122.132 122.132 119.993 2.139 25541
4716 1 20 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.092 0.064 25541
4717 1 20 . 1 1 23 23 LEU C C 23 174.830 174.830 179.354 -4.524 25541
4718 1 20 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.464 0.058 25541
4719 1 20 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.735 1.384 25541
4720 1 20 . 1 1 23 23 LEU H H 23 7.909 7.909 8.803 -0.894 25541
4721 1 20 . 1 1 24 24 ARG N N 24 118.051 118.051 118.323 -0.272 25541
4722 1 20 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.937 -0.300 25541
4723 1 20 . 1 1 24 24 ARG C C 24 175.240 175.240 178.395 -3.155 25541
4724 1 20 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.698 0.278 25541
4725 1 20 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.703 0.159 25541
4726 1 20 . 1 1 24 24 ARG H H 24 8.250 8.250 7.538 0.712 25541
4727 1 20 . 1 1 25 25 ASP N N 25 118.179 118.179 118.718 -0.539 25541
4728 1 20 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.531 -0.146 25541
4729 1 20 . 1 1 25 25 ASP C C 25 176.554 176.554 178.020 -1.466 25541
4730 1 20 . 1 1 25 25 ASP CA C 25 57.356 57.356 56.937 0.419 25541
4731 1 20 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.995 -0.953 25541
4732 1 20 . 1 1 25 25 ASP H H 25 8.507 8.507 8.430 0.077 25541
4733 1 20 . 1 1 26 26 THR N N 26 118.299 118.299 116.637 1.662 25541
4734 1 20 . 1 1 26 26 THR HA H 26 3.891 3.891 3.992 -0.101 25541
4735 1 20 . 1 1 26 26 THR C C 26 173.365 173.365 176.418 -3.053 25541
4736 1 20 . 1 1 26 26 THR CA C 26 67.787 67.787 66.407 1.380 25541
4737 1 20 . 1 1 26 26 THR CB C 26 68.120 68.120 69.111 -0.991 25541
4738 1 20 . 1 1 26 26 THR H H 26 7.918 7.918 8.266 -0.348 25541
4739 1 20 . 1 1 27 27 ILE N N 27 122.576 122.576 118.520 4.056 25541
4740 1 20 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.829 -0.204 25541
4741 1 20 . 1 1 27 27 ILE C C 27 174.485 174.485 176.387 -1.902 25541
4742 1 20 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.367 0.344 25541
4743 1 20 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.723 -0.196 25541
4744 1 20 . 1 1 27 27 ILE H H 27 8.159 8.159 7.531 0.628 25541
4745 1 20 . 1 1 28 28 ASN N N 28 115.118 115.118 116.077 -0.959 25541
4746 1 20 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.753 -0.138 25541
4747 1 20 . 1 1 28 28 ASN C C 28 173.902 173.902 174.977 -1.075 25541
4748 1 20 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.722 0.738 25541
4749 1 20 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.381 -0.151 25541
4750 1 20 . 1 1 28 28 ASN H H 28 7.713 7.713 7.702 0.011 25541
4751 1 20 . 1 1 29 29 THR N N 29 107.730 107.730 111.878 -4.148 25541
4752 1 20 . 1 1 29 29 THR HA H 29 4.600 4.600 4.462 0.138 25541
4753 1 20 . 1 1 29 29 THR C C 29 172.290 172.290 174.515 -2.225 25541
4754 1 20 . 1 1 29 29 THR CA C 29 62.595 62.595 62.584 0.011 25541
4755 1 20 . 1 1 29 29 THR CB C 29 72.291 72.291 70.055 2.236 25541
4756 1 20 . 1 1 29 29 THR H H 29 7.587 7.587 7.648 -0.061 25541
4757 1 20 . 1 1 30 30 SER N N 30 117.784 117.784 118.454 -0.670 25541
4758 1 20 . 1 1 30 30 SER HA H 30 4.296 4.296 4.647 -0.351 25541
4759 1 20 . 1 1 30 30 SER C C 30 172.473 172.473 173.620 -1.147 25541
4760 1 20 . 1 1 30 30 SER CA C 30 59.618 59.618 58.333 1.285 25541
4761 1 20 . 1 1 30 30 SER CB C 30 64.402 64.402 64.484 -0.082 25541
4762 1 20 . 1 1 30 30 SER H H 30 8.698 8.698 8.582 0.116 25541
4763 1 20 . 1 1 31 31 CYS N N 31 121.196 121.196 118.121 3.075 25541
4764 1 20 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.802 -0.015 25541
4765 1 20 . 1 1 31 31 CYS C C 31 170.861 170.861 172.416 -1.555 25541
4766 1 20 . 1 1 31 31 CYS CA C 31 57.372 57.372 58.790 -1.418 25541
4767 1 20 . 1 1 31 31 CYS CB C 31 28.364 28.364 29.921 -1.556 25541
4768 1 20 . 1 1 31 31 CYS H H 31 8.713 8.713 8.255 0.458 25541
4769 1 20 . 1 1 32 32 ASP N N 32 124.610 124.610 123.586 1.024 25541
4770 1 20 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.759 -0.146 25541
4771 1 20 . 1 1 32 32 ASP C C 32 172.541 172.541 175.523 -2.982 25541
4772 1 20 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.108 -0.923 25541
4773 1 20 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.362 -2.225 25541
4774 1 20 . 1 1 32 32 ASP H H 32 8.542 8.542 8.202 0.340 25541
4775 1 20 . 1 1 33 33 ILE N N 33 125.134 125.134 121.936 3.198 25541
