data_25085
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25085
_Entry.PDB_ID 2MRM
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 25085
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 ALA N N 2 125.104 125.104 123.090 2.014 25085
2 1 1 . 1 1 2 2 ALA HA H 2 4.287 4.287 4.550 -0.263 25085
3 1 1 . 1 1 2 2 ALA C C 2 176.800 176.800 175.771 1.029 25085
4 1 1 . 1 1 2 2 ALA CA C 2 52.429 52.429 51.914 0.515 25085
5 1 1 . 1 1 2 2 ALA CB C 2 19.407 19.407 19.395 0.012 25085
6 1 1 . 1 1 2 2 ALA H H 2 8.344 8.344 7.961 0.383 25085
7 1 1 . 1 1 3 3 LEU N N 3 120.515 120.515 118.586 1.929 25085
8 1 1 . 1 1 3 3 LEU HA H 3 4.452 4.452 4.881 -0.429 25085
9 1 1 . 1 1 3 3 LEU C C 3 176.497 176.497 176.393 0.104 25085
10 1 1 . 1 1 3 3 LEU CA C 3 54.698 54.698 54.513 0.185 25085
11 1 1 . 1 1 3 3 LEU CB C 3 43.203 43.203 42.346 0.857 25085
12 1 1 . 1 1 3 3 LEU H H 3 8.070 8.070 7.702 0.368 25085
13 1 1 . 1 1 4 4 THR N N 4 117.803 117.803 121.207 -3.404 25085
14 1 1 . 1 1 4 4 THR HA H 4 4.480 4.480 4.729 -0.249 25085
15 1 1 . 1 1 4 4 THR C C 4 173.872 173.872 173.899 -0.027 25085
16 1 1 . 1 1 4 4 THR CA C 4 62.247 62.247 61.248 0.999 25085
17 1 1 . 1 1 4 4 THR CB C 4 70.533 70.533 71.324 -0.791 25085
18 1 1 . 1 1 4 4 THR H H 4 7.954 7.954 8.376 -0.422 25085
19 1 1 . 1 1 5 5 THR N N 5 121.501 121.501 116.109 5.392 25085
20 1 1 . 1 1 5 5 THR HA H 5 5.289 5.289 4.488 0.801 25085
21 1 1 . 1 1 5 5 THR C C 5 174.162 174.162 173.592 0.570 25085
22 1 1 . 1 1 5 5 THR CA C 5 62.102 62.102 62.232 -0.130 25085
23 1 1 . 1 1 5 5 THR CB C 5 69.457 69.457 69.579 -0.122 25085
24 1 1 . 1 1 5 5 THR H H 5 8.640 8.640 8.453 0.187 25085
25 1 1 . 1 1 6 6 ILE N N 6 122.023 122.023 124.019 -1.996 25085
26 1 1 . 1 1 6 6 ILE HA H 6 4.988 4.988 4.463 0.524 25085
27 1 1 . 1 1 6 6 ILE C C 6 173.377 173.377 173.875 -0.498 25085
28 1 1 . 1 1 6 6 ILE CA C 6 58.611 58.611 59.759 -1.148 25085
29 1 1 . 1 1 6 6 ILE CB C 6 42.821 42.821 42.686 0.135 25085
30 1 1 . 1 1 6 6 ILE H H 6 8.977 8.977 9.207 -0.230 25085
31 1 1 . 1 1 7 7 SER N N 7 122.659 122.659 117.975 4.684 25085
32 1 1 . 1 1 7 7 SER HA H 7 4.768 4.768 5.095 -0.327 25085
33 1 1 . 1 1 7 7 SER CA C 7 56.790 56.790 54.703 2.087 25085
34 1 1 . 1 1 7 7 SER CB C 7 63.235 63.235 64.101 -0.866 25085
35 1 1 . 1 1 7 7 SER H H 7 9.242 9.242 8.641 0.601 25085
36 1 1 . 1 1 8 8 PRO HA H 8 4.207 4.207 4.315 -0.108 25085
37 1 1 . 1 1 8 8 PRO C C 8 176.787 176.787 178.496 -1.709 25085
38 1 1 . 1 1 8 8 PRO CA C 8 66.443 66.443 65.413 1.030 25085
39 1 1 . 1 1 8 8 PRO CB C 8 32.724 32.724 31.994 0.730 25085
40 1 1 . 1 1 9 9 HIS N N 9 113.700 113.700 114.403 -0.703 25085
41 1 1 . 1 1 9 9 HIS HA H 9 3.990 3.990 4.462 -0.472 25085
42 1 1 . 1 1 9 9 HIS C C 9 178.123 178.123 177.262 0.861 25085
43 1 1 . 1 1 9 9 HIS CA C 9 60.827 60.827 59.559 1.268 25085
44 1 1 . 1 1 9 9 HIS CB C 9 29.552 29.552 29.895 -0.344 25085
45 1 1 . 1 1 9 9 HIS H H 9 8.172 8.172 8.266 -0.094 25085
46 1 1 . 1 1 10 10 ASP N N 10 120.665 120.665 120.632 0.033 25085
47 1 1 . 1 1 10 10 ASP HA H 10 4.369 4.369 4.591 -0.222 25085
48 1 1 . 1 1 10 10 ASP C C 10 179.100 179.100 177.716 1.384 25085
49 1 1 . 1 1 10 10 ASP CA C 10 57.071 57.071 56.609 0.462 25085
50 1 1 . 1 1 10 10 ASP CB C 10 39.529 39.529 41.249 -1.720 25085
51 1 1 . 1 1 10 10 ASP H H 10 7.706 7.706 8.691 -0.985 25085
52 1 1 . 1 1 11 11 ALA N N 11 123.686 123.686 121.714 1.972 25085
53 1 1 . 1 1 11 11 ALA HA H 11 3.782 3.782 3.754 0.028 25085
54 1 1 . 1 1 11 11 ALA C C 11 178.260 178.260 178.945 -0.685 25085
55 1 1 . 1 1 11 11 ALA CA C 11 55.142 55.142 55.268 -0.126 25085
56 1 1 . 1 1 11 11 ALA CB C 11 18.293 18.293 18.084 0.209 25085
57 1 1 . 1 1 11 11 ALA H H 11 8.896 8.896 7.585 1.311 25085
58 1 1 . 1 1 12 12 GLN N N 12 117.521 117.521 118.258 -0.737 25085
59 1 1 . 1 1 12 12 GLN HA H 12 4.000 4.000 3.978 0.022 25085
60 1 1 . 1 1 12 12 GLN C C 12 178.499 178.499 177.922 0.577 25085
61 1 1 . 1 1 12 12 GLN CA C 12 60.102 60.102 59.432 0.670 25085
62 1 1 . 1 1 12 12 GLN CB C 12 28.743 28.743 28.383 0.360 25085
63 1 1 . 1 1 12 12 GLN H H 12 8.431 8.431 8.070 0.361 25085
64 1 1 . 1 1 13 13 GLU N N 13 118.578 118.578 118.298 0.280 25085
65 1 1 . 1 1 13 13 GLU HA H 13 4.059 4.059 4.047 0.012 25085
66 1 1 . 1 1 13 13 GLU C C 13 178.352 178.352 178.640 -0.288 25085
67 1 1 . 1 1 13 13 GLU CA C 13 59.079 59.079 58.933 0.146 25085
68 1 1 . 1 1 13 13 GLU CB C 13 29.213 29.213 28.991 0.221 25085
69 1 1 . 1 1 13 13 GLU H H 13 7.234 7.234 7.990 -0.756 25085
70 1 1 . 1 1 14 14 LEU N N 14 119.848 119.848 117.277 2.571 25085
71 1 1 . 1 1 14 14 LEU HA H 14 3.891 3.891 4.223 -0.332 25085
72 1 1 . 1 1 14 14 LEU C C 14 180.773 180.773 178.483 2.290 25085
73 1 1 . 1 1 14 14 LEU CA C 14 57.958 57.958 56.756 1.202 25085
74 1 1 . 1 1 14 14 LEU CB C 14 41.715 41.715 42.154 -0.439 25085
75 1 1 . 1 1 14 14 LEU H H 14 7.582 7.582 7.431 0.151 25085
76 1 1 . 1 1 15 15 ILE N N 15 122.392 122.392 119.524 2.868 25085
77 1 1 . 1 1 15 15 ILE HA H 15 3.924 3.924 3.653 0.271 25085
78 1 1 . 1 1 15 15 ILE C C 15 180.109 180.109 177.643 2.466 25085
79 1 1 . 1 1 15 15 ILE CA C 15 64.663 64.663 64.574 0.089 25085
80 1 1 . 1 1 15 15 ILE CB C 15 38.900 38.900 37.597 1.303 25085
81 1 1 . 1 1 15 15 ILE H H 15 8.772 8.772 7.858 0.914 25085
82 1 1 . 1 1 16 16 ALA N N 16 123.856 123.856 119.621 4.235 25085
83 1 1 . 1 1 16 16 ALA HA H 16 4.183 4.183 4.261 -0.078 25085
84 1 1 . 1 1 16 16 ALA C C 16 179.100 179.100 178.375 0.725 25085
85 1 1 . 1 1 16 16 ALA CA C 16 54.806 54.806 53.580 1.226 25085
86 1 1 . 1 1 16 16 ALA CB C 16 17.646 17.646 18.832 -1.186 25085
87 1 1 . 1 1 16 16 ALA H H 16 7.808 7.808 7.576 0.232 25085
88 1 1 . 1 1 17 17 ARG N N 17 115.329 115.329 119.388 -4.059 25085
89 1 1 . 1 1 17 17 ARG HA H 17 4.404 4.404 4.331 0.073 25085
90 1 1 . 1 1 17 17 ARG C C 17 176.446 176.446 177.384 -0.938 25085
91 1 1 . 1 1 17 17 ARG CA C 17 56.015 56.015 57.205 -1.190 25085
92 1 1 . 1 1 17 17 ARG CB C 17 30.676 30.676 31.324 -0.648 25085
93 1 1 . 1 1 17 17 ARG H H 17 7.280 7.280 8.329 -1.049 25085
94 1 1 . 1 1 18 18 GLY N N 18 107.395 107.395 104.224 3.171 25085
95 1 1 . 1 1 18 18 GLY C C 18 174.072 174.072 173.649 0.423 25085
96 1 1 . 1 1 18 18 GLY CA C 18 45.218 45.218 44.619 0.599 25085
97 1 1 . 1 1 18 18 GLY H H 18 7.795 7.795 8.312 -0.517 25085
98 1 1 . 1 1 19 19 ALA N N 19 123.197 123.197 123.959 -0.762 25085
99 1 1 . 1 1 19 19 ALA HA H 19 4.217 4.217 4.071 0.146 25085
100 1 1 . 1 1 19 19 ALA C C 19 176.261 176.261 177.378 -1.117 25085
101 1 1 . 1 1 19 19 ALA CA C 19 52.674 52.674 53.261 -0.587 25085
102 1 1 . 1 1 19 19 ALA CB C 19 19.411 19.411 19.327 0.084 25085
103 1 1 . 1 1 19 19 ALA H H 19 7.980 7.980 7.571 0.409 25085
104 1 1 . 1 1 20 20 LYS N N 20 118.629 118.629 122.453 -3.824 25085
105 1 1 . 1 1 20 20 LYS HA H 20 4.308 4.308 4.434 -0.126 25085
106 1 1 . 1 1 20 20 LYS C C 20 173.981 173.981 175.175 -1.194 25085
107 1 1 . 1 1 20 20 LYS CA C 20 53.820 53.820 55.133 -1.313 25085
108 1 1 . 1 1 20 20 LYS CB C 20 33.571 33.571 32.972 0.598 25085
109 1 1 . 1 1 20 20 LYS H H 20 7.589 7.589 7.988 -0.399 25085
110 1 1 . 1 1 21 21 LEU N N 21 126.686 126.686 126.248 0.438 25085
111 1 1 . 1 1 21 21 LEU HA H 21 5.154 5.154 4.553 0.601 25085
112 1 1 . 1 1 21 21 LEU C C 21 174.076 174.076 175.843 -1.767 25085
113 1 1 . 1 1 21 21 LEU CA C 21 53.262 53.262 55.016 -1.754 25085
114 1 1 . 1 1 21 21 LEU CB C 21 44.350 44.350 43.256 1.094 25085
115 1 1 . 1 1 21 21 LEU H H 21 8.812 8.812 8.721 0.091 25085
116 1 1 . 1 1 22 22 ILE N N 22 127.566 127.566 121.786 5.780 25085
117 1 1 . 1 1 22 22 ILE HA H 22 4.678 4.678 4.840 -0.162 25085
118 1 1 . 1 1 22 22 ILE C C 22 173.136 173.136 173.706 -0.570 25085
119 1 1 . 1 1 22 22 ILE CA C 22 60.160 60.160 59.451 0.709 25085
120 1 1 . 1 1 22 22 ILE CB C 22 39.842 39.842 41.604 -1.762 25085
121 1 1 . 1 1 22 22 ILE H H 22 9.416 9.416 8.944 0.472 25085
122 1 1 . 1 1 23 23 ASP N N 23 129.217 129.217 124.105 5.112 25085
123 1 1 . 1 1 23 23 ASP HA H 23 3.806 3.806 4.957 -1.151 25085
124 1 1 . 1 1 23 23 ASP C C 23 176.042 176.042 175.103 0.939 25085
125 1 1 . 1 1 23 23 ASP CA C 23 52.005 52.005 51.942 0.063 25085
126 1 1 . 1 1 23 23 ASP CB C 23 42.984 42.984 44.056 -1.072 25085
127 1 1 . 1 1 23 23 ASP H H 23 8.619 8.619 8.748 -0.129 25085
128 1 1 . 1 1 24 24 ILE N N 24 115.522 115.522 120.178 -4.656 25085
129 1 1 . 1 1 24 24 ILE HA H 24 5.255 5.255 4.983 0.272 25085
130 1 1 . 1 1 24 24 ILE C C 24 178.920 178.920 173.787 5.133 25085