4776 1 20 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.042 -0.356 25541
4777 1 20 . 1 1 33 33 ILE C C 33 175.743 175.743 175.955 -0.212 25541
4778 1 20 . 1 1 33 33 ILE CA C 33 64.710 64.710 62.801 1.909 25541
4779 1 20 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.953 -0.138 25541
4780 1 20 . 1 1 33 33 ILE H H 33 8.459 8.459 8.567 -0.108 25541
4781 1 20 . 1 1 34 34 GLU N N 34 121.097 121.097 119.974 1.123 25541
4782 1 20 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.326 -0.195 25541
4783 1 20 . 1 1 34 34 GLU C C 34 176.406 176.406 178.179 -1.773 25541
4784 1 20 . 1 1 34 34 GLU CA C 34 59.333 59.333 57.529 1.804 25541
4785 1 20 . 1 1 34 34 GLU CB C 34 29.675 29.675 29.989 -0.314 25541
4786 1 20 . 1 1 34 34 GLU H H 34 8.177 8.177 8.163 0.014 25541
4787 1 20 . 1 1 35 35 LEU N N 35 124.890 124.890 121.226 3.664 25541
4788 1 20 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.966 -0.355 25541
4789 1 20 . 1 1 35 35 LEU C C 35 176.399 176.399 178.966 -2.567 25541
4790 1 20 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.998 -0.930 25541
4791 1 20 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.665 -0.755 25541
4792 1 20 . 1 1 35 35 LEU H H 35 7.831 7.831 7.857 -0.026 25541
4793 1 20 . 1 1 36 36 LEU N N 36 120.493 120.493 118.794 1.699 25541
4794 1 20 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.769 -0.110 25541
4795 1 20 . 1 1 36 36 LEU C C 36 176.280 176.280 178.997 -2.717 25541
4796 1 20 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.145 0.470 25541
4797 1 20 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.985 1.484 25541
4798 1 20 . 1 1 36 36 LEU H H 36 8.843 8.843 7.512 1.331 25541
4799 1 20 . 1 1 37 37 ALA N N 37 119.956 119.956 120.648 -0.692 25541
4800 1 20 . 1 1 37 37 ALA HA H 37 3.997 3.997 4.011 -0.014 25541
4801 1 20 . 1 1 37 37 ALA C C 37 177.606 177.606 179.566 -1.960 25541
4802 1 20 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.787 0.382 25541
4803 1 20 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.881 -0.261 25541
4804 1 20 . 1 1 37 37 ALA H H 37 7.610 7.610 8.235 -0.625 25541
4805 1 20 . 1 1 38 38 ALA N N 38 121.594 121.594 121.732 -0.138 25541
4806 1 20 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.325 -0.222 25541
4807 1 20 . 1 1 38 38 ALA C C 38 178.452 178.452 178.857 -0.405 25541
4808 1 20 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.395 0.459 25541
4809 1 20 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.535 -0.475 25541
4810 1 20 . 1 1 38 38 ALA H H 38 7.665 7.665 8.344 -0.679 25541
4811 1 20 . 1 1 39 39 CYS N N 39 119.263 119.263 117.921 1.342 25541
4812 1 20 . 1 1 39 39 CYS HA H 39 3.731 3.731 4.321 -0.590 25541
4813 1 20 . 1 1 39 39 CYS C C 39 173.860 173.860 177.051 -3.191 25541
4814 1 20 . 1 1 39 39 CYS CA C 39 63.823 63.823 60.954 2.869 25541
4815 1 20 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.550 -0.325 25541
4816 1 20 . 1 1 39 39 CYS H H 39 8.766 8.766 8.709 0.057 25541
4817 1 20 . 1 1 40 40 ARG N N 40 119.658 119.658 119.516 0.142 25541
4818 1 20 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.934 -0.036 25541
4819 1 20 . 1 1 40 40 ARG C C 40 176.108 176.108 178.494 -2.386 25541
4820 1 20 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.877 0.605 25541
4821 1 20 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.984 -0.120 25541
4822 1 20 . 1 1 40 40 ARG H H 40 8.327 8.327 8.522 -0.195 25541
4823 1 20 . 1 1 41 41 GLU N N 41 119.358 119.358 119.325 0.033 25541
4824 1 20 . 1 1 41 41 GLU HA H 41 4.099 4.099 4.019 0.080 25541
4825 1 20 . 1 1 41 41 GLU C C 41 171.786 171.786 178.636 -6.850 25541
4826 1 20 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.782 -0.569 25541
4827 1 20 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.615 -0.338 25541
4828 1 20 . 1 1 41 41 GLU H H 41 7.929 7.929 7.792 0.137 25541
4829 1 20 . 1 1 42 42 GLU N N 42 121.281 121.281 118.707 2.574 25541
4830 1 20 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.086 0.137 25541
4831 1 20 . 1 1 42 42 GLU C C 42 173.408 173.408 178.832 -5.424 25541
4832 1 20 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.408 -0.089 25541
4833 1 20 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.273 -1.058 25541
4834 1 20 . 1 1 42 42 GLU H H 42 7.945 7.945 7.591 0.354 25541
4835 1 20 . 1 1 43 43 PHE N N 43 119.271 119.271 121.532 -2.261 25541
4836 1 20 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.069 0.008 25541
4837 1 20 . 1 1 43 43 PHE C C 43 175.299 175.299 177.107 -1.808 25541
4838 1 20 . 1 1 43 43 PHE CA C 43 61.549 61.549 61.501 0.048 25541
4839 1 20 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.169 -0.035 25541
4840 1 20 . 1 1 43 43 PHE H H 43 8.624 8.624 8.280 0.344 25541
4841 1 20 . 1 1 44 44 HIS N N 44 116.374 116.374 118.327 -1.953 25541
4842 1 20 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.390 -0.124 25541
4843 1 20 . 1 1 44 44 HIS C C 44 174.771 174.771 178.139 -3.368 25541
4844 1 20 . 1 1 44 44 HIS CA C 44 59.343 59.343 59.206 0.137 25541
4845 1 20 . 1 1 44 44 HIS CB C 44 29.488 29.488 30.133 -0.645 25541
4846 1 20 . 1 1 44 44 HIS H H 44 7.976 7.976 7.867 0.109 25541
4847 1 20 . 1 1 45 45 ARG N N 45 120.170 120.170 119.282 0.888 25541
4848 1 20 . 1 1 45 45 ARG HA H 45 3.946 3.946 3.958 -0.012 25541
4849 1 20 . 1 1 45 45 ARG C C 45 176.310 176.310 178.344 -2.034 25541
4850 1 20 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.310 -0.104 25541
4851 1 20 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.758 0.630 25541
4852 1 20 . 1 1 45 45 ARG H H 45 8.166 8.166 7.600 0.566 25541
4853 1 20 . 1 1 46 46 ARG N N 46 116.229 116.229 117.573 -1.344 25541
4854 1 20 . 1 1 46 46 ARG HA H 46 4.065 4.065 3.978 0.087 25541
4855 1 20 . 1 1 46 46 ARG C C 46 176.046 176.046 177.665 -1.619 25541
4856 1 20 . 1 1 46 46 ARG CA C 46 57.691 57.691 58.110 -0.419 25541
4857 1 20 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.414 0.834 25541
4858 1 20 . 1 1 46 46 ARG H H 46 7.764 7.764 7.459 0.305 25541
4859 1 20 . 1 1 47 47 LEU N N 47 119.010 119.010 116.135 2.875 25541
4860 1 20 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.290 -0.155 25541
4861 1 20 . 1 1 47 47 LEU CA C 47 55.957 55.957 56.158 -0.201 25541
4862 1 20 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.724 0.300 25541
4863 1 20 . 1 1 47 47 LEU H H 47 7.557 7.557 7.631 -0.074 25541
4864 1 20 . 1 1 48 48 LYS N N 48 119.277 119.277 119.109 0.168 25541
4865 1 20 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.261 -0.186 25541
4866 1 20 . 1 1 48 48 LYS C C 48 176.354 176.354 177.264 -0.910 25541
4867 1 20 . 1 1 48 48 LYS CA C 48 56.655 56.655 57.005 -0.350 25541
4868 1 20 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.998 -0.588 25541
4869 1 20 . 1 1 48 48 LYS H H 48 7.662 7.662 7.646 0.016 25541
4870 1 20 . 1 1 49 49 VAL N N 49 119.095 119.095 122.282 -3.187 25541
4871 1 20 . 1 1 49 49 VAL HA H 49 3.972 3.972 3.427 0.545 25541
4872 1 20 . 1 1 49 49 VAL C C 49 174.195 174.195 176.662 -2.467 25541
4873 1 20 . 1 1 49 49 VAL CA C 49 62.214 62.214 63.329 -1.115 25541
4874 1 20 . 1 1 49 49 VAL CB C 49 32.747 32.747 31.291 1.456 25541
4875 1 20 . 1 1 49 49 VAL H H 49 7.688 7.688 7.545 0.143 25541
4876 1 20 . 1 1 50 50 TYR N N 50 123.606 123.606 125.092 -1.486 25541
4877 1 20 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.473 0.009 25541
4878 1 20 . 1 1 50 50 TYR CA C 50 57.855 57.855 56.944 0.911 25541
4879 1 20 . 1 1 50 50 TYR CB C 50 38.721 38.721 35.714 3.007 25541
4880 1 20 . 1 1 50 50 TYR H H 50 8.164 8.164 7.726 0.438 25541
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 41 2.015 -0.094 2.038 25541
2 1 1 "Average Difference" HA 41 0.280 0.144 0.243 25541
3 1 1 "Average Difference" C 39 2.588 2.154 1.454 25541
4 1 1 "Average Difference" CA 41 0.991 -0.205 0.982 25541
5 1 1 "Average Difference" CB 41 1.064 0.273 1.041 25541
6 1 1 "Average Difference" HN 41 0.486 -0.097 0.482 25541
7 1 2 "Average Difference" N 41 2.114 -0.425 2.096 25541
8 1 2 "Average Difference" HA 41 0.291 0.127 0.265 25541
9 1 2 "Average Difference" C 39 2.710 2.340 1.385 25541
10 1 2 "Average Difference" CA 41 1.025 -0.179 1.022 25541
11 1 2 "Average Difference" CB 41 1.069 0.126 1.075 25541
12 1 2 "Average Difference" HN 41 0.520 -0.041 0.525 25541
13 1 3 "Average Difference" N 41 1.777 -0.211 1.787 25541
14 1 3 "Average Difference" HA 41 0.287 0.110 0.268 25541
15 1 3 "Average Difference" C 39 2.585 2.151 1.453 25541
16 1 3 "Average Difference" CA 41 0.860 -0.234 0.838 25541
17 1 3 "Average Difference" CB 41 1.070 0.143 1.074 25541