131 1 1 . 1 1 24 24 ILE CA C 24 60.188 60.188 59.828 0.360 25085
132 1 1 . 1 1 24 24 ILE CB C 24 38.015 38.015 37.839 0.176 25085
133 1 1 . 1 1 24 24 ILE H H 24 7.877 7.877 7.593 0.284 25085
134 1 1 . 1 1 25 25 ARG N N 25 124.317 124.317 122.406 1.911 25085
135 1 1 . 1 1 25 25 ARG HA H 25 4.170 4.170 4.544 -0.374 25085
136 1 1 . 1 1 25 25 ARG C C 25 171.756 171.756 174.208 -2.452 25085
137 1 1 . 1 1 25 25 ARG CA C 25 56.547 56.547 54.812 1.735 25085
138 1 1 . 1 1 25 25 ARG CB C 25 30.897 30.897 31.083 -0.186 25085
139 1 1 . 1 1 25 25 ARG H H 25 8.235 8.235 7.611 0.624 25085
140 1 1 . 1 1 26 26 ASP N N 26 112.059 112.059 121.293 -9.234 25085
141 1 1 . 1 1 26 26 ASP HA H 26 4.609 4.609 4.942 -0.333 25085
142 1 1 . 1 1 26 26 ASP C C 26 177.934 177.934 176.979 0.955 25085
143 1 1 . 1 1 26 26 ASP CA C 26 54.398 54.398 53.340 1.058 25085
144 1 1 . 1 1 26 26 ASP CB C 26 42.029 42.029 42.140 -0.111 25085
145 1 1 . 1 1 26 26 ASP H H 26 7.730 7.730 8.629 -0.899 25085
146 1 1 . 1 1 27 27 ALA N N 27 121.435 121.435 128.505 -7.070 25085
147 1 1 . 1 1 27 27 ALA HA H 27 3.959 3.959 3.901 0.058 25085
148 1 1 . 1 1 27 27 ALA C C 27 179.388 179.388 178.575 0.813 25085
149 1 1 . 1 1 27 27 ALA CA C 27 55.829 55.829 55.754 0.075 25085
150 1 1 . 1 1 27 27 ALA CB C 27 18.572 18.572 18.177 0.395 25085
151 1 1 . 1 1 27 27 ALA H H 27 8.797 8.797 8.869 -0.072 25085
152 1 1 . 1 1 28 28 ASP N N 28 114.759 114.759 117.534 -2.775 25085
153 1 1 . 1 1 28 28 ASP HA H 28 4.314 4.314 4.381 -0.067 25085
154 1 1 . 1 1 28 28 ASP C C 28 178.738 178.738 178.873 -0.135 25085
155 1 1 . 1 1 28 28 ASP CA C 28 56.997 56.997 57.431 -0.434 25085
156 1 1 . 1 1 28 28 ASP CB C 28 39.811 39.811 40.519 -0.708 25085
157 1 1 . 1 1 28 28 ASP H H 28 8.755 8.755 8.778 -0.023 25085
158 1 1 . 1 1 29 29 GLU N N 29 119.562 119.562 118.438 1.124 25085
159 1 1 . 1 1 29 29 GLU HA H 29 4.116 4.116 4.226 -0.110 25085
160 1 1 . 1 1 29 29 GLU C C 29 178.473 178.473 178.975 -0.502 25085
161 1 1 . 1 1 29 29 GLU CA C 29 58.928 58.928 58.328 0.600 25085
162 1 1 . 1 1 29 29 GLU CB C 29 29.395 29.395 30.207 -0.812 25085
163 1 1 . 1 1 29 29 GLU H H 29 7.446 7.446 8.647 -1.201 25085
164 1 1 . 1 1 30 30 TYR N N 30 120.494 120.494 121.165 -0.671 25085
165 1 1 . 1 1 30 30 TYR HA H 30 4.092 4.092 4.547 -0.455 25085
166 1 1 . 1 1 30 30 TYR C C 30 176.988 176.988 177.525 -0.537 25085
167 1 1 . 1 1 30 30 TYR CA C 30 60.931 60.931 60.981 -0.050 25085
168 1 1 . 1 1 30 30 TYR CB C 30 39.534 39.534 38.765 0.769 25085
169 1 1 . 1 1 30 30 TYR H H 30 7.545 7.545 7.610 -0.065 25085
170 1 1 . 1 1 31 31 LEU N N 31 118.227 118.227 118.880 -0.653 25085
171 1 1 . 1 1 31 31 LEU HA H 31 3.916 3.916 4.038 -0.122 25085
172 1 1 . 1 1 31 31 LEU C C 31 178.824 178.824 178.205 0.619 25085
173 1 1 . 1 1 31 31 LEU CA C 31 57.444 57.444 58.091 -0.647 25085
174 1 1 . 1 1 31 31 LEU CB C 31 41.941 41.941 42.337 -0.396 25085
175 1 1 . 1 1 31 31 LEU H H 31 8.235 8.235 8.909 -0.674 25085
176 1 1 . 1 1 32 32 ARG N N 32 117.334 117.334 115.863 1.471 25085
177 1 1 . 1 1 32 32 ARG HA H 32 4.112 4.112 4.098 0.014 25085
178 1 1 . 1 1 32 32 ARG C C 32 177.008 177.008 176.667 0.341 25085
179 1 1 . 1 1 32 32 ARG CA C 32 59.366 59.366 58.271 1.095 25085
180 1 1 . 1 1 32 32 ARG CB C 32 30.938 30.938 30.417 0.521 25085
181 1 1 . 1 1 32 32 ARG H H 32 7.133 7.133 7.555 -0.422 25085
182 1 1 . 1 1 33 33 GLU N N 33 117.282 117.282 119.358 -2.076 25085
183 1 1 . 1 1 33 33 GLU HA H 33 4.893 4.893 4.404 0.489 25085
184 1 1 . 1 1 33 33 GLU C C 33 173.503 173.503 173.567 -0.064 25085
185 1 1 . 1 1 33 33 GLU CA C 33 56.291 56.291 55.943 0.348 25085
186 1 1 . 1 1 33 33 GLU CB C 33 32.248 32.248 32.790 -0.542 25085
187 1 1 . 1 1 33 33 GLU H H 33 7.521 7.521 7.478 0.043 25085
188 1 1 . 1 1 34 34 HIS N N 34 117.828 117.828 124.736 -6.908 25085
189 1 1 . 1 1 34 34 HIS HA H 34 4.627 4.627 4.096 0.531 25085
190 1 1 . 1 1 34 34 HIS C C 34 171.950 171.950 172.753 -0.803 25085
191 1 1 . 1 1 34 34 HIS CA C 34 54.304 54.304 54.169 0.135 25085
192 1 1 . 1 1 34 34 HIS CB C 34 30.712 30.712 33.435 -2.724 25085
193 1 1 . 1 1 34 34 HIS H H 34 8.354 8.354 9.264 -0.910 25085
194 1 1 . 1 1 35 35 ILE N N 35 126.965 126.965 123.534 3.431 25085
195 1 1 . 1 1 35 35 ILE HA H 35 3.973 3.973 4.204 -0.231 25085
196 1 1 . 1 1 35 35 ILE CA C 35 60.500 60.500 57.678 2.822 25085
197 1 1 . 1 1 35 35 ILE CB C 35 38.822 38.822 38.217 0.605 25085
198 1 1 . 1 1 35 35 ILE H H 35 10.032 10.032 7.853 2.179 25085
199 1 1 . 1 1 36 36 PRO HA H 36 4.033 4.033 4.245 -0.212 25085
200 1 1 . 1 1 36 36 PRO C C 36 177.308 177.308 176.204 1.104 25085
201 1 1 . 1 1 36 36 PRO CA C 36 66.191 66.191 63.646 2.545 25085
202 1 1 . 1 1 36 36 PRO CB C 36 31.701 31.701 29.846 1.855 25085
203 1 1 . 1 1 37 37 GLU N N 37 113.735 113.735 117.170 -3.435 25085
204 1 1 . 1 1 37 37 GLU HA H 37 4.083 4.083 4.355 -0.272 25085
205 1 1 . 1 1 37 37 GLU C C 37 176.274 176.274 174.483 1.791 25085
206 1 1 . 1 1 37 37 GLU CA C 37 58.285 58.285 56.300 1.985 25085
207 1 1 . 1 1 37 37 GLU CB C 37 28.895 28.895 29.555 -0.660 25085
208 1 1 . 1 1 37 37 GLU H H 37 8.625 8.625 9.201 -0.576 25085
209 1 1 . 1 1 38 38 ALA N N 38 122.325 122.325 121.790 0.535 25085
210 1 1 . 1 1 38 38 ALA HA H 38 4.484 4.484 4.699 -0.215 25085
211 1 1 . 1 1 38 38 ALA C C 38 178.043 178.043 175.383 2.660 25085
212 1 1 . 1 1 38 38 ALA CA C 38 52.385 52.385 51.543 0.842 25085
213 1 1 . 1 1 38 38 ALA CB C 38 21.151 21.151 21.943 -0.792 25085
214 1 1 . 1 1 38 38 ALA H H 38 8.160 8.160 7.521 0.639 25085
215 1 1 . 1 1 39 39 ASP N N 39 123.726 123.726 120.442 3.284 25085
216 1 1 . 1 1 39 39 ASP HA H 39 4.856 4.856 4.778 0.078 25085
217 1 1 . 1 1 39 39 ASP C C 39 174.077 174.077 175.054 -0.977 25085
218 1 1 . 1 1 39 39 ASP CA C 39 53.498 53.498 53.750 -0.252 25085
219 1 1 . 1 1 39 39 ASP CB C 39 45.176 45.176 42.381 2.795 25085
220 1 1 . 1 1 39 39 ASP H H 39 9.095 9.095 8.971 0.124 25085
221 1 1 . 1 1 40 40 LEU N N 40 123.111 123.111 123.612 -0.501 25085
222 1 1 . 1 1 40 40 LEU HA H 40 4.339 4.339 4.146 0.193 25085
223 1 1 . 1 1 40 40 LEU C C 40 176.159 176.159 175.436 0.723 25085
224 1 1 . 1 1 40 40 LEU CA C 40 54.766 54.766 53.703 1.063 25085
225 1 1 . 1 1 40 40 LEU CB C 40 41.988 41.988 43.229 -1.241 25085
226 1 1 . 1 1 40 40 LEU H H 40 8.199 8.199 8.256 -0.057 25085
227 1 1 . 1 1 41 41 ALA N N 41 130.678 130.678 130.392 0.286 25085
228 1 1 . 1 1 41 41 ALA HA H 41 4.430 4.430 4.720 -0.290 25085
229 1 1 . 1 1 41 41 ALA CA C 41 49.844 49.844 49.646 0.198 25085
230 1 1 . 1 1 41 41 ALA CB C 41 18.765 18.765 19.918 -1.153 25085
231 1 1 . 1 1 41 41 ALA H H 41 8.705 8.705 8.795 -0.090 25085
232 1 1 . 1 1 42 42 PRO HA H 42 4.133 4.133 4.405 -0.272 25085
233 1 1 . 1 1 42 42 PRO C C 42 178.946 178.946 178.105 0.841 25085
234 1 1 . 1 1 42 42 PRO CA C 42 62.119 62.119 62.924 -0.805 25085
235 1 1 . 1 1 42 42 PRO CB C 42 33.383 33.383 32.070 1.313 25085
236 1 1 . 1 1 43 43 LEU N N 43 124.604 124.604 127.965 -3.361 25085
237 1 1 . 1 1 43 43 LEU HA H 43 3.881 3.881 3.817 0.064 25085
238 1 1 . 1 1 43 43 LEU C C 43 176.869 176.869 178.751 -1.882 25085
239 1 1 . 1 1 43 43 LEU CA C 43 58.639 58.639 58.862 -0.223 25085
240 1 1 . 1 1 43 43 LEU CB C 43 41.848 41.848 41.839 0.009 25085
241 1 1 . 1 1 43 43 LEU H H 43 8.330 8.330 8.607 -0.277 25085
242 1 1 . 1 1 44 44 SER N N 44 110.167 110.167 112.617 -2.450 25085
243 1 1 . 1 1 44 44 SER HA H 44 4.147 4.147 4.057 0.090 25085
244 1 1 . 1 1 44 44 SER C C 44 177.107 177.107 176.346 0.761 25085
245 1 1 . 1 1 44 44 SER CA C 44 61.043 61.043 61.363 -0.320 25085
246 1 1 . 1 1 44 44 SER CB C 44 61.765 61.765 62.551 -0.786 25085
247 1 1 . 1 1 44 44 SER H H 44 8.553 8.553 8.295 0.258 25085
248 1 1 . 1 1 45 45 VAL N N 45 123.549 123.549 122.084 1.465 25085
249 1 1 . 1 1 45 45 VAL HA H 45 3.825 3.825 3.861 -0.036 25085
250 1 1 . 1 1 45 45 VAL C C 45 178.328 178.328 177.690 0.638 25085
251 1 1 . 1 1 45 45 VAL CA C 45 65.576 65.576 65.204 0.372 25085
252 1 1 . 1 1 45 45 VAL CB C 45 31.889 31.889 31.449 0.440 25085
253 1 1 . 1 1 45 45 VAL H H 45 7.181 7.181 8.496 -1.315 25085
254 1 1 . 1 1 46 46 LEU N N 46 120.336 120.336 121.408 -1.072 25085
255 1 1 . 1 1 46 46 LEU HA H 46 3.826 3.826 4.150 -0.324 25085
256 1 1 . 1 1 46 46 LEU C C 46 179.996 179.996 178.490 1.506 25085
257 1 1 . 1 1 46 46 LEU CA C 46 57.602 57.602 57.654 -0.052 25085
258 1 1 . 1 1 46 46 LEU CB C 46 41.691 41.691 42.109 -0.418 25085