18 1 3 "Average Difference" HN 41 0.536 -0.063 0.539 25541
19 1 4 "Average Difference" N 41 2.120 0.099 2.144 25541
20 1 4 "Average Difference" HA 41 0.268 0.096 0.254 25541
21 1 4 "Average Difference" C 39 2.737 2.387 1.358 25541
22 1 4 "Average Difference" CA 41 0.943 0.004 0.955 25541
23 1 4 "Average Difference" CB 41 1.152 0.084 1.163 25541
24 1 4 "Average Difference" HN 41 0.485 -0.045 0.489 25541
25 1 5 "Average Difference" N 41 2.399 -0.650 2.338 25541
26 1 5 "Average Difference" HA 41 0.287 0.109 0.268 25541
27 1 5 "Average Difference" C 39 2.666 2.295 1.376 25541
28 1 5 "Average Difference" CA 41 0.900 -0.107 0.905 25541
29 1 5 "Average Difference" CB 41 1.190 0.190 1.189 25541
30 1 5 "Average Difference" HN 41 0.553 -0.118 0.547 25541
31 1 6 "Average Difference" N 41 2.116 -0.555 2.068 25541
32 1 6 "Average Difference" HA 41 0.309 0.144 0.276 25541
33 1 6 "Average Difference" C 39 2.648 2.133 1.590 25541
34 1 6 "Average Difference" CA 41 0.860 -0.147 0.858 25541
35 1 6 "Average Difference" CB 41 1.140 0.334 1.104 25541
36 1 6 "Average Difference" HN 41 0.525 -0.015 0.531 25541
37 1 7 "Average Difference" N 41 1.850 -0.400 1.829 25541
38 1 7 "Average Difference" HA 41 0.271 0.127 0.242 25541
39 1 7 "Average Difference" C 39 2.620 2.218 1.413 25541
40 1 7 "Average Difference" CA 41 1.057 -0.277 1.033 25541
41 1 7 "Average Difference" CB 41 1.062 0.234 1.049 25541
42 1 7 "Average Difference" HN 41 0.543 -0.093 0.541 25541
43 1 8 "Average Difference" N 41 1.946 -0.176 1.962 25541
44 1 8 "Average Difference" HA 41 0.292 0.115 0.272 25541
45 1 8 "Average Difference" C 39 2.654 2.288 1.363 25541
46 1 8 "Average Difference" CA 41 1.108 -0.202 1.103 25541
47 1 8 "Average Difference" CB 41 1.122 0.117 1.129 25541
48 1 8 "Average Difference" HN 41 0.504 -0.057 0.507 25541
49 1 9 "Average Difference" N 41 2.041 -0.540 1.992 25541
50 1 9 "Average Difference" HA 41 0.277 0.118 0.254 25541
51 1 9 "Average Difference" C 39 2.613 2.277 1.299 25541
52 1 9 "Average Difference" CA 41 0.975 -0.074 0.984 25541
53 1 9 "Average Difference" CB 41 1.184 0.257 1.170 25541
54 1 9 "Average Difference" HN 41 0.524 -0.043 0.529 25541
55 1 10 "Average Difference" N 41 2.124 -0.480 2.094 25541
56 1 10 "Average Difference" HA 41 0.275 0.115 0.253 25541
57 1 10 "Average Difference" C 39 2.650 2.210 1.482 25541
58 1 10 "Average Difference" CA 41 0.980 -0.184 0.975 25541
59 1 10 "Average Difference" CB 41 1.082 0.227 1.071 25541
60 1 10 "Average Difference" HN 41 0.485 -0.074 0.485 25541
61 1 11 "Average Difference" N 41 2.130 -0.261 2.140 25541
62 1 11 "Average Difference" HA 41 0.289 0.105 0.272 25541
63 1 11 "Average Difference" C 39 2.615 2.233 1.378 25541
64 1 11 "Average Difference" CA 41 0.924 -0.162 0.921 25541
65 1 11 "Average Difference" CB 41 1.151 0.129 1.158 25541
66 1 11 "Average Difference" HN 41 0.514 -0.086 0.513 25541
67 1 12 "Average Difference" N 41 2.750 -0.622 2.713 25541
68 1 12 "Average Difference" HA 41 0.271 0.111 0.250 25541
69 1 12 "Average Difference" C 39 2.601 2.218 1.377 25541
70 1 12 "Average Difference" CA 41 1.047 -0.110 1.054 25541
71 1 12 "Average Difference" CB 41 1.233 0.200 1.231 25541
72 1 12 "Average Difference" HN 41 0.565 -0.056 0.569 25541
73 1 13 "Average Difference" N 41 1.906 -0.478 1.868 25541
74 1 13 "Average Difference" HA 41 0.258 0.118 0.233 25541
75 1 13 "Average Difference" C 39 2.643 2.244 1.415 25541
76 1 13 "Average Difference" CA 41 0.843 -0.105 0.846 25541
77 1 13 "Average Difference" CB 41 1.138 0.256 1.123 25541
78 1 13 "Average Difference" HN 41 0.475 -0.034 0.480 25541
79 1 14 "Average Difference" N 41 1.982 -0.069 2.005 25541
80 1 14 "Average Difference" HA 41 0.279 0.153 0.237 25541
81 1 14 "Average Difference" C 39 2.597 2.186 1.421 25541
82 1 14 "Average Difference" CA 41 0.895 -0.055 0.905 25541
83 1 14 "Average Difference" CB 41 1.100 0.282 1.076 25541
84 1 14 "Average Difference" HN 41 0.522 -0.034 0.527 25541
85 1 15 "Average Difference" N 41 1.852 -0.323 1.847 25541
86 1 15 "Average Difference" HA 41 0.275 0.099 0.260 25541
87 1 15 "Average Difference" C 39 2.636 2.221 1.439 25541
88 1 15 "Average Difference" CA 41 0.925 -0.291 0.889 25541
89 1 15 "Average Difference" CB 41 1.031 0.208 1.023 25541
90 1 15 "Average Difference" HN 41 0.478 -0.092 0.475 25541
91 1 16 "Average Difference" N 41 1.856 -0.142 1.874 25541
92 1 16 "Average Difference" HA 41 0.265 0.129 0.234 25541
93 1 16 "Average Difference" C 39 2.618 2.179 1.470 25541
94 1 16 "Average Difference" CA 41 0.867 -0.198 0.855 25541
95 1 16 "Average Difference" CB 41 1.120 0.228 1.110 25541
96 1 16 "Average Difference" HN 41 0.464 -0.055 0.467 25541
97 1 17 "Average Difference" N 41 1.900 -0.108 1.921 25541
98 1 17 "Average Difference" HA 41 0.297 0.095 0.285 25541
99 1 17 "Average Difference" C 39 2.621 2.224 1.404 25541
100 1 17 "Average Difference" CA 41 0.936 0.015 0.947 25541
101 1 17 "Average Difference" CB 41 1.125 0.155 1.128 25541
102 1 17 "Average Difference" HN 41 0.527 -0.075 0.528 25541
103 1 18 "Average Difference" N 41 1.885 0.026 1.908 25541
104 1 18 "Average Difference" HA 41 0.255 0.111 0.232 25541
105 1 18 "Average Difference" C 39 2.555 2.149 1.399 25541
106 1 18 "Average Difference" CA 41 0.797 -0.172 0.788 25541
107 1 18 "Average Difference" CB 41 0.993 0.245 0.975 25541
108 1 18 "Average Difference" HN 41 0.512 -0.056 0.515 25541
109 1 19 "Average Difference" N 41 1.962 -0.079 1.985 25541
110 1 19 "Average Difference" HA 41 0.280 0.140 0.245 25541
111 1 19 "Average Difference" C 39 2.653 2.294 1.350 25541
112 1 19 "Average Difference" CA 41 0.927 -0.068 0.936 25541
113 1 19 "Average Difference" CB 41 1.097 0.152 1.100 25541
114 1 19 "Average Difference" HN 41 0.531 -0.029 0.537 25541
115 1 20 "Average Difference" N 41 2.016 -0.057 2.041 25541
116 1 20 "Average Difference" HA 41 0.289 0.140 0.256 25541
117 1 20 "Average Difference" C 39 2.559 2.186 1.347 25541
118 1 20 "Average Difference" CA 41 0.983 -0.259 0.960 25541
119 1 20 "Average Difference" CB 41 1.230 0.233 1.223 25541
120 1 20 "Average Difference" HN 41 0.530 -0.104 0.527 25541
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 25541
_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 10 10 THR N N 10 114.351 114.351 114.491 -0.140 25541
2 1 . 1 1 10 10 THR HA H 10 4.241 4.241 4.391 -0.150 25541
3 1 . 1 1 10 10 THR C C 10 171.741 171.741 173.359 -1.618 25541
4 1 . 1 1 10 10 THR CA C 10 62.002 62.002 62.068 -0.066 25541
5 1 . 1 1 10 10 THR CB C 10 69.796 69.796 69.766 0.030 25541
6 1 . 1 1 10 10 THR H H 10 8.114 8.114 8.026 0.088 25541
7 1 . 1 1 11 11 LYS N N 11 124.677 124.677 124.045 0.632 25541
8 1 . 1 1 11 11 LYS HA H 11 4.164 4.164 4.307 -0.143 25541
9 1 . 1 1 11 11 LYS C C 11 172.964 172.964 175.265 -2.301 25541
10 1 . 1 1 11 11 LYS CA C 11 56.122 56.122 56.222 -0.100 25541
11 1 . 1 1 11 11 LYS CB C 11 32.819 32.819 33.029 -0.210 25541
12 1 . 1 1 11 11 LYS H H 11 8.436 8.436 8.361 0.075 25541
13 1 . 1 1 12 12 LYS N N 12 123.337 123.337 122.215 1.122 25541
14 1 . 1 1 12 12 LYS HA H 12 4.093 4.093 3.896 0.197 25541
15 1 . 1 1 12 12 LYS C C 12 173.147 173.147 175.061 -1.914 25541
16 1 . 1 1 12 12 LYS CA C 12 56.327 56.327 55.852 0.475 25541
17 1 . 1 1 12 12 LYS CB C 12 33.223 33.223 32.636 0.587 25541
18 1 . 1 1 12 12 LYS H H 12 8.239 8.239 8.030 0.209 25541
19 1 . 1 1 13 13 TYR N N 13 119.233 119.233 117.797 1.436 25541
20 1 . 1 1 13 13 TYR HA H 13 4.401 4.401 4.681 -0.280 25541
21 1 . 1 1 13 13 TYR C C 13 172.016 172.016 174.665 -2.649 25541
22 1 . 1 1 13 13 TYR CA C 13 57.325 57.325 56.985 0.340 25541
23 1 . 1 1 13 13 TYR CB C 13 39.864 39.864 40.895 -1.030 25541
24 1 . 1 1 13 13 TYR H H 13 8.274 8.274 8.031 0.243 25541
25 1 . 1 1 14 14 ASP N N 14 120.486 120.486 122.539 -2.053 25541
26 1 . 1 1 14 14 ASP HA H 14 4.677 4.677 4.935 -0.258 25541
27 1 . 1 1 14 14 ASP C C 14 173.276 173.276 176.253 -2.977 25541
28 1 . 1 1 14 14 ASP CA C 14 52.719 52.719 53.931 -1.212 25541
29 1 . 1 1 14 14 ASP CB C 14 40.205 40.205 41.011 -0.806 25541
30 1 . 1 1 14 14 ASP H H 14 8.603 8.603 8.745 -0.142 25541
31 1 . 1 1 15 15 LEU N N 15 126.405 126.405 126.068 0.337 25541
32 1 . 1 1 15 15 LEU HA H 15 3.765 3.765 5.042 -1.277 25541
33 1 . 1 1 15 15 LEU C C 15 175.592 175.592 177.210 -1.618 25541
34 1 . 1 1 15 15 LEU CA C 15 53.255 53.255 54.258 -1.003 25541
35 1 . 1 1 15 15 LEU CB C 15 39.967 39.967 40.993 -1.026 25541
36 1 . 1 1 15 15 LEU H H 15 8.901 8.901 8.624 0.277 25541
37 1 . 1 1 16 16 SER N N 16 116.540 116.540 116.166 0.374 25541
38 1 . 1 1 16 16 SER HA H 16 4.100 4.100 4.233 -0.133 25541
39 1 . 1 1 16 16 SER C C 16 173.247 173.247 174.612 -1.365 25541