259 1 1 . 1 1 46 46 LEU H H 46 8.040 8.040 8.145 -0.105 25085
260 1 1 . 1 1 47 47 GLU N N 47 115.713 115.713 118.340 -2.627 25085
261 1 1 . 1 1 47 47 GLU HA H 47 3.820 3.820 3.970 -0.150 25085
262 1 1 . 1 1 47 47 GLU C C 47 177.029 177.029 178.116 -1.087 25085
263 1 1 . 1 1 47 47 GLU CA C 47 59.317 59.317 59.005 0.312 25085
264 1 1 . 1 1 47 47 GLU CB C 47 30.526 30.526 29.950 0.576 25085
265 1 1 . 1 1 47 47 GLU H H 47 8.567 8.567 8.270 0.297 25085
266 1 1 . 1 1 48 48 GLN N N 48 116.740 116.740 116.304 0.436 25085
267 1 1 . 1 1 48 48 GLN HA H 48 4.281 4.281 4.283 -0.002 25085
268 1 1 . 1 1 48 48 GLN C C 48 177.605 177.605 177.726 -0.121 25085
269 1 1 . 1 1 48 48 GLN CA C 48 57.827 57.827 57.128 0.699 25085
270 1 1 . 1 1 48 48 GLN CB C 48 29.985 29.985 29.276 0.709 25085
271 1 1 . 1 1 48 48 GLN H H 48 7.472 7.472 7.822 -0.350 25085
272 1 1 . 1 1 49 49 SER N N 49 111.004 111.004 116.201 -5.197 25085
273 1 1 . 1 1 49 49 SER HA H 49 4.648 4.648 4.377 0.271 25085
274 1 1 . 1 1 49 49 SER C C 49 174.859 174.859 174.646 0.213 25085
275 1 1 . 1 1 49 49 SER CA C 49 58.406 58.406 58.678 -0.272 25085
276 1 1 . 1 1 49 49 SER CB C 49 64.758 64.758 64.503 0.255 25085
277 1 1 . 1 1 49 49 SER H H 49 8.657 8.657 7.854 0.803 25085
278 1 1 . 1 1 50 50 GLY N N 50 110.839 110.839 109.789 1.050 25085
279 1 1 . 1 1 50 50 GLY C C 50 172.398 172.398 173.617 -1.219 25085
280 1 1 . 1 1 50 50 GLY CA C 50 44.444 44.444 45.300 -0.856 25085
281 1 1 . 1 1 50 50 GLY H H 50 7.846 7.846 7.445 0.401 25085
282 1 1 . 1 1 51 51 LEU N N 51 121.009 121.009 124.674 -3.665 25085
283 1 1 . 1 1 51 51 LEU HA H 51 4.244 4.244 4.724 -0.480 25085
284 1 1 . 1 1 51 51 LEU CA C 51 52.593 52.593 51.192 1.401 25085
285 1 1 . 1 1 51 51 LEU CB C 51 43.381 43.381 43.351 0.030 25085
286 1 1 . 1 1 51 51 LEU H H 51 8.647 8.647 7.889 0.758 25085
287 1 1 . 1 1 52 52 PRO HA H 52 4.349 4.349 4.384 -0.035 25085
288 1 1 . 1 1 52 52 PRO C C 52 177.247 177.247 177.426 -0.179 25085
289 1 1 . 1 1 52 52 PRO CA C 52 62.980 62.980 63.283 -0.303 25085
290 1 1 . 1 1 52 52 PRO CB C 52 32.423 32.423 29.949 2.474 25085
291 1 1 . 1 1 53 53 ALA N N 53 126.595 126.595 125.289 1.306 25085
292 1 1 . 1 1 53 53 ALA HA H 53 3.870 3.870 3.975 -0.105 25085
293 1 1 . 1 1 53 53 ALA C C 53 180.484 180.484 179.217 1.267 25085
294 1 1 . 1 1 53 53 ALA CA C 53 55.829 55.829 54.990 0.839 25085
295 1 1 . 1 1 53 53 ALA CB C 53 18.248 18.248 18.608 -0.360 25085
296 1 1 . 1 1 53 53 ALA H H 53 8.643 8.643 9.035 -0.392 25085
297 1 1 . 1 1 54 54 LYS N N 54 113.898 113.898 118.928 -5.030 25085
298 1 1 . 1 1 54 54 LYS HA H 54 4.167 4.167 4.165 0.002 25085
299 1 1 . 1 1 54 54 LYS C C 54 176.704 176.704 178.720 -2.016 25085
300 1 1 . 1 1 54 54 LYS CA C 54 57.893 57.893 58.624 -0.731 25085
301 1 1 . 1 1 54 54 LYS CB C 54 31.892 31.892 32.284 -0.392 25085
302 1 1 . 1 1 54 54 LYS H H 54 8.442 8.442 8.025 0.417 25085
303 1 1 . 1 1 55 55 LEU N N 55 117.932 117.932 119.246 -1.314 25085
304 1 1 . 1 1 55 55 LEU HA H 55 4.308 4.308 4.299 0.009 25085
305 1 1 . 1 1 55 55 LEU C C 55 174.589 174.589 177.961 -3.372 25085
306 1 1 . 1 1 55 55 LEU CA C 55 54.003 54.003 56.712 -2.708 25085
307 1 1 . 1 1 55 55 LEU CB C 55 41.649 41.649 42.365 -0.716 25085
308 1 1 . 1 1 55 55 LEU H H 55 7.805 7.805 8.433 -0.628 25085
309 1 1 . 1 1 56 56 ARG N N 56 116.873 116.873 118.064 -1.191 25085
310 1 1 . 1 1 56 56 ARG HA H 56 4.006 4.006 4.411 -0.405 25085
311 1 1 . 1 1 56 56 ARG C C 56 175.542 175.542 175.558 -0.016 25085
312 1 1 . 1 1 56 56 ARG CA C 56 57.428 57.428 56.036 1.392 25085
313 1 1 . 1 1 56 56 ARG CB C 56 29.651 29.651 30.699 -1.048 25085
314 1 1 . 1 1 56 56 ARG H H 56 6.971 6.971 7.598 -0.627 25085
315 1 1 . 1 1 57 57 HIS N N 57 122.622 122.622 116.636 5.986 25085
316 1 1 . 1 1 57 57 HIS HA H 57 4.596 4.596 4.511 0.085 25085
317 1 1 . 1 1 57 57 HIS C C 57 173.855 173.855 173.180 0.675 25085
318 1 1 . 1 1 57 57 HIS CA C 57 55.780 55.780 56.131 -0.351 25085
319 1 1 . 1 1 57 57 HIS CB C 57 33.878 33.878 30.688 3.190 25085
320 1 1 . 1 1 57 57 HIS H H 57 7.281 7.281 7.510 -0.229 25085
321 1 1 . 1 1 58 58 GLU N N 58 120.479 120.479 118.270 2.209 25085
322 1 1 . 1 1 58 58 GLU HA H 58 4.052 4.052 4.389 -0.337 25085
323 1 1 . 1 1 58 58 GLU C C 58 176.762 176.762 175.359 1.403 25085
324 1 1 . 1 1 58 58 GLU CA C 58 59.634 59.634 56.645 2.989 25085
325 1 1 . 1 1 58 58 GLU CB C 58 29.931 29.931 31.434 -1.503 25085
326 1 1 . 1 1 58 58 GLU H H 58 7.626 7.626 8.337 -0.711 25085
327 1 1 . 1 1 59 59 GLN N N 59 118.110 118.110 117.993 0.117 25085
328 1 1 . 1 1 59 59 GLN HA H 59 5.479 5.479 5.274 0.205 25085
329 1 1 . 1 1 59 59 GLN C C 59 174.322 174.322 174.910 -0.588 25085
330 1 1 . 1 1 59 59 GLN CA C 59 55.486 55.486 54.952 0.534 25085
331 1 1 . 1 1 59 59 GLN CB C 59 33.151 33.151 31.413 1.738 25085
332 1 1 . 1 1 59 59 GLN H H 59 8.560 8.560 8.125 0.435 25085
333 1 1 . 1 1 60 60 ILE N N 60 122.789 122.789 122.140 0.649 25085
334 1 1 . 1 1 60 60 ILE HA H 60 4.531 4.531 4.787 -0.256 25085
335 1 1 . 1 1 60 60 ILE C C 60 173.352 173.352 174.530 -1.178 25085
336 1 1 . 1 1 60 60 ILE CA C 60 59.794 59.794 59.964 -0.170 25085
337 1 1 . 1 1 60 60 ILE CB C 60 43.188 43.188 41.509 1.679 25085
338 1 1 . 1 1 60 60 ILE H H 60 8.735 8.735 7.912 0.823 25085
339 1 1 . 1 1 61 61 ILE N N 61 125.871 125.871 121.001 4.870 25085
340 1 1 . 1 1 61 61 ILE HA H 61 5.002 5.002 4.584 0.418 25085
341 1 1 . 1 1 61 61 ILE C C 61 175.195 175.195 174.281 0.914 25085
342 1 1 . 1 1 61 61 ILE CA C 61 58.419 58.419 59.879 -1.460 25085
343 1 1 . 1 1 61 61 ILE CB C 61 40.270 40.270 41.746 -1.476 25085
344 1 1 . 1 1 61 61 ILE H H 61 9.057 9.057 8.654 0.403 25085
345 1 1 . 1 1 62 62 PHE N N 62 123.742 123.742 122.898 0.844 25085
346 1 1 . 1 1 62 62 PHE HA H 62 5.810 5.810 5.664 0.146 25085
347 1 1 . 1 1 62 62 PHE C C 62 176.135 176.135 174.859 1.276 25085
348 1 1 . 1 1 62 62 PHE CA C 62 56.960 56.960 56.201 0.759 25085
349 1 1 . 1 1 62 62 PHE CB C 62 43.352 43.352 42.735 0.617 25085
350 1 1 . 1 1 62 62 PHE H H 62 8.977 8.977 8.844 0.133 25085
351 1 1 . 1 1 63 63 HIS N N 63 116.939 116.939 116.722 0.217 25085
352 1 1 . 1 1 63 63 HIS HA H 63 5.979 5.979 5.145 0.834 25085
353 1 1 . 1 1 63 63 HIS C C 63 171.108 171.108 173.292 -2.184 25085
354 1 1 . 1 1 63 63 HIS CA C 63 54.115 54.115 54.179 -0.064 25085
355 1 1 . 1 1 63 63 HIS CB C 63 36.861 36.861 32.550 4.311 25085
356 1 1 . 1 1 63 63 HIS H H 63 9.298 9.298 8.327 0.971 25085
357 1 1 . 1 1 64 64 CYS N N 64 119.251 119.251 120.922 -1.671 25085
358 1 1 . 1 1 64 64 CYS HA H 64 5.044 5.044 5.004 0.040 25085
359 1 1 . 1 1 64 64 CYS C C 64 177.438 177.438 175.574 1.864 25085
360 1 1 . 1 1 64 64 CYS CA C 64 56.886 56.886 56.161 0.725 25085
361 1 1 . 1 1 64 64 CYS CB C 64 29.425 29.425 31.238 -1.813 25085
362 1 1 . 1 1 64 64 CYS H H 64 8.156 8.156 8.980 -0.824 25085
363 1 1 . 1 1 65 65 GLN N N 65 125.627 125.627 125.789 -0.162 25085
364 1 1 . 1 1 65 65 GLN HA H 65 4.220 4.220 4.004 0.216 25085
365 1 1 . 1 1 65 65 GLN C C 65 174.440 174.440 174.941 -0.501 25085
366 1 1 . 1 1 65 65 GLN CA C 65 59.788 59.788 59.559 0.229 25085
367 1 1 . 1 1 65 65 GLN CB C 65 29.370 29.370 28.937 0.433 25085
368 1 1 . 1 1 65 65 GLN H H 65 8.937 8.937 9.154 -0.217 25085
369 1 1 . 1 1 66 66 ALA N N 66 118.880 118.880 117.903 0.977 25085
370 1 1 . 1 1 66 66 ALA HA H 66 5.115 5.115 4.876 0.239 25085
371 1 1 . 1 1 66 66 ALA C C 66 177.625 177.625 176.575 1.050 25085
372 1 1 . 1 1 66 66 ALA CA C 66 50.744 50.744 50.694 0.049 25085
373 1 1 . 1 1 66 66 ALA CB C 66 20.658 20.658 19.297 1.361 25085
374 1 1 . 1 1 66 66 ALA H H 66 9.024 9.024 7.353 1.671 25085
375 1 1 . 1 1 67 67 GLY N N 67 112.878 112.878 109.386 3.492 25085
376 1 1 . 1 1 67 67 GLY C C 67 174.810 174.810 173.949 0.861 25085
377 1 1 . 1 1 67 67 GLY CA C 67 45.642 45.642 46.499 -0.857 25085
378 1 1 . 1 1 67 67 GLY H H 67 8.845 8.845 8.120 0.725 25085
379 1 1 . 1 1 68 68 LYS N N 68 120.133 120.133 117.559 2.574 25085
380 1 1 . 1 1 68 68 LYS HA H 68 4.158 4.158 4.382 -0.224 25085
381 1 1 . 1 1 68 68 LYS C C 68 177.939 177.939 177.812 0.127 25085
382 1 1 . 1 1 68 68 LYS CA C 68 58.811 58.811 57.191 1.619 25085
383 1 1 . 1 1 68 68 LYS CB C 68 32.796 32.796 33.607 -0.811 25085
384 1 1 . 1 1 68 68 LYS H H 68 7.936 7.936 7.519 0.417 25085
385 1 1 . 1 1 69 69 ARG N N 69 125.804 125.804 119.092 6.712 25085
386 1 1 . 1 1 69 69 ARG HA H 69 4.217 4.217 4.380 -0.163 25085
387 1 1 . 1 1 69 69 ARG C C 69 180.944 180.944 178.007 2.937 25085