40 1 . 1 1 16 16 SER CA C 16 61.720 61.720 60.634 1.086 25541
41 1 . 1 1 16 16 SER CB C 16 62.797 62.797 63.402 -0.605 25541
42 1 . 1 1 16 16 SER H H 16 8.112 8.112 8.304 -0.192 25541
43 1 . 1 1 17 17 LYS N N 17 118.008 118.008 119.145 -1.137 25541
44 1 . 1 1 17 17 LYS HA H 17 4.501 4.501 4.600 -0.099 25541
45 1 . 1 1 17 17 LYS C C 17 175.079 175.079 175.118 -0.038 25541
46 1 . 1 1 17 17 LYS CA C 17 55.267 55.267 56.038 -0.771 25541
47 1 . 1 1 17 17 LYS CB C 17 31.977 31.977 34.197 -2.220 25541
48 1 . 1 1 17 17 LYS H H 17 8.521 8.521 8.019 0.502 25541
49 1 . 1 1 18 18 TRP N N 18 122.041 122.041 122.624 -0.583 25541
50 1 . 1 1 18 18 TRP HA H 18 4.578 4.578 4.825 -0.247 25541
51 1 . 1 1 18 18 TRP C C 18 174.862 174.862 175.070 -0.208 25541
52 1 . 1 1 18 18 TRP CA C 18 58.371 58.371 57.102 1.269 25541
53 1 . 1 1 18 18 TRP CB C 18 28.544 28.544 32.373 -3.829 25541
54 1 . 1 1 18 18 TRP H H 18 7.853 7.853 8.505 -0.652 25541
55 1 . 1 1 19 19 LYS N N 19 123.185 123.185 121.074 2.111 25541
56 1 . 1 1 19 19 LYS HA H 19 4.535 4.535 4.705 -0.170 25541
57 1 . 1 1 19 19 LYS C C 19 175.094 175.094 177.061 -1.967 25541
58 1 . 1 1 19 19 LYS CA C 19 55.427 55.427 54.855 0.572 25541
59 1 . 1 1 19 19 LYS CB C 19 33.120 33.120 33.963 -0.843 25541
60 1 . 1 1 19 19 LYS H H 19 9.544 9.544 8.455 1.089 25541
61 1 . 1 1 20 20 TYR N N 20 124.291 124.291 125.852 -1.561 25541
62 1 . 1 1 20 20 TYR HA H 20 4.025 4.025 4.051 -0.026 25541
63 1 . 1 1 20 20 TYR C C 20 174.531 174.531 177.164 -2.633 25541
64 1 . 1 1 20 20 TYR CA C 20 63.149 63.149 62.612 0.536 25541
65 1 . 1 1 20 20 TYR CB C 20 38.153 38.153 38.418 -0.265 25541
66 1 . 1 1 20 20 TYR H H 20 9.266 9.266 9.222 0.044 25541
67 1 . 1 1 21 21 ALA N N 21 117.781 117.781 120.989 -3.208 25541
68 1 . 1 1 21 21 ALA HA H 21 3.873 3.873 4.255 -0.382 25541
69 1 . 1 1 21 21 ALA C C 21 176.314 176.314 179.587 -3.273 25541
70 1 . 1 1 21 21 ALA CA C 21 55.335 55.335 55.051 0.284 25541
71 1 . 1 1 21 21 ALA CB C 21 18.703 18.703 17.905 0.798 25541
72 1 . 1 1 21 21 ALA H H 21 8.986 8.986 8.555 0.431 25541
73 1 . 1 1 22 22 GLU N N 22 115.218 115.218 119.421 -4.203 25541
74 1 . 1 1 22 22 GLU HA H 22 4.119 4.119 4.152 -0.033 25541
75 1 . 1 1 22 22 GLU C C 22 177.380 177.380 179.371 -1.991 25541
76 1 . 1 1 22 22 GLU CA C 22 58.479 58.479 59.423 -0.944 25541
77 1 . 1 1 22 22 GLU CB C 22 29.870 29.870 29.376 0.494 25541
78 1 . 1 1 22 22 GLU H H 22 6.854 6.854 8.261 -1.407 25541
79 1 . 1 1 23 23 LEU N N 23 122.132 122.132 120.018 2.114 25541
80 1 . 1 1 23 23 LEU HA H 23 4.156 4.156 4.070 0.086 25541
81 1 . 1 1 23 23 LEU C C 23 174.830 174.830 179.619 -4.789 25541
82 1 . 1 1 23 23 LEU CA C 23 58.522 58.522 58.320 0.202 25541
83 1 . 1 1 23 23 LEU CB C 23 43.119 43.119 41.695 1.424 25541
84 1 . 1 1 23 23 LEU H H 23 7.909 7.909 8.989 -1.080 25541
85 1 . 1 1 24 24 ARG N N 24 118.051 118.051 118.620 -0.569 25541
86 1 . 1 1 24 24 ARG HA H 24 3.637 3.637 3.902 -0.265 25541
87 1 . 1 1 24 24 ARG C C 24 175.240 175.240 178.361 -3.121 25541
88 1 . 1 1 24 24 ARG CA C 24 58.976 58.976 58.785 0.191 25541
89 1 . 1 1 24 24 ARG CB C 24 29.862 29.862 29.720 0.142 25541
90 1 . 1 1 24 24 ARG H H 24 8.250 8.250 7.750 0.500 25541
91 1 . 1 1 25 25 ASP N N 25 118.179 118.179 118.970 -0.791 25541
92 1 . 1 1 25 25 ASP HA H 25 4.385 4.385 4.482 -0.097 25541
93 1 . 1 1 25 25 ASP C C 25 176.554 176.554 178.327 -1.773 25541
94 1 . 1 1 25 25 ASP CA C 25 57.356 57.356 57.229 0.127 25541
95 1 . 1 1 25 25 ASP CB C 25 40.042 40.042 40.716 -0.674 25541
96 1 . 1 1 25 25 ASP H H 25 8.507 8.507 8.409 0.098 25541
97 1 . 1 1 26 26 THR N N 26 118.299 118.299 116.494 1.805 25541
98 1 . 1 1 26 26 THR HA H 26 3.891 3.891 4.027 -0.136 25541
99 1 . 1 1 26 26 THR C C 26 173.365 173.365 176.537 -3.172 25541
100 1 . 1 1 26 26 THR CA C 26 67.787 67.787 66.520 1.267 25541
101 1 . 1 1 26 26 THR CB C 26 68.120 68.120 68.943 -0.823 25541
102 1 . 1 1 26 26 THR H H 26 7.918 7.918 8.400 -0.482 25541
103 1 . 1 1 27 27 ILE N N 27 122.576 122.576 118.994 3.582 25541
104 1 . 1 1 27 27 ILE HA H 27 3.625 3.625 3.829 -0.204 25541
105 1 . 1 1 27 27 ILE C C 27 174.485 174.485 176.341 -1.856 25541
106 1 . 1 1 27 27 ILE CA C 27 64.711 64.711 64.229 0.482 25541
107 1 . 1 1 27 27 ILE CB C 27 37.527 37.527 37.707 -0.180 25541
108 1 . 1 1 27 27 ILE H H 27 8.159 8.159 7.411 0.748 25541