388 1 1 . 1 1 69 69 ARG CA C 69 60.010 60.010 58.654 1.356 25085
389 1 1 . 1 1 69 69 ARG CB C 69 30.974 30.974 29.906 1.068 25085
390 1 1 . 1 1 69 69 ARG H H 69 8.981 8.981 7.850 1.131 25085
391 1 1 . 1 1 70 70 THR N N 70 116.681 116.681 116.219 0.462 25085
392 1 1 . 1 1 70 70 THR HA H 70 3.607 3.607 4.017 -0.410 25085
393 1 1 . 1 1 70 70 THR C C 70 176.434 176.434 176.525 -0.091 25085
394 1 1 . 1 1 70 70 THR CA C 70 65.914 65.914 66.337 -0.423 25085
395 1 1 . 1 1 70 70 THR CB C 70 68.169 68.169 68.308 -0.139 25085
396 1 1 . 1 1 70 70 THR H H 70 10.382 10.382 8.308 2.074 25085
397 1 1 . 1 1 71 71 SER N N 71 113.046 113.046 114.721 -1.675 25085
398 1 1 . 1 1 71 71 SER HA H 71 3.993 3.993 4.213 -0.220 25085
399 1 1 . 1 1 71 71 SER C C 71 177.594 177.594 175.836 1.758 25085
400 1 1 . 1 1 71 71 SER CA C 71 62.500 62.500 61.088 1.412 25085
401 1 1 . 1 1 71 71 SER H H 71 7.346 7.346 8.409 -1.063 25085
402 1 1 . 1 1 72 72 ASN N N 72 117.540 117.540 118.091 -0.551 25085
403 1 1 . 1 1 72 72 ASN HA H 72 4.598 4.598 4.607 -0.009 25085
404 1 1 . 1 1 72 72 ASN C C 72 175.595 175.595 176.720 -1.125 25085
405 1 1 . 1 1 72 72 ASN CA C 72 55.147 55.147 55.475 -0.328 25085
406 1 1 . 1 1 72 72 ASN CB C 72 38.821 38.821 38.901 -0.080 25085
407 1 1 . 1 1 72 72 ASN H H 72 8.078 8.078 7.364 0.714 25085
408 1 1 . 1 1 73 73 ASN N N 73 114.869 114.869 118.164 -3.295 25085
409 1 1 . 1 1 73 73 ASN HA H 73 5.159 5.159 4.685 0.474 25085
410 1 1 . 1 1 73 73 ASN C C 73 174.375 174.375 176.861 -2.486 25085
411 1 1 . 1 1 73 73 ASN CA C 73 52.976 52.976 54.077 -1.101 25085
412 1 1 . 1 1 73 73 ASN CB C 73 39.862 39.862 39.287 0.575 25085
413 1 1 . 1 1 73 73 ASN H H 73 7.290 7.290 8.296 -1.006 25085
414 1 1 . 1 1 74 74 ALA N N 74 124.647 124.647 122.320 2.327 25085
415 1 1 . 1 1 74 74 ALA HA H 74 3.721 3.721 3.725 -0.004 25085
416 1 1 . 1 1 74 74 ALA C C 74 177.908 177.908 178.657 -0.749 25085
417 1 1 . 1 1 74 74 ALA CA C 74 57.085 57.085 55.735 1.350 25085
418 1 1 . 1 1 74 74 ALA CB C 74 19.427 19.427 18.379 1.048 25085
419 1 1 . 1 1 74 74 ALA H H 74 7.105 7.105 8.663 -1.558 25085
420 1 1 . 1 1 75 75 ASP N N 75 114.917 114.917 115.883 -0.966 25085
421 1 1 . 1 1 75 75 ASP HA H 75 4.250 4.250 4.514 -0.264 25085
422 1 1 . 1 1 75 75 ASP C C 75 179.100 179.100 178.328 0.772 25085
423 1 1 . 1 1 75 75 ASP CA C 75 57.236 57.236 56.992 0.244 25085
424 1 1 . 1 1 75 75 ASP CB C 75 39.783 39.783 40.576 -0.793 25085
425 1 1 . 1 1 75 75 ASP H H 75 8.403 8.403 8.323 0.080 25085
426 1 1 . 1 1 76 76 LYS N N 76 121.888 121.888 119.969 1.919 25085
427 1 1 . 1 1 76 76 LYS HA H 76 4.053 4.053 4.172 -0.119 25085
428 1 1 . 1 1 76 76 LYS C C 76 178.832 178.832 178.741 0.091 25085
429 1 1 . 1 1 76 76 LYS CA C 76 58.864 58.864 57.883 0.981 25085
430 1 1 . 1 1 76 76 LYS CB C 76 32.423 32.423 32.438 -0.015 25085
431 1 1 . 1 1 76 76 LYS H H 76 7.652 7.652 7.951 -0.299 25085
432 1 1 . 1 1 77 77 LEU N N 77 118.644 118.644 120.766 -2.122 25085
433 1 1 . 1 1 77 77 LEU HA H 77 3.557 3.557 3.911 -0.354 25085
434 1 1 . 1 1 77 77 LEU C C 77 178.068 178.068 178.189 -0.121 25085
435 1 1 . 1 1 77 77 LEU CA C 77 57.692 57.692 57.630 0.062 25085
436 1 1 . 1 1 77 77 LEU CB C 77 40.077 40.077 41.331 -1.254 25085
437 1 1 . 1 1 77 77 LEU H H 77 8.146 8.146 8.375 -0.229 25085
438 1 1 . 1 1 78 78 ALA N N 78 119.668 119.668 120.244 -0.576 25085
439 1 1 . 1 1 78 78 ALA HA H 78 3.990 3.990 3.843 0.147 25085
440 1 1 . 1 1 78 78 ALA C C 78 179.542 179.542 177.958 1.584 25085
441 1 1 . 1 1 78 78 ALA CA C 78 54.937 54.937 54.794 0.143 25085
442 1 1 . 1 1 78 78 ALA CB C 78 18.080 18.080 18.356 -0.276 25085
443 1 1 . 1 1 78 78 ALA H H 78 8.136 8.136 7.564 0.572 25085
444 1 1 . 1 1 79 79 ALA N N 79 118.918 118.918 118.826 0.092 25085
445 1 1 . 1 1 79 79 ALA HA H 79 4.139 4.139 4.148 -0.009 25085
446 1 1 . 1 1 79 79 ALA C C 79 180.800 180.800 179.985 0.815 25085
447 1 1 . 1 1 79 79 ALA CA C 79 54.571 54.571 54.112 0.459 25085
448 1 1 . 1 1 79 79 ALA CB C 79 18.268 18.268 18.983 -0.716 25085
449 1 1 . 1 1 79 79 ALA H H 79 7.319 7.319 7.440 -0.121 25085
450 1 1 . 1 1 80 80 ILE N N 80 118.438 118.438 118.328 0.110 25085
451 1 1 . 1 1 80 80 ILE HA H 80 3.801 3.801 3.864 -0.063 25085
452 1 1 . 1 1 80 80 ILE C C 80 177.302 177.302 176.752 0.550 25085
453 1 1 . 1 1 80 80 ILE CA C 80 64.252 64.252 63.531 0.721 25085
454 1 1 . 1 1 80 80 ILE CB C 80 39.115 39.115 38.027 1.088 25085
455 1 1 . 1 1 80 80 ILE H H 80 8.227 8.227 7.373 0.854 25085
456 1 1 . 1 1 81 81 ALA N N 81 117.917 117.917 118.954 -1.037 25085
457 1 1 . 1 1 81 81 ALA HA H 81 4.466 4.466 4.497 -0.031 25085
458 1 1 . 1 1 81 81 ALA C C 81 176.153 176.153 176.419 -0.266 25085
459 1 1 . 1 1 81 81 ALA CA C 81 51.404 51.404 51.023 0.381 25085
460 1 1 . 1 1 81 81 ALA CB C 81 20.200 20.200 19.190 1.010 25085
461 1 1 . 1 1 81 81 ALA H H 81 7.913 7.913 8.331 -0.418 25085
462 1 1 . 1 1 82 82 ALA N N 82 124.086 124.086 121.915 2.171 25085
463 1 1 . 1 1 82 82 ALA HA H 82 4.457 4.457 4.039 0.418 25085
464 1 1 . 1 1 82 82 ALA CA C 82 52.276 52.276 52.760 -0.484 25085
465 1 1 . 1 1 82 82 ALA CB C 82 17.243 17.243 16.445 0.798 25085
466 1 1 . 1 1 82 82 ALA H H 82 7.223 7.223 7.238 -0.015 25085
467 1 1 . 1 1 83 83 PRO HA H 83 4.692 4.692 4.282 0.410 25085
468 1 1 . 1 1 83 83 PRO C C 83 175.169 175.169 176.394 -1.225 25085
469 1 1 . 1 1 83 83 PRO CA C 83 63.767 63.767 63.395 0.372 25085
470 1 1 . 1 1 83 83 PRO CB C 83 32.624 32.624 31.227 1.397 25085
471 1 1 . 1 1 84 84 ALA N N 84 127.741 127.741 122.613 5.128 25085
472 1 1 . 1 1 84 84 ALA HA H 84 4.138 4.138 4.192 -0.054 25085
473 1 1 . 1 1 84 84 ALA C C 84 176.494 176.494 177.364 -0.870 25085
474 1 1 . 1 1 84 84 ALA CA C 84 53.432 53.432 52.529 0.903 25085
475 1 1 . 1 1 84 84 ALA CB C 84 19.719 19.719 19.457 0.262 25085
476 1 1 . 1 1 84 84 ALA H H 84 8.528 8.528 7.326 1.202 25085
477 1 1 . 1 1 85 85 GLU N N 85 121.634 121.634 119.403 2.231 25085
478 1 1 . 1 1 85 85 GLU HA H 85 4.228 4.228 4.492 -0.264 25085
479 1 1 . 1 1 85 85 GLU C C 85 175.094 175.094 174.244 0.850 25085
480 1 1 . 1 1 85 85 GLU CA C 85 56.444 56.444 55.463 0.981 25085
481 1 1 . 1 1 85 85 GLU CB C 85 30.803 30.803 30.340 0.463 25085
482 1 1 . 1 1 85 85 GLU H H 85 8.166 8.166 8.250 -0.084 25085
483 1 1 . 1 1 86 86 ILE N N 86 122.543 122.543 122.755 -0.212 25085
484 1 1 . 1 1 86 86 ILE HA H 86 5.269 5.269 4.701 0.568 25085
485 1 1 . 1 1 86 86 ILE C C 86 174.463 174.463 174.820 -0.357 25085
486 1 1 . 1 1 86 86 ILE CA C 86 59.329 59.329 59.868 -0.539 25085
487 1 1 . 1 1 86 86 ILE CB C 86 40.546 40.546 40.721 -0.175 25085
488 1 1 . 1 1 86 86 ILE H H 86 7.925 7.925 8.217 -0.292 25085
489 1 1 . 1 1 87 87 PHE N N 87 122.457 122.457 122.391 0.066 25085
490 1 1 . 1 1 87 87 PHE HA H 87 5.428 5.428 5.678 -0.250 25085
491 1 1 . 1 1 87 87 PHE C C 87 174.450 174.450 175.264 -0.814 25085
492 1 1 . 1 1 87 87 PHE CA C 87 55.029 55.029 55.775 -0.746 25085
493 1 1 . 1 1 87 87 PHE CB C 87 43.626 43.626 42.829 0.797 25085
494 1 1 . 1 1 87 87 PHE H H 87 9.050 9.050 7.931 1.119 25085
495 1 1 . 1 1 88 88 LEU N N 88 119.959 119.959 119.671 0.288 25085
496 1 1 . 1 1 88 88 LEU HA H 88 5.358 5.358 4.834 0.524 25085
497 1 1 . 1 1 88 88 LEU C C 88 176.627 176.627 174.842 1.785 25085
498 1 1 . 1 1 88 88 LEU CA C 88 52.654 52.654 53.756 -1.102 25085
499 1 1 . 1 1 88 88 LEU CB C 88 43.094 43.094 46.981 -3.887 25085
500 1 1 . 1 1 88 88 LEU H H 88 8.824 8.824 8.620 0.204 25085
501 1 1 . 1 1 89 89 LEU N N 89 124.096 124.096 126.664 -2.568 25085
502 1 1 . 1 1 89 89 LEU HA H 89 4.432 4.432 4.599 -0.167 25085
503 1 1 . 1 1 89 89 LEU C C 89 176.693 176.693 175.959 0.734 25085
504 1 1 . 1 1 89 89 LEU CA C 89 55.385 55.385 53.387 1.998 25085
505 1 1 . 1 1 89 89 LEU CB C 89 43.537 43.537 41.335 2.202 25085
506 1 1 . 1 1 89 89 LEU H H 89 8.293 8.293 8.435 -0.142 25085
507 1 1 . 1 1 90 90 GLU N N 90 102.942 102.942 127.658 -24.716 25085
508 1 1 . 1 1 90 90 GLU HA H 90 3.895 3.895 4.060 -0.165 25085
509 1 1 . 1 1 90 90 GLU C C 90 175.199 175.199 176.843 -1.644 25085
510 1 1 . 1 1 90 90 GLU CA C 90 58.586 58.586 58.234 0.352 25085
511 1 1 . 1 1 90 90 GLU CB C 90 30.831 30.831 30.430 0.401 25085
512 1 1 . 1 1 90 90 GLU H H 90 9.394 9.394 8.123 1.271 25085
513 1 1 . 1 1 91 91 ASP N N 91 120.515 120.515 123.301 -2.786 25085
514 1 1 . 1 1 91 91 ASP HA H 91 4.184 4.184 4.328 -0.144 25085
515 1 1 . 1 1 91 91 ASP C C 91 176.159 176.159 175.821 0.338 25085
516 1 1 . 1 1 91 91 ASP CA C 91 55.814 55.814 56.608 -0.794 25085