109 1 . 1 1 28 28 ASN N N 28 115.118 115.118 116.049 -0.931 25541
110 1 . 1 1 28 28 ASN HA H 28 4.615 4.615 4.747 -0.132 25541
111 1 . 1 1 28 28 ASN C C 28 173.902 173.902 175.014 -1.112 25541
112 1 . 1 1 28 28 ASN CA C 28 54.460 54.460 53.772 0.688 25541
113 1 . 1 1 28 28 ASN CB C 28 39.230 39.230 39.340 -0.110 25541
114 1 . 1 1 28 28 ASN H H 28 7.713 7.713 7.790 -0.077 25541
115 1 . 1 1 29 29 THR N N 29 107.730 107.730 109.278 -1.548 25541
116 1 . 1 1 29 29 THR HA H 29 4.600 4.600 4.425 0.174 25541
117 1 . 1 1 29 29 THR C C 29 172.290 172.290 174.826 -2.536 25541
118 1 . 1 1 29 29 THR CA C 29 62.595 62.595 62.562 0.033 25541
119 1 . 1 1 29 29 THR CB C 29 72.291 72.291 70.139 2.152 25541
120 1 . 1 1 29 29 THR H H 29 7.587 7.587 7.537 0.050 25541
121 1 . 1 1 30 30 SER N N 30 117.784 117.784 118.200 -0.416 25541
122 1 . 1 1 30 30 SER HA H 30 4.296 4.296 4.584 -0.288 25541
123 1 . 1 1 30 30 SER C C 30 172.473 172.473 173.213 -0.740 25541
124 1 . 1 1 30 30 SER CA C 30 59.618 59.618 58.370 1.248 25541
125 1 . 1 1 30 30 SER CB C 30 64.402 64.402 64.347 0.055 25541
126 1 . 1 1 30 30 SER H H 30 8.698 8.698 8.377 0.321 25541
127 1 . 1 1 31 31 CYS N N 31 121.196 121.196 119.179 2.017 25541
128 1 . 1 1 31 31 CYS HA H 31 4.787 4.787 4.672 0.115 25541
129 1 . 1 1 31 31 CYS C C 31 170.861 170.861 172.420 -1.559 25541
130 1 . 1 1 31 31 CYS CA C 31 57.372 57.372 59.003 -1.631 25541
131 1 . 1 1 31 31 CYS CB C 31 28.364 28.364 29.014 -0.650 25541
132 1 . 1 1 31 31 CYS H H 31 8.713 8.713 8.360 0.353 25541
133 1 . 1 1 32 32 ASP N N 32 124.610 124.610 125.723 -1.113 25541
134 1 . 1 1 32 32 ASP HA H 32 4.613 4.613 4.737 -0.124 25541
135 1 . 1 1 32 32 ASP C C 32 172.541 172.541 175.575 -3.034 25541
136 1 . 1 1 32 32 ASP CA C 32 53.185 53.185 54.024 -0.839 25541
137 1 . 1 1 32 32 ASP CB C 32 41.137 41.137 43.170 -2.033 25541
138 1 . 1 1 32 32 ASP H H 32 8.542 8.542 8.205 0.337 25541
139 1 . 1 1 33 33 ILE N N 33 125.134 125.134 121.792 3.342 25541
140 1 . 1 1 33 33 ILE HA H 33 3.686 3.686 4.021 -0.335 25541
141 1 . 1 1 33 33 ILE C C 33 175.743 175.743 176.164 -0.421 25541
142 1 . 1 1 33 33 ILE CA C 33 64.710 64.710 62.772 1.938 25541
143 1 . 1 1 33 33 ILE CB C 33 37.815 37.815 37.693 0.122 25541
144 1 . 1 1 33 33 ILE H H 33 8.459 8.459 8.565 -0.106 25541
145 1 . 1 1 34 34 GLU N N 34 121.097 121.097 119.598 1.499 25541
146 1 . 1 1 34 34 GLU HA H 34 4.131 4.131 4.293 -0.162 25541
147 1 . 1 1 34 34 GLU C C 34 176.406 176.406 178.160 -1.754 25541
148 1 . 1 1 34 34 GLU CA C 34 59.333 59.333 58.065 1.268 25541
149 1 . 1 1 34 34 GLU CB C 34 29.675 29.675 29.983 -0.308 25541
150 1 . 1 1 34 34 GLU H H 34 8.177 8.177 7.914 0.263 25541
151 1 . 1 1 35 35 LEU N N 35 124.890 124.890 121.186 3.704 25541
152 1 . 1 1 35 35 LEU HA H 35 3.611 3.611 3.877 -0.267 25541
153 1 . 1 1 35 35 LEU C C 35 176.399 176.399 178.936 -2.537 25541
154 1 . 1 1 35 35 LEU CA C 35 57.068 57.068 57.786 -0.718 25541
155 1 . 1 1 35 35 LEU CB C 35 40.910 40.910 41.670 -0.760 25541
156 1 . 1 1 35 35 LEU H H 35 7.831 7.831 7.890 -0.059 25541
157 1 . 1 1 36 36 LEU N N 36 120.493 120.493 118.642 1.852 25541
158 1 . 1 1 36 36 LEU HA H 36 3.659 3.659 3.742 -0.083 25541
159 1 . 1 1 36 36 LEU C C 36 176.280 176.280 178.950 -2.670 25541
160 1 . 1 1 36 36 LEU CA C 36 58.615 58.615 58.135 0.480 25541
161 1 . 1 1 36 36 LEU CB C 36 42.469 42.469 40.973 1.496 25541
162 1 . 1 1 36 36 LEU H H 36 8.843 8.843 7.552 1.291 25541
163 1 . 1 1 37 37 ALA N N 37 119.956 119.956 120.587 -0.631 25541
164 1 . 1 1 37 37 ALA HA H 37 3.997 3.997 3.946 0.051 25541
165 1 . 1 1 37 37 ALA C C 37 177.606 177.606 179.434 -1.828 25541
166 1 . 1 1 37 37 ALA CA C 37 55.169 55.169 54.735 0.434 25541
167 1 . 1 1 37 37 ALA CB C 37 17.620 17.620 17.901 -0.281 25541
168 1 . 1 1 37 37 ALA H H 37 7.610 7.610 8.223 -0.614 25541
169 1 . 1 1 38 38 ALA N N 38 121.594 121.594 121.084 0.510 25541
170 1 . 1 1 38 38 ALA HA H 38 4.103 4.103 4.217 -0.114 25541
171 1 . 1 1 38 38 ALA C C 38 178.452 178.452 178.869 -0.417 25541
172 1 . 1 1 38 38 ALA CA C 38 54.855 54.855 54.428 0.427 25541
173 1 . 1 1 38 38 ALA CB C 38 18.060 18.060 18.410 -0.350 25541
174 1 . 1 1 38 38 ALA H H 38 7.665 7.665 8.292 -0.627 25541
175 1 . 1 1 39 39 CYS N N 39 119.263 119.263 118.065 1.198 25541
176 1 . 1 1 39 39 CYS HA H 39 3.731 3.731 3.889 -0.158 25541