517 1 1 . 1 1 91 91 ASP CB C 91 39.033 39.033 40.767 -1.734 25085
518 1 1 . 1 1 91 91 ASP H H 91 9.210 9.210 8.913 0.297 25085
519 1 1 . 1 1 92 92 GLY N N 92 104.313 104.313 105.945 -1.632 25085
520 1 1 . 1 1 92 92 GLY C C 92 172.980 172.980 174.119 -1.139 25085
521 1 1 . 1 1 92 92 GLY CA C 92 46.946 46.946 44.688 2.258 25085
522 1 1 . 1 1 92 92 GLY H H 92 7.902 7.902 7.730 0.172 25085
523 1 1 . 1 1 93 93 ILE N N 93 121.445 121.445 123.351 -1.906 25085
524 1 1 . 1 1 93 93 ILE HA H 93 3.902 3.902 4.138 -0.236 25085
525 1 1 . 1 1 93 93 ILE C C 93 176.528 176.528 176.327 0.201 25085
526 1 1 . 1 1 93 93 ILE CA C 93 63.908 63.908 63.065 0.843 25085
527 1 1 . 1 1 93 93 ILE CB C 93 38.416 38.416 38.288 0.128 25085
528 1 1 . 1 1 93 93 ILE H H 93 8.129 8.129 8.181 -0.052 25085
529 1 1 . 1 1 94 94 ASP N N 94 126.304 126.304 119.969 6.335 25085
530 1 1 . 1 1 94 94 ASP HA H 94 4.436 4.436 4.340 0.096 25085
531 1 1 . 1 1 94 94 ASP C C 94 180.174 180.174 178.162 2.012 25085
532 1 1 . 1 1 94 94 ASP CA C 94 58.351 58.351 57.335 1.016 25085
533 1 1 . 1 1 94 94 ASP CB C 94 39.223 39.223 40.495 -1.272 25085
534 1 1 . 1 1 94 94 ASP H H 94 9.161 9.161 8.357 0.805 25085
535 1 1 . 1 1 95 95 GLY N N 95 110.690 110.690 107.330 3.360 25085
536 1 1 . 1 1 95 95 GLY C C 95 176.108 176.108 175.695 0.413 25085
537 1 1 . 1 1 95 95 GLY CA C 95 46.873 46.873 46.459 0.414 25085
538 1 1 . 1 1 95 95 GLY H H 95 8.080 8.080 7.534 0.546 25085
539 1 1 . 1 1 96 96 TRP N N 96 126.965 126.965 123.464 3.501 25085
540 1 1 . 1 1 96 96 TRP HA H 96 3.795 3.795 4.220 -0.425 25085
541 1 1 . 1 1 96 96 TRP C C 96 177.058 177.058 177.519 -0.461 25085
542 1 1 . 1 1 96 96 TRP CA C 96 61.633 61.633 61.895 -0.262 25085
543 1 1 . 1 1 96 96 TRP CB C 96 29.512 29.512 29.279 0.233 25085
544 1 1 . 1 1 96 96 TRP H H 96 8.007 8.007 7.789 0.218 25085
545 1 1 . 1 1 97 97 LYS N N 97 116.604 116.604 119.154 -2.550 25085
546 1 1 . 1 1 97 97 LYS HA H 97 4.090 4.090 4.240 -0.150 25085
547 1 1 . 1 1 97 97 LYS C C 97 182.010 182.010 179.449 2.561 25085
548 1 1 . 1 1 97 97 LYS CA C 97 59.776 59.776 58.974 0.803 25085
549 1 1 . 1 1 97 97 LYS CB C 97 32.208 32.208 32.478 -0.270 25085
550 1 1 . 1 1 97 97 LYS H H 97 8.696 8.696 8.092 0.604 25085
551 1 1 . 1 1 98 98 ARG N N 98 122.491 122.491 120.796 1.695 25085
552 1 1 . 1 1 98 98 ARG HA H 98 4.050 4.050 4.113 -0.063 25085
553 1 1 . 1 1 98 98 ARG C C 98 177.666 177.666 178.086 -0.420 25085
554 1 1 . 1 1 98 98 ARG CA C 98 59.509 59.509 58.395 1.114 25085
555 1 1 . 1 1 98 98 ARG CB C 98 30.471 30.471 30.162 0.309 25085
556 1 1 . 1 1 98 98 ARG H H 98 8.280 8.280 7.660 0.620 25085
557 1 1 . 1 1 99 99 ALA N N 99 119.546 119.546 119.174 0.372 25085
558 1 1 . 1 1 99 99 ALA HA H 99 4.276 4.276 4.172 0.104 25085
559 1 1 . 1 1 99 99 ALA C C 99 176.800 176.800 177.730 -0.930 25085
560 1 1 . 1 1 99 99 ALA CA C 99 52.254 52.254 53.033 -0.779 25085
561 1 1 . 1 1 99 99 ALA CB C 99 18.270 18.270 18.968 -0.698 25085
562 1 1 . 1 1 99 99 ALA H H 99 7.519 7.519 8.392 -0.873 25085
563 1 1 . 1 1 100 100 GLY N N 100 106.339 106.339 104.321 2.018 25085
564 1 1 . 1 1 100 100 GLY C C 100 174.232 174.232 173.720 0.512 25085
565 1 1 . 1 1 100 100 GLY CA C 100 45.050 45.050 44.725 0.325 25085
566 1 1 . 1 1 100 100 GLY H H 100 7.926 7.926 7.572 0.354 25085
567 1 1 . 1 1 101 101 LEU N N 101 122.181 122.181 121.036 1.145 25085
568 1 1 . 1 1 101 101 LEU HA H 101 4.286 4.286 4.536 -0.250 25085
569 1 1 . 1 1 101 101 LEU CA C 101 53.183 53.183 50.893 2.290 25085
570 1 1 . 1 1 101 101 LEU CB C 101 37.320 37.320 42.301 -4.981 25085
571 1 1 . 1 1 101 101 LEU H H 101 6.976 6.976 7.279 -0.303 25085
572 1 1 . 1 1 102 102 PRO HA H 102 4.476 4.476 4.512 -0.036 25085
573 1 1 . 1 1 102 102 PRO C C 102 177.424 177.424 176.315 1.109 25085
574 1 1 . 1 1 102 102 PRO CA C 102 64.014 64.014 62.591 1.423 25085
575 1 1 . 1 1 102 102 PRO CB C 102 33.200 33.200 32.122 1.078 25085
576 1 1 . 1 1 103 103 VAL N N 103 110.512 110.512 114.894 -4.382 25085
577 1 1 . 1 1 103 103 VAL HA H 103 4.643 4.643 4.871 -0.228 25085
578 1 1 . 1 1 103 103 VAL C C 103 174.297 174.297 174.904 -0.607 25085
579 1 1 . 1 1 103 103 VAL CA C 103 59.693 59.693 59.669 0.024 25085
580 1 1 . 1 1 103 103 VAL CB C 103 35.980 35.980 34.235 1.745 25085
581 1 1 . 1 1 103 103 VAL H H 103 8.073 8.073 7.843 0.230 25085
582 1 1 . 1 1 104 104 ALA N N 104 125.898 125.898 124.027 1.871 25085
583 1 1 . 1 1 104 104 ALA HA H 104 4.550 4.550 4.828 -0.278 25085
584 1 1 . 1 1 104 104 ALA C C 104 176.190 176.190 175.667 0.523 25085
585 1 1 . 1 1 104 104 ALA CA C 104 50.699 50.699 51.234 -0.535 25085
586 1 1 . 1 1 104 104 ALA CB C 104 19.534 19.534 20.649 -1.115 25085
587 1 1 . 1 1 104 104 ALA H H 104 8.996 8.996 8.023 0.973 25085
588 1 1 . 1 1 105 105 VAL N N 105 119.534 119.534 124.322 -4.788 25085
589 1 1 . 1 1 105 105 VAL HA H 105 4.615 4.615 4.349 0.266 25085
590 1 1 . 1 1 105 105 VAL C C 105 175.576 175.576 175.767 -0.191 25085
591 1 1 . 1 1 105 105 VAL CA C 105 60.234 60.234 61.057 -0.823 25085
592 1 1 . 1 1 105 105 VAL CB C 105 34.683 34.683 33.504 1.179 25085
593 1 1 . 1 1 105 105 VAL H H 105 8.276 8.276 8.387 -0.111 25085
594 1 1 . 1 1 106 106 ASN N N 106 123.346 123.346 125.972 -2.626 25085
595 1 1 . 1 1 106 106 ASN HA H 106 4.748 4.748 4.613 0.135 25085
596 1 1 . 1 1 106 106 ASN C C 106 173.877 173.877 175.217 -1.340 25085
597 1 1 . 1 1 106 106 ASN CA C 106 53.465 53.465 53.577 -0.112 25085
598 1 1 . 1 1 106 106 ASN CB C 106 39.424 39.424 38.677 0.747 25085
599 1 1 . 1 1 106 106 ASN H H 106 8.190 8.190 8.446 -0.256 25085
600 1 2 . 1 1 2 2 ALA N N 2 125.104 125.104 126.694 -1.590 25085
601 1 2 . 1 1 2 2 ALA HA H 2 4.287 4.287 4.518 -0.231 25085
602 1 2 . 1 1 2 2 ALA C C 2 176.800 176.800 177.179 -0.379 25085
603 1 2 . 1 1 2 2 ALA CA C 2 52.429 52.429 52.048 0.381 25085
604 1 2 . 1 1 2 2 ALA CB C 2 19.407 19.407 19.245 0.161 25085
605 1 2 . 1 1 2 2 ALA H H 2 8.344 8.344 8.616 -0.272 25085
606 1 2 . 1 1 3 3 LEU N N 3 120.515 120.515 117.586 2.929 25085
607 1 2 . 1 1 3 3 LEU HA H 3 4.452 4.452 4.316 0.136 25085
608 1 2 . 1 1 3 3 LEU C C 3 176.497 176.497 176.255 0.242 25085
609 1 2 . 1 1 3 3 LEU CA C 3 54.698 54.698 55.569 -0.871 25085
610 1 2 . 1 1 3 3 LEU CB C 3 43.203 43.203 41.368 1.835 25085
611 1 2 . 1 1 3 3 LEU H H 3 8.070 8.070 7.582 0.488 25085
612 1 2 . 1 1 4 4 THR N N 4 117.803 117.803 119.924 -2.121 25085
613 1 2 . 1 1 4 4 THR HA H 4 4.480 4.480 4.818 -0.338 25085
614 1 2 . 1 1 4 4 THR C C 4 173.872 173.872 173.445 0.427 25085
615 1 2 . 1 1 4 4 THR CA C 4 62.247 62.247 61.095 1.152 25085
616 1 2 . 1 1 4 4 THR CB C 4 70.533 70.533 71.398 -0.865 25085
617 1 2 . 1 1 4 4 THR H H 4 7.954 7.954 8.693 -0.739 25085
618 1 2 . 1 1 5 5 THR N N 5 121.501 121.501 114.814 6.687 25085
619 1 2 . 1 1 5 5 THR HA H 5 5.289 5.289 4.463 0.826 25085
620 1 2 . 1 1 5 5 THR C C 5 174.162 174.162 173.791 0.371 25085
621 1 2 . 1 1 5 5 THR CA C 5 62.102 62.102 61.847 0.255 25085
622 1 2 . 1 1 5 5 THR CB C 5 69.457 69.457 69.719 -0.262 25085
623 1 2 . 1 1 5 5 THR H H 5 8.640 8.640 8.500 0.140 25085
624 1 2 . 1 1 6 6 ILE N N 6 122.023 122.023 123.118 -1.095 25085
625 1 2 . 1 1 6 6 ILE HA H 6 4.988 4.988 4.471 0.517 25085
626 1 2 . 1 1 6 6 ILE C C 6 173.377 173.377 173.798 -0.421 25085
627 1 2 . 1 1 6 6 ILE CA C 6 58.611 58.611 59.518 -0.907 25085
628 1 2 . 1 1 6 6 ILE CB C 6 42.821 42.821 42.510 0.311 25085
629 1 2 . 1 1 6 6 ILE H H 6 8.977 8.977 9.061 -0.084 25085
630 1 2 . 1 1 7 7 SER N N 7 122.659 122.659 118.287 4.372 25085
631 1 2 . 1 1 7 7 SER HA H 7 4.768 4.768 5.058 -0.290 25085
632 1 2 . 1 1 7 7 SER CA C 7 56.790 56.790 55.154 1.636 25085
633 1 2 . 1 1 7 7 SER CB C 7 63.235 63.235 63.921 -0.686 25085
634 1 2 . 1 1 7 7 SER H H 7 9.242 9.242 8.458 0.784 25085
635 1 2 . 1 1 8 8 PRO HA H 8 4.207 4.207 4.363 -0.156 25085
636 1 2 . 1 1 8 8 PRO C C 8 176.787 176.787 178.399 -1.612 25085
637 1 2 . 1 1 8 8 PRO CA C 8 66.443 66.443 65.495 0.948 25085
638 1 2 . 1 1 8 8 PRO CB C 8 32.724 32.724 31.692 1.032 25085
639 1 2 . 1 1 9 9 HIS N N 9 113.700 113.700 116.435 -2.735 25085
640 1 2 . 1 1 9 9 HIS HA H 9 3.990 3.990 4.355 -0.365 25085
641 1 2 . 1 1 9 9 HIS C C 9 178.123 178.123 177.564 0.559 25085
642 1 2 . 1 1 9 9 HIS CA C 9 60.827 60.827 58.195 2.632 25085
643 1 2 . 1 1 9 9 HIS CB C 9 29.552 29.552 29.815 -0.263 25085
644 1 2 . 1 1 9 9 HIS H H 9 8.172 8.172 7.529 0.643 25085
645 1 2 . 1 1 10 10 ASP N N 10 120.665 120.665 119.979 0.686 25085
646 1 2 . 1 1 10 10 ASP HA H 10 4.369 4.369 4.486 -0.117 25085
647 1 2 . 1 1 10 10 ASP C C 10 179.100 179.100 177.943 1.157 25085
648 1 2 . 1 1 10 10 ASP CA C 10 57.071 57.071 57.014 0.057 25085
649 1 2 . 1 1 10 10 ASP CB C 10 39.529 39.529 41.167 -1.638 25085
650 1 2 . 1 1 10 10 ASP H H 10 7.706 7.706 8.695 -0.989 25085
651 1 2 . 1 1 11 11 ALA N N 11 123.686 123.686 122.653 1.033 25085
652 1 2 . 1 1 11 11 ALA HA H 11 3.782 3.782 3.800 -0.018 25085
653 1 2 . 1 1 11 11 ALA C C 11 178.260 178.260 179.082 -0.822 25085
654 1 2 . 1 1 11 11 ALA CA C 11 55.142 55.142 55.461 -0.319 25085
655 1 2 . 1 1 11 11 ALA CB C 11 18.293 18.293 18.061 0.232 25085
656 1 2 . 1 1 11 11 ALA H H 11 8.896 8.896 7.603 1.293 25085
657 1 2 . 1 1 12 12 GLN N N 12 117.521 117.521 118.151 -0.630 25085
658 1 2 . 1 1 12 12 GLN HA H 12 4.000 4.000 4.166 -0.166 25085
659 1 2 . 1 1 12 12 GLN C C 12 178.499 178.499 178.476 0.023 25085
660 1 2 . 1 1 12 12 GLN CA C 12 60.102 60.102 59.480 0.622 25085
661 1 2 . 1 1 12 12 GLN CB C 12 28.743 28.743 28.587 0.156 25085
662 1 2 . 1 1 12 12 GLN H H 12 8.431 8.431 8.064 0.367 25085
663 1 2 . 1 1 13 13 GLU N N 13 118.578 118.578 119.012 -0.434 25085
664 1 2 . 1 1 13 13 GLU HA H 13 4.059 4.059 4.054 0.005 25085
665 1 2 . 1 1 13 13 GLU C C 13 178.352 178.352 179.388 -1.036 25085
666 1 2 . 1 1 13 13 GLU CA C 13 59.079 59.079 59.068 0.011 25085
667 1 2 . 1 1 13 13 GLU CB C 13 29.213 29.213 29.437 -0.224 25085
668 1 2 . 1 1 13 13 GLU H H 13 7.234 7.234 7.814 -0.580 25085
669 1 2 . 1 1 14 14 LEU N N 14 119.848 119.848 119.993 -0.145 25085
670 1 2 . 1 1 14 14 LEU HA H 14 3.891 3.891 4.055 -0.164 25085
671 1 2 . 1 1 14 14 LEU C C 14 180.773 180.773 179.009 1.764 25085
672 1 2 . 1 1 14 14 LEU CA C 14 57.958 57.958 57.612 0.346 25085
673 1 2 . 1 1 14 14 LEU CB C 14 41.715 41.715 41.710 0.005 25085
674 1 2 . 1 1 14 14 LEU H H 14 7.582 7.582 7.655 -0.073 25085
675 1 2 . 1 1 15 15 ILE N N 15 122.392 122.392 117.094 5.298 25085
676 1 2 . 1 1 15 15 ILE HA H 15 3.924 3.924 3.678 0.246 25085
677 1 2 . 1 1 15 15 ILE C C 15 180.109 180.109 177.476 2.633 25085
678 1 2 . 1 1 15 15 ILE CA C 15 64.663 64.663 64.433 0.230 25085
679 1 2 . 1 1 15 15 ILE CB C 15 38.900 38.900 37.684 1.216 25085
680 1 2 . 1 1 15 15 ILE H H 15 8.772 8.772 8.711 0.061 25085
681 1 2 . 1 1 16 16 ALA N N 16 123.856 123.856 119.544 4.312 25085
682 1 2 . 1 1 16 16 ALA HA H 16 4.183 4.183 4.263 -0.080 25085
683 1 2 . 1 1 16 16 ALA C C 16 179.100 179.100 178.589 0.511 25085
684 1 2 . 1 1 16 16 ALA CA C 16 54.806 54.806 53.726 1.080 25085
685 1 2 . 1 1 16 16 ALA CB C 16 17.646 17.646 18.863 -1.217 25085
686 1 2 . 1 1 16 16 ALA H H 16 7.808 7.808 7.338 0.470 25085
687 1 2 . 1 1 17 17 ARG N N 17 115.329 115.329 118.737 -3.408 25085
688 1 2 . 1 1 17 17 ARG HA H 17 4.404 4.404 4.305 0.099 25085
689 1 2 . 1 1 17 17 ARG C C 17 176.446 176.446 177.359 -0.913 25085
690 1 2 . 1 1 17 17 ARG CA C 17 56.015 56.015 57.302 -1.287 25085
691 1 2 . 1 1 17 17 ARG CB C 17 30.676 30.676 31.514 -0.838 25085
692 1 2 . 1 1 17 17 ARG H H 17 7.280 7.280 8.329 -1.049 25085
693 1 2 . 1 1 18 18 GLY N N 18 107.395 107.395 104.182 3.213 25085
694 1 2 . 1 1 18 18 GLY C C 18 174.072 174.072 173.082 0.990 25085
695 1 2 . 1 1 18 18 GLY CA C 18 45.218 45.218 44.895 0.323 25085
696 1 2 . 1 1 18 18 GLY H H 18 7.795 7.795 8.320 -0.525 25085
697 1 2 . 1 1 19 19 ALA N N 19 123.197 123.197 124.096 -0.899 25085
698 1 2 . 1 1 19 19 ALA HA H 19 4.217 4.217 3.934 0.283 25085
699 1 2 . 1 1 19 19 ALA C C 19 176.261 176.261 177.168 -0.907 25085
700 1 2 . 1 1 19 19 ALA CA C 19 52.674 52.674 53.149 -0.475 25085
701 1 2 . 1 1 19 19 ALA CB C 19 19.411 19.411 19.076 0.335 25085
702 1 2 . 1 1 19 19 ALA H H 19 7.980 7.980 7.525 0.455 25085
703 1 2 . 1 1 20 20 LYS N N 20 118.629 118.629 123.470 -4.841 25085
704 1 2 . 1 1 20 20 LYS HA H 20 4.308 4.308 4.239 0.069 25085
705 1 2 . 1 1 20 20 LYS C C 20 173.981 173.981 175.097 -1.116 25085
706 1 2 . 1 1 20 20 LYS CA C 20 53.820 53.820 54.836 -1.016 25085
707 1 2 . 1 1 20 20 LYS CB C 20 33.571 33.571 32.101 1.470 25085
708 1 2 . 1 1 20 20 LYS H H 20 7.589 7.589 7.827 -0.238 25085
709 1 2 . 1 1 21 21 LEU N N 21 126.686 126.686 127.126 -0.440 25085
710 1 2 . 1 1 21 21 LEU HA H 21 5.154 5.154 4.604 0.550 25085
711 1 2 . 1 1 21 21 LEU C C 21 174.076 174.076 175.178 -1.102 25085
712 1 2 . 1 1 21 21 LEU CA C 21 53.262 53.262 53.975 -0.713 25085
713 1 2 . 1 1 21 21 LEU CB C 21 44.350 44.350 43.270 1.080 25085
714 1 2 . 1 1 21 21 LEU H H 21 8.812 8.812 8.398 0.414 25085
715 1 2 . 1 1 22 22 ILE N N 22 127.566 127.566 122.765 4.801 25085
716 1 2 . 1 1 22 22 ILE HA H 22 4.678 4.678 5.016 -0.338 25085
717 1 2 . 1 1 22 22 ILE C C 22 173.136 173.136 174.820 -1.684 25085
718 1 2 . 1 1 22 22 ILE CA C 22 60.160 60.160 59.098 1.062 25085
719 1 2 . 1 1 22 22 ILE CB C 22 39.842 39.842 41.481 -1.639 25085
720 1 2 . 1 1 22 22 ILE H H 22 9.416 9.416 8.722 0.694 25085
721 1 2 . 1 1 23 23 ASP N N 23 129.217 129.217 124.432 4.785 25085
722 1 2 . 1 1 23 23 ASP HA H 23 3.806 3.806 5.465 -1.659 25085
723 1 2 . 1 1 23 23 ASP C C 23 176.042 176.042 175.376 0.666 25085
724 1 2 . 1 1 23 23 ASP CA C 23 52.005 52.005 53.019 -1.014 25085
725 1 2 . 1 1 23 23 ASP CB C 23 42.984 42.984 43.549 -0.565 25085
726 1 2 . 1 1 23 23 ASP H H 23 8.619 8.619 8.522 0.097 25085
727 1 2 . 1 1 24 24 ILE N N 24 115.522 115.522 120.663 -5.141 25085
728 1 2 . 1 1 24 24 ILE HA H 24 5.255 5.255 4.805 0.450 25085
729 1 2 . 1 1 24 24 ILE C C 24 178.920 178.920 173.941 4.979 25085
730 1 2 . 1 1 24 24 ILE CA C 24 60.188 60.188 59.852 0.336 25085
731 1 2 . 1 1 24 24 ILE CB C 24 38.015 38.015 38.490 -0.476 25085
732 1 2 . 1 1 24 24 ILE H H 24 7.877 7.877 7.768 0.109 25085
733 1 2 . 1 1 25 25 ARG N N 25 124.317 124.317 124.033 0.284 25085
734 1 2 . 1 1 25 25 ARG HA H 25 4.170 4.170 4.473 -0.303 25085
735 1 2 . 1 1 25 25 ARG C C 25 171.756 171.756 174.248 -2.492 25085
736 1 2 . 1 1 25 25 ARG CA C 25 56.547 56.547 55.462 1.085 25085
737 1 2 . 1 1 25 25 ARG CB C 25 30.897 30.897 32.303 -1.406 25085
738 1 2 . 1 1 25 25 ARG H H 25 8.235 8.235 7.981 0.254 25085
739 1 2 . 1 1 26 26 ASP N N 26 112.059 112.059 120.502 -8.443 25085
740 1 2 . 1 1 26 26 ASP HA H 26 4.609 4.609 4.880 -0.271 25085
741 1 2 . 1 1 26 26 ASP C C 26 177.934 177.934 176.929 1.005 25085
742 1 2 . 1 1 26 26 ASP CA C 26 54.398 54.398 52.735 1.663 25085
743 1 2 . 1 1 26 26 ASP CB C 26 42.029 42.029 41.477 0.552 25085
744 1 2 . 1 1 26 26 ASP H H 26 7.730 7.730 8.573 -0.843 25085
745 1 2 . 1 1 27 27 ALA N N 27 121.435 121.435 130.262 -8.827 25085
746 1 2 . 1 1 27 27 ALA HA H 27 3.959 3.959 3.942 0.017 25085
747 1 2 . 1 1 27 27 ALA C C 27 179.388 179.388 178.678 0.710 25085
748 1 2 . 1 1 27 27 ALA CA C 27 55.829 55.829 55.280 0.549 25085
749 1 2 . 1 1 27 27 ALA CB C 27 18.572 18.572 18.828 -0.256 25085
750 1 2 . 1 1 27 27 ALA H H 27 8.797 8.797 8.876 -0.079 25085
751 1 2 . 1 1 28 28 ASP N N 28 114.759 114.759 118.407 -3.648 25085
752 1 2 . 1 1 28 28 ASP HA H 28 4.314 4.314 4.314 0.000 25085
753 1 2 . 1 1 28 28 ASP C C 28 178.738 178.738 178.895 -0.157 25085
754 1 2 . 1 1 28 28 ASP CA C 28 56.997 56.997 57.760 -0.762 25085
755 1 2 . 1 1 28 28 ASP CB C 28 39.811 39.811 40.565 -0.754 25085
756 1 2 . 1 1 28 28 ASP H H 28 8.755 8.755 7.996 0.759 25085
757 1 2 . 1 1 29 29 GLU N N 29 119.562 119.562 118.442 1.120 25085
758 1 2 . 1 1 29 29 GLU HA H 29 4.116 4.116 4.251 -0.135 25085
759 1 2 . 1 1 29 29 GLU C C 29 178.473 178.473 178.195 0.278 25085
760 1 2 . 1 1 29 29 GLU CA C 29 58.928 58.928 58.198 0.730 25085
761 1 2 . 1 1 29 29 GLU CB C 29 29.395 29.395 29.821 -0.426 25085
762 1 2 . 1 1 29 29 GLU H H 29 7.446 7.446 8.851 -1.405 25085
763 1 2 . 1 1 30 30 TYR N N 30 120.494 120.494 120.002 0.492 25085
764 1 2 . 1 1 30 30 TYR HA H 30 4.092 4.092 4.586 -0.494 25085
765 1 2 . 1 1 30 30 TYR C C 30 176.988 176.988 177.787 -0.799 25085
766 1 2 . 1 1 30 30 TYR CA C 30 60.931 60.931 60.721 0.209 25085
767 1 2 . 1 1 30 30 TYR CB C 30 39.534 39.534 39.136 0.398 25085
768 1 2 . 1 1 30 30 TYR H H 30 7.545 7.545 7.476 0.070 25085
769 1 2 . 1 1 31 31 LEU N N 31 118.227 118.227 119.591 -1.364 25085
770 1 2 . 1 1 31 31 LEU HA H 31 3.916 3.916 3.983 -0.067 25085
771 1 2 . 1 1 31 31 LEU C C 31 178.824 178.824 178.407 0.417 25085
772 1 2 . 1 1 31 31 LEU CA C 31 57.444 57.444 57.810 -0.366 25085
773 1 2 . 1 1 31 31 LEU CB C 31 41.941 41.941 42.148 -0.207 25085
774 1 2 . 1 1 31 31 LEU H H 31 8.235 8.235 8.827 -0.592 25085