177 1 . 1 1 39 39 CYS C C 39 173.860 173.860 176.750 -2.890 25541
178 1 . 1 1 39 39 CYS CA C 39 63.823 63.823 62.358 1.465 25541
179 1 . 1 1 39 39 CYS CB C 39 27.225 27.225 27.392 -0.167 25541
180 1 . 1 1 39 39 CYS H H 39 8.766 8.766 8.534 0.232 25541
181 1 . 1 1 40 40 ARG N N 40 119.658 119.658 119.243 0.415 25541
182 1 . 1 1 40 40 ARG HA H 40 3.898 3.898 3.862 0.036 25541
183 1 . 1 1 40 40 ARG C C 40 176.108 176.108 178.611 -2.503 25541
184 1 . 1 1 40 40 ARG CA C 40 60.482 60.482 59.702 0.780 25541
185 1 . 1 1 40 40 ARG CB C 40 29.864 29.864 29.722 0.142 25541
186 1 . 1 1 40 40 ARG H H 40 8.327 8.327 8.430 -0.103 25541
187 1 . 1 1 41 41 GLU N N 41 119.358 119.358 118.249 1.109 25541
188 1 . 1 1 41 41 GLU HA H 41 4.099 4.099 3.927 0.172 25541
189 1 . 1 1 41 41 GLU C C 41 171.786 171.786 178.814 -7.028 25541
190 1 . 1 1 41 41 GLU CA C 41 59.213 59.213 59.454 -0.241 25541
191 1 . 1 1 41 41 GLU CB C 41 29.277 29.277 29.279 -0.002 25541
192 1 . 1 1 41 41 GLU H H 41 7.929 7.929 7.698 0.231 25541
193 1 . 1 1 42 42 GLU N N 42 121.281 121.281 119.244 2.037 25541
194 1 . 1 1 42 42 GLU HA H 42 4.223 4.223 4.121 0.102 25541
195 1 . 1 1 42 42 GLU C C 42 173.408 173.408 178.839 -5.431 25541
196 1 . 1 1 42 42 GLU CA C 42 58.319 58.319 58.362 -0.043 25541
197 1 . 1 1 42 42 GLU CB C 42 28.215 28.215 29.202 -0.987 25541
198 1 . 1 1 42 42 GLU H H 42 7.945 7.945 7.671 0.274 25541
199 1 . 1 1 43 43 PHE N N 43 119.271 119.271 121.254 -1.983 25541
200 1 . 1 1 43 43 PHE HA H 43 4.077 4.077 4.029 0.048 25541
201 1 . 1 1 43 43 PHE C C 43 175.299 175.299 177.371 -2.072 25541
202 1 . 1 1 43 43 PHE CA C 43 61.549 61.549 61.940 -0.391 25541
203 1 . 1 1 43 43 PHE CB C 43 39.134 39.134 39.107 0.027 25541
204 1 . 1 1 43 43 PHE H H 43 8.624 8.624 8.576 0.048 25541
205 1 . 1 1 44 44 HIS N N 44 116.374 116.374 116.702 -0.328 25541
206 1 . 1 1 44 44 HIS HA H 44 4.266 4.266 4.338 -0.072 25541
207 1 . 1 1 44 44 HIS C C 44 174.771 174.771 177.872 -3.101 25541
208 1 . 1 1 44 44 HIS CA C 44 59.343 59.343 59.008 0.335 25541
209 1 . 1 1 44 44 HIS CB C 44 29.488 29.488 29.853 -0.365 25541
210 1 . 1 1 44 44 HIS H H 44 7.976 7.976 8.092 -0.116 25541
211 1 . 1 1 45 45 ARG N N 45 120.170 120.170 118.925 1.245 25541
212 1 . 1 1 45 45 ARG HA H 45 3.946 3.946 4.056 -0.110 25541
213 1 . 1 1 45 45 ARG C C 45 176.310 176.310 178.443 -2.133 25541
214 1 . 1 1 45 45 ARG CA C 45 59.206 59.206 59.183 0.023 25541
215 1 . 1 1 45 45 ARG CB C 45 30.388 30.388 29.953 0.435 25541
216 1 . 1 1 45 45 ARG H H 45 8.166 8.166 7.881 0.285 25541
217 1 . 1 1 46 46 ARG N N 46 116.229 116.229 118.342 -2.113 25541
218 1 . 1 1 46 46 ARG HA H 46 4.065 4.065 4.111 -0.046 25541
219 1 . 1 1 46 46 ARG C C 46 176.046 176.046 178.281 -2.235 25541
220 1 . 1 1 46 46 ARG CA C 46 57.691 57.691 57.916 -0.225 25541
221 1 . 1 1 46 46 ARG CB C 46 30.248 30.248 29.357 0.891 25541
222 1 . 1 1 46 46 ARG H H 46 7.764 7.764 7.608 0.156 25541
223 1 . 1 1 47 47 LEU N N 47 119.010 119.010 118.923 0.087 25541
224 1 . 1 1 47 47 LEU HA H 47 4.135 4.135 4.088 0.047 25541
225 1 . 1 1 47 47 LEU CA C 47 55.957 55.957 57.122 -1.165 25541
226 1 . 1 1 47 47 LEU CB C 47 42.024 42.024 41.645 0.379 25541
227 1 . 1 1 47 47 LEU H H 47 7.557 7.557 7.538 0.019 25541
228 1 . 1 1 48 48 LYS N N 48 119.277 119.277 118.566 0.711 25541
229 1 . 1 1 48 48 LYS HA H 48 4.075 4.075 4.166 -0.092 25541
230 1 . 1 1 48 48 LYS C C 48 176.354 176.354 177.119 -0.765 25541
231 1 . 1 1 48 48 LYS CA C 48 56.655 56.655 57.832 -1.177 25541
232 1 . 1 1 48 48 LYS CB C 48 32.410 32.410 32.839 -0.429 25541
233 1 . 1 1 48 48 LYS H H 48 7.662 7.662 7.581 0.081 25541
234 1 . 1 1 49 49 VAL N N 49 119.095 119.095 118.785 0.310 25541
235 1 . 1 1 49 49 VAL HA H 49 3.972 3.972 3.970 0.002 25541
236 1 . 1 1 49 49 VAL C C 49 174.195 174.195 175.106 -0.911 25541
237 1 . 1 1 49 49 VAL CA C 49 62.214 62.214 62.192 0.022 25541
238 1 . 1 1 49 49 VAL CB C 49 32.747 32.747 32.391 0.356 25541
239 1 . 1 1 49 49 VAL H H 49 7.688 7.688 7.751 -0.063 25541
240 1 . 1 1 50 50 TYR N N 50 123.606 123.606 122.482 1.124 25541
241 1 . 1 1 50 50 TYR HA H 50 4.482 4.482 4.563 -0.081 25541
242 1 . 1 1 50 50 TYR CA C 50 57.855 57.855 57.132 0.723 25541
243 1 . 1 1 50 50 TYR CB C 50 38.721 38.721 37.647 1.075 25541
244 1 . 1 1 50 50 TYR H H 50 8.164 8.164 8.092 0.072 25541
stop_
save_