775 1 2 . 1 1 32 32 ARG N N 32 117.334 117.334 115.616 1.718 25085
776 1 2 . 1 1 32 32 ARG HA H 32 4.112 4.112 4.083 0.029 25085
777 1 2 . 1 1 32 32 ARG C C 32 177.008 177.008 175.811 1.197 25085
778 1 2 . 1 1 32 32 ARG CA C 32 59.366 59.366 57.849 1.517 25085
779 1 2 . 1 1 32 32 ARG CB C 32 30.938 30.938 30.654 0.284 25085
780 1 2 . 1 1 32 32 ARG H H 32 7.133 7.133 7.414 -0.281 25085
781 1 2 . 1 1 33 33 GLU N N 33 117.282 117.282 116.198 1.084 25085
782 1 2 . 1 1 33 33 GLU HA H 33 4.893 4.893 4.787 0.106 25085
783 1 2 . 1 1 33 33 GLU C C 33 173.503 173.503 173.496 0.007 25085
784 1 2 . 1 1 33 33 GLU CA C 33 56.291 56.291 56.106 0.185 25085
785 1 2 . 1 1 33 33 GLU CB C 33 32.248 32.248 32.321 -0.073 25085
786 1 2 . 1 1 33 33 GLU H H 33 7.521 7.521 7.322 0.199 25085
787 1 2 . 1 1 34 34 HIS N N 34 117.828 117.828 119.004 -1.176 25085
788 1 2 . 1 1 34 34 HIS HA H 34 4.627 4.627 4.209 0.418 25085
789 1 2 . 1 1 34 34 HIS C C 34 171.950 171.950 172.556 -0.606 25085
790 1 2 . 1 1 34 34 HIS CA C 34 54.304 54.304 54.348 -0.044 25085
791 1 2 . 1 1 34 34 HIS CB C 34 30.712 30.712 33.067 -2.355 25085
792 1 2 . 1 1 34 34 HIS H H 34 8.354 8.354 9.448 -1.094 25085
793 1 2 . 1 1 35 35 ILE N N 35 126.965 126.965 119.312 7.653 25085
794 1 2 . 1 1 35 35 ILE HA H 35 3.973 3.973 4.294 -0.321 25085
795 1 2 . 1 1 35 35 ILE CA C 35 60.500 60.500 57.524 2.976 25085
796 1 2 . 1 1 35 35 ILE CB C 35 38.822 38.822 38.008 0.813 25085
797 1 2 . 1 1 35 35 ILE H H 35 10.032 10.032 7.530 2.502 25085
798 1 2 . 1 1 36 36 PRO HA H 36 4.033 4.033 4.143 -0.110 25085
799 1 2 . 1 1 36 36 PRO C C 36 177.308 177.308 175.916 1.392 25085
800 1 2 . 1 1 36 36 PRO CA C 36 66.191 66.191 63.769 2.422 25085
801 1 2 . 1 1 36 36 PRO CB C 36 31.701 31.701 31.001 0.700 25085
802 1 2 . 1 1 37 37 GLU N N 37 113.735 113.735 115.897 -2.162 25085
803 1 2 . 1 1 37 37 GLU HA H 37 4.083 4.083 4.495 -0.412 25085
804 1 2 . 1 1 37 37 GLU C C 37 176.274 176.274 174.617 1.657 25085
805 1 2 . 1 1 37 37 GLU CA C 37 58.285 58.285 55.420 2.865 25085
806 1 2 . 1 1 37 37 GLU CB C 37 28.895 28.895 30.710 -1.815 25085
807 1 2 . 1 1 37 37 GLU H H 37 8.625 8.625 8.331 0.294 25085
808 1 2 . 1 1 38 38 ALA N N 38 122.325 122.325 120.892 1.433 25085
809 1 2 . 1 1 38 38 ALA HA H 38 4.484 4.484 4.655 -0.171 25085
810 1 2 . 1 1 38 38 ALA C C 38 178.043 178.043 175.132 2.911 25085
811 1 2 . 1 1 38 38 ALA CA C 38 52.385 52.385 50.726 1.659 25085
812 1 2 . 1 1 38 38 ALA CB C 38 21.151 21.151 21.917 -0.766 25085
813 1 2 . 1 1 38 38 ALA H H 38 8.160 8.160 7.791 0.369 25085
814 1 2 . 1 1 39 39 ASP N N 39 123.726 123.726 121.132 2.594 25085
815 1 2 . 1 1 39 39 ASP HA H 39 4.856 4.856 4.739 0.117 25085
816 1 2 . 1 1 39 39 ASP C C 39 174.077 174.077 175.241 -1.164 25085
817 1 2 . 1 1 39 39 ASP CA C 39 53.498 53.498 54.020 -0.522 25085
818 1 2 . 1 1 39 39 ASP CB C 39 45.176 45.176 43.292 1.884 25085
819 1 2 . 1 1 39 39 ASP H H 39 9.095 9.095 8.682 0.413 25085
820 1 2 . 1 1 40 40 LEU N N 40 123.111 123.111 126.732 -3.621 25085
821 1 2 . 1 1 40 40 LEU HA H 40 4.339 4.339 4.299 0.040 25085
822 1 2 . 1 1 40 40 LEU C C 40 176.159 176.159 175.559 0.600 25085
823 1 2 . 1 1 40 40 LEU CA C 40 54.766 54.766 54.418 0.348 25085
824 1 2 . 1 1 40 40 LEU CB C 40 41.988 41.988 43.022 -1.034 25085
825 1 2 . 1 1 40 40 LEU H H 40 8.199 8.199 8.469 -0.270 25085
826 1 2 . 1 1 41 41 ALA N N 41 130.678 130.678 130.317 0.361 25085
827 1 2 . 1 1 41 41 ALA HA H 41 4.430 4.430 4.727 -0.297 25085
828 1 2 . 1 1 41 41 ALA CA C 41 49.844 49.844 49.728 0.116 25085
829 1 2 . 1 1 41 41 ALA CB C 41 18.765 18.765 19.831 -1.066 25085
830 1 2 . 1 1 41 41 ALA H H 41 8.705 8.705 8.464 0.241 25085
831 1 2 . 1 1 42 42 PRO HA H 42 4.133 4.133 4.407 -0.274 25085
832 1 2 . 1 1 42 42 PRO C C 42 178.946 178.946 178.085 0.861 25085
833 1 2 . 1 1 42 42 PRO CA C 42 62.119 62.119 62.859 -0.740 25085
834 1 2 . 1 1 42 42 PRO CB C 42 33.383 33.383 31.728 1.655 25085
835 1 2 . 1 1 43 43 LEU N N 43 124.604 124.604 124.128 0.476 25085
836 1 2 . 1 1 43 43 LEU HA H 43 3.881 3.881 3.963 -0.082 25085
837 1 2 . 1 1 43 43 LEU C C 43 176.869 176.869 177.974 -1.105 25085
838 1 2 . 1 1 43 43 LEU CA C 43 58.639 58.639 57.723 0.916 25085
839 1 2 . 1 1 43 43 LEU CB C 43 41.848 41.848 41.660 0.188 25085
840 1 2 . 1 1 43 43 LEU H H 43 8.330 8.330 8.455 -0.125 25085
841 1 2 . 1 1 44 44 SER N N 44 110.167 110.167 112.316 -2.149 25085
842 1 2 . 1 1 44 44 SER HA H 44 4.147 4.147 4.241 -0.094 25085
843 1 2 . 1 1 44 44 SER C C 44 177.107 177.107 176.113 0.994 25085
844 1 2 . 1 1 44 44 SER CA C 44 61.043 61.043 60.340 0.703 25085
845 1 2 . 1 1 44 44 SER CB C 44 61.765 61.765 63.505 -1.740 25085
846 1 2 . 1 1 44 44 SER H H 44 8.553 8.553 7.900 0.653 25085
847 1 2 . 1 1 45 45 VAL N N 45 123.549 123.549 123.699 -0.150 25085
848 1 2 . 1 1 45 45 VAL HA H 45 3.825 3.825 3.902 -0.077 25085
849 1 2 . 1 1 45 45 VAL C C 45 178.328 178.328 176.991 1.337 25085
850 1 2 . 1 1 45 45 VAL CA C 45 65.576 65.576 65.330 0.246 25085
851 1 2 . 1 1 45 45 VAL CB C 45 31.889 31.889 31.608 0.281 25085
852 1 2 . 1 1 45 45 VAL H H 45 7.181 7.181 8.517 -1.336 25085
853 1 2 . 1 1 46 46 LEU N N 46 120.336 120.336 120.465 -0.129 25085
854 1 2 . 1 1 46 46 LEU HA H 46 3.826 3.826 3.945 -0.119 25085
855 1 2 . 1 1 46 46 LEU C C 46 179.996 179.996 178.180 1.816 25085
856 1 2 . 1 1 46 46 LEU CA C 46 57.602 57.602 58.355 -0.753 25085
857 1 2 . 1 1 46 46 LEU CB C 46 41.691 41.691 41.940 -0.248 25085
858 1 2 . 1 1 46 46 LEU H H 46 8.040 8.040 7.793 0.247 25085
859 1 2 . 1 1 47 47 GLU N N 47 115.713 115.713 117.093 -1.380 25085
860 1 2 . 1 1 47 47 GLU HA H 47 3.820 3.820 4.091 -0.271 25085
861 1 2 . 1 1 47 47 GLU C C 47 177.029 177.029 178.270 -1.241 25085
862 1 2 . 1 1 47 47 GLU CA C 47 59.317 59.317 58.347 0.970 25085
863 1 2 . 1 1 47 47 GLU CB C 47 30.526 30.526 29.796 0.730 25085
864 1 2 . 1 1 47 47 GLU H H 47 8.567 8.567 7.890 0.677 25085
865 1 2 . 1 1 48 48 GLN N N 48 116.740 116.740 117.821 -1.081 25085
866 1 2 . 1 1 48 48 GLN HA H 48 4.281 4.281 4.137 0.144 25085
867 1 2 . 1 1 48 48 GLN C C 48 177.605 177.605 177.591 0.014 25085
868 1 2 . 1 1 48 48 GLN CA C 48 57.827 57.827 57.938 -0.111 25085
869 1 2 . 1 1 48 48 GLN CB C 48 29.985 29.985 29.179 0.806 25085
870 1 2 . 1 1 48 48 GLN H H 48 7.472 7.472 7.770 -0.298 25085
871 1 2 . 1 1 49 49 SER N N 49 111.004 111.004 114.146 -3.142 25085
872 1 2 . 1 1 49 49 SER HA H 49 4.648 4.648 4.434 0.214 25085
873 1 2 . 1 1 49 49 SER C C 49 174.859 174.859 174.611 0.248 25085
874 1 2 . 1 1 49 49 SER CA C 49 58.406 58.406 59.044 -0.638 25085
875 1 2 . 1 1 49 49 SER CB C 49 64.758 64.758 64.771 -0.013 25085
876 1 2 . 1 1 49 49 SER H H 49 8.657 8.657 8.470 0.187 25085
877 1 2 . 1 1 50 50 GLY N N 50 110.839 110.839 109.848 0.991 25085
878 1 2 . 1 1 50 50 GLY C C 50 172.398 172.398 172.856 -0.458 25085
879 1 2 . 1 1 50 50 GLY CA C 50 44.444 44.444 44.827 -0.383 25085
880 1 2 . 1 1 50 50 GLY H H 50 7.846 7.846 7.721 0.125 25085
881 1 2 . 1 1 51 51 LEU N N 51 121.009 121.009 123.867 -2.858 25085
882 1 2 . 1 1 51 51 LEU HA H 51 4.244 4.244 4.823 -0.579 25085
883 1 2 . 1 1 51 51 LEU CA C 51 52.593 52.593 51.544 1.050 25085
884 1 2 . 1 1 51 51 LEU CB C 51 43.381 43.381 43.894 -0.513 25085
885 1 2 . 1 1 51 51 LEU H H 51 8.647 8.647 7.840 0.807 25085
886 1 2 . 1 1 52 52 PRO HA H 52 4.349 4.349 4.639 -0.290 25085
887 1 2 . 1 1 52 52 PRO C C 52 177.247 177.247 177.512 -0.265 25085
888 1 2 . 1 1 52 52 PRO CA C 52 62.980 62.980 62.495 0.485 25085
889 1 2 . 1 1 52 52 PRO CB C 52 32.423 32.423 30.410 2.013 25085
890 1 2 . 1 1 53 53 ALA N N 53 126.595 126.595 128.790 -2.195 25085
891 1 2 . 1 1 53 53 ALA HA H 53 3.870 3.870 3.874 -0.004 25085
892 1 2 . 1 1 53 53 ALA C C 53 180.484 180.484 178.825 1.659 25085
893 1 2 . 1 1 53 53 ALA CA C 53 55.829 55.829 55.230 0.599 25085
894 1 2 . 1 1 53 53 ALA CB C 53 18.248 18.248 18.544 -0.296 25085
895 1 2 . 1 1 53 53 ALA H H 53 8.643 8.643 8.265 0.378 25085
896 1 2 . 1 1 54 54 LYS N N 54 113.898 113.898 118.103 -4.205 25085
897 1 2 . 1 1 54 54 LYS HA H 54 4.167 4.167 4.091 0.076 25085
898 1 2 . 1 1 54 54 LYS C C 54 176.704 176.704 178.466 -1.762 25085
899 1 2 . 1 1 54 54 LYS CA C 54 57.893 57.893 58.383 -0.490 25085
900 1 2 . 1 1 54 54 LYS CB C 54 31.892 31.892 31.774 0.118 25085
901 1 2 . 1 1 54 54 LYS H H 54 8.442 8.442 8.316 0.126 25085
902 1 2 . 1 1 55 55 LEU N N 55 117.932 117.932 119.387 -1.455 25085
903 1 2 . 1 1 55 55 LEU HA H 55 4.308 4.308 4.259 0.049 25085
904 1 2 . 1 1 55 55 LEU C C 55 174.589 174.589 177.910 -3.321 25085
905 1 2 . 1 1 55 55 LEU CA C 55 54.003 54.003 56.797 -2.794 25085
906 1 2 . 1 1 55 55 LEU CB C 55 41.649 41.649 42.302 -0.653 25085
907 1 2 . 1 1 55 55 LEU H H 55 7.805 7.805 8.570 -0.765 25085
908 1 2 . 1 1 56 56 ARG N N 56 116.873 116.873 116.395 0.478 25085
909 1 2 . 1 1 56 56 ARG HA H 56 4.006 4.006 4.630 -0.624 25085
910 1 2 . 1 1 56 56 ARG C C 56 175.542 175.542 175.203 0.339 25085
911 1 2 . 1 1 56 56 ARG CA C 56 57.428 57.428 55.305 2.123 25085
912 1 2 . 1 1 56 56 ARG CB C 56 29.651 29.651 31.060 -1.409 25085
913 1 2 . 1 1 56 56 ARG H H 56 6.971 6.971 8.107 -1.136 25085
914 1 2 . 1 1 57 57 HIS N N 57 122.622 122.622 117.386 5.236 25085
915 1 2 . 1 1 57 57 HIS HA H 57 4.596 4.596 4.548 0.048 25085
916 1 2 . 1 1 57 57 HIS C C 57 173.855 173.855 173.300 0.555 25085
917 1 2 . 1 1 57 57 HIS CA C 57 55.780 55.780 56.514 -0.734 25085
918 1 2 . 1 1 57 57 HIS CB C 57 33.878 33.878 31.815 2.063 25085
919 1 2 . 1 1 57 57 HIS H H 57 7.281 7.281 7.504 -0.223 25085
920 1 2 . 1 1 58 58 GLU N N 58 120.479 120.479 118.616 1.863 25085
921 1 2 . 1 1 58 58 GLU HA H 58 4.052 4.052 4.420 -0.368 25085
922 1 2 . 1 1 58 58 GLU C C 58 176.762 176.762 175.097 1.665 25085
923 1 2 . 1 1 58 58 GLU CA C 58 59.634 59.634 56.741 2.893 25085
924 1 2 . 1 1 58 58 GLU CB C 58 29.931 29.931 31.789 -1.858 25085
925 1 2 . 1 1 58 58 GLU H H 58 7.626 7.626 8.593 -0.967 25085
926 1 2 . 1 1 59 59 GLN N N 59 118.110 118.110 118.574 -0.464 25085
927 1 2 . 1 1 59 59 GLN HA H 59 5.479 5.479 4.972 0.507 25085
928 1 2 . 1 1 59 59 GLN C C 59 174.322 174.322 174.781 -0.459 25085
929 1 2 . 1 1 59 59 GLN CA C 59 55.486 55.486 54.989 0.497 25085
930 1 2 . 1 1 59 59 GLN CB C 59 33.151 33.151 31.344 1.807 25085
931 1 2 . 1 1 59 59 GLN H H 59 8.560 8.560 8.162 0.398 25085
932 1 2 . 1 1 60 60 ILE N N 60 122.789 122.789 123.865 -1.076 25085
933 1 2 . 1 1 60 60 ILE HA H 60 4.531 4.531 4.501 0.030 25085
934 1 2 . 1 1 60 60 ILE C C 60 173.352 173.352 174.626 -1.274 25085
935 1 2 . 1 1 60 60 ILE CA C 60 59.794 59.794 60.454 -0.660 25085
936 1 2 . 1 1 60 60 ILE CB C 60 43.188 43.188 39.502 3.686 25085
937 1 2 . 1 1 60 60 ILE H H 60 8.735 8.735 7.996 0.739 25085
938 1 2 . 1 1 61 61 ILE N N 61 125.871 125.871 125.153 0.718 25085
939 1 2 . 1 1 61 61 ILE HA H 61 5.002 5.002 4.867 0.135 25085
940 1 2 . 1 1 61 61 ILE C C 61 175.195 175.195 174.496 0.699 25085
941 1 2 . 1 1 61 61 ILE CA C 61 58.419 58.419 59.508 -1.089 25085
942 1 2 . 1 1 61 61 ILE CB C 61 40.270 40.270 40.759 -0.489 25085
943 1 2 . 1 1 61 61 ILE H H 61 9.057 9.057 8.618 0.439 25085
944 1 2 . 1 1 62 62 PHE N N 62 123.742 123.742 123.623 0.119 25085
945 1 2 . 1 1 62 62 PHE HA H 62 5.810 5.810 5.732 0.078 25085
946 1 2 . 1 1 62 62 PHE C C 62 176.135 176.135 174.854 1.281 25085
947 1 2 . 1 1 62 62 PHE CA C 62 56.960 56.960 55.889 1.071 25085
948 1 2 . 1 1 62 62 PHE CB C 62 43.352 43.352 42.230 1.121 25085
949 1 2 . 1 1 62 62 PHE H H 62 8.977 8.977 8.332 0.645 25085
950 1 2 . 1 1 63 63 HIS N N 63 116.939 116.939 117.039 -0.100 25085
951 1 2 . 1 1 63 63 HIS HA H 63 5.979 5.979 5.196 0.783 25085
952 1 2 . 1 1 63 63 HIS C C 63 171.108 171.108 173.284 -2.176 25085
953 1 2 . 1 1 63 63 HIS CA C 63 54.115 54.115 53.385 0.730 25085
954 1 2 . 1 1 63 63 HIS CB C 63 36.861 36.861 30.999 5.862 25085
955 1 2 . 1 1 63 63 HIS H H 63 9.298 9.298 9.407 -0.109 25085
956 1 2 . 1 1 64 64 CYS N N 64 119.251 119.251 122.490 -3.239 25085
957 1 2 . 1 1 64 64 CYS HA H 64 5.044 5.044 4.803 0.241 25085
958 1 2 . 1 1 64 64 CYS C C 64 177.438 177.438 175.879 1.559 25085
959 1 2 . 1 1 64 64 CYS CA C 64 56.886 56.886 56.652 0.234 25085
960 1 2 . 1 1 64 64 CYS CB C 64 29.425 29.425 32.111 -2.686 25085
961 1 2 . 1 1 64 64 CYS H H 64 8.156 8.156 8.410 -0.254 25085
962 1 2 . 1 1 65 65 GLN N N 65 125.627 125.627 123.336 2.291 25085
963 1 2 . 1 1 65 65 GLN HA H 65 4.220 4.220 3.891 0.329 25085
964 1 2 . 1 1 65 65 GLN C C 65 174.440 174.440 175.876 -1.436 25085
965 1 2 . 1 1 65 65 GLN CA C 65 59.788 59.788 59.074 0.714 25085
966 1 2 . 1 1 65 65 GLN CB C 65 29.370 29.370 27.840 1.530 25085
967 1 2 . 1 1 65 65 GLN H H 65 8.937 8.937 9.019 -0.082 25085
968 1 2 . 1 1 66 66 ALA N N 66 118.880 118.880 117.011 1.869 25085
969 1 2 . 1 1 66 66 ALA HA H 66 5.115 5.115 4.814 0.301 25085
970 1 2 . 1 1 66 66 ALA C C 66 177.625 177.625 177.607 0.018 25085
971 1 2 . 1 1 66 66 ALA CA C 66 50.744 50.744 52.084 -1.341 25085
972 1 2 . 1 1 66 66 ALA CB C 66 20.658 20.658 19.583 1.075 25085
973 1 2 . 1 1 66 66 ALA H H 66 9.024 9.024 8.041 0.983 25085
974 1 2 . 1 1 67 67 GLY N N 67 112.878 112.878 107.567 5.311 25085
975 1 2 . 1 1 67 67 GLY C C 67 174.810 174.810 176.310 -1.500 25085
976 1 2 . 1 1 67 67 GLY CA C 67 45.642 45.642 46.329 -0.687 25085
977 1 2 . 1 1 67 67 GLY H H 67 8.845 8.845 8.077 0.768 25085
978 1 2 . 1 1 68 68 LYS N N 68 120.133 120.133 120.899 -0.766 25085
979 1 2 . 1 1 68 68 LYS HA H 68 4.158 4.158 3.854 0.304 25085
980 1 2 . 1 1 68 68 LYS C C 68 177.939 177.939 177.732 0.207 25085
981 1 2 . 1 1 68 68 LYS CA C 68 58.811 58.811 58.894 -0.083 25085
982 1 2 . 1 1 68 68 LYS CB C 68 32.796 32.796 32.337 0.459 25085
983 1 2 . 1 1 68 68 LYS H H 68 7.936 7.936 8.360 -0.424 25085
984 1 2 . 1 1 69 69 ARG N N 69 125.804 125.804 117.040 8.764 25085
985 1 2 . 1 1 69 69 ARG HA H 69 4.217 4.217 4.269 -0.052 25085
986 1 2 . 1 1 69 69 ARG C C 69 180.944 180.944 178.275 2.669 25085
987 1 2 . 1 1 69 69 ARG CA C 69 60.010 60.010 58.445 1.565 25085
988 1 2 . 1 1 69 69 ARG CB C 69 30.974 30.974 29.755 1.219 25085
989 1 2 . 1 1 69 69 ARG H H 69 8.981 8.981 8.405 0.576 25085
990 1 2 . 1 1 70 70 THR N N 70 116.681 116.681 117.208 -0.527 25085
991 1 2 . 1 1 70 70 THR HA H 70 3.607 3.607 4.065 -0.458 25085
992 1 2 . 1 1 70 70 THR C C 70 176.434 176.434 176.706 -0.272 25085
993 1 2 . 1 1 70 70 THR CA C 70 65.914 65.914 66.945 -1.031 25085
994 1 2 . 1 1 70 70 THR CB C 70 68.169 68.169 67.928 0.241 25085
995 1 2 . 1 1 70 70 THR H H 70 10.382 10.382 8.564 1.818 25085
996 1 2 . 1 1 71 71 SER N N 71 113.046 113.046 117.286 -4.240 25085
997 1 2 . 1 1 71 71 SER HA H 71 3.993 3.993 4.202 -0.209 25085
998 1 2 . 1 1 71 71 SER C C 71 177.594 177.594 175.659 1.935 25085
999 1 2 . 1 1 71 71 SER CA C 71 62.500 62.500 61.225 1.275 25085
1000 1 2 . 1 1 71 71 SER H H 71 7.346 7.346 7.843 -0.497 25085
1001 1 2 . 1 1 72 72 ASN N N 72 117.540 117.540 118.816 -1.276 25085
1002 1 2 . 1 1 72 72 ASN HA H 72 4.598 4.598 4.774 -0.176 25085
1003 1 2 . 1 1 72 72 ASN C C 72 175.595 175.595 177.047 -1.452 25085
1004 1 2 . 1 1 72 72 ASN CA C 72 55.147 55.147 55.375 -0.228 25085
1005 1 2 . 1 1 72 72 ASN CB C 72 38.821 38.821 38.885 -0.064 25085
1006 1 2 . 1 1 72 72 ASN H H 72 8.078 8.078 7.552 0.526 25085
1007 1 2 . 1 1 73 73 ASN N N 73 114.869 114.869 119.008 -4.139 25085
1008 1 2 . 1 1 73 73 ASN HA H 73 5.159 5.159 4.694 0.465 25085
1009 1 2 . 1 1 73 73 ASN C C 73 174.375 174.375 177.072 -2.697 25085
1010 1 2 . 1 1 73 73 ASN CA C 73 52.976 52.976 54.323 -1.347 25085
1011 1 2 . 1 1 73 73 ASN CB C 73 39.862 39.862 38.641 1.221 25085
1012 1 2 . 1 1 73 73 ASN H H 73 7.290 7.290 8.673 -1.383 25085
1013 1 2 . 1 1 74 74 ALA N N 74 124.647 124.647 123.056 1.591 25085
1014 1 2 . 1 1 74 74 ALA HA H 74 3.721 3.721 3.775 -0.054 25085
1015 1 2 . 1 1 74 74 ALA C C 74 177.908 177.908 178.874 -0.966 25085
1016 1 2 . 1 1 74 74 ALA CA C 74 57.085 57.085 55.180 1.905 25085
1017 1 2 . 1 1 74 74 ALA CB C 74 19.427 19.427 18.138 1.289 25085
1018 1 2 . 1 1 74 74 ALA H H 74 7.105 7.105 8.594 -1.489 25085
1019 1 2 . 1 1 75 75 ASP N N 75 114.917 114.917 116.176 -1.259 25085
1020 1 2 . 1 1 75 75 ASP HA H 75 4.250 4.250 4.416 -0.166 25085
1021 1 2 . 1 1 75 75 ASP C C 75 179.100 179.100 178.371 0.729 25085
1022 1 2 . 1 1 75 75 ASP CA C 75 57.236 57.236 56.850 0.386 25085
1023 1 2 . 1 1 75 75 ASP CB C 75 39.783 39.783 41.006 -1.223 25085
1024 1 2 . 1 1 75 75 ASP H H 75 8.403 8.403 7.920 0.483 25085
1025 1 2 . 1 1 76 76 LYS N N 76 121.888 121.888 118.491 3.397 25085
1026 1 2 . 1 1 76 76 LYS HA H 76 4.053 4.053 4.175 -0.122 25085
1027 1 2 . 1 1 76 76 LYS C C 76 178.832 178.832 178.829 0.003 25085
1028 1 2 . 1 1 76 76 LYS CA C 76 58.864 58.864 57.623 1.241 25085
1029 1 2 . 1 1 76 76 LYS CB C 76 32.423 32.423 32.485 -0.062 25085
1030 1 2 . 1 1 76 76 LYS H H 76 7.652 7.652 8.226 -0.574 25085
1031 1 2 . 1 1 77 77 LEU N N 77 118.644 118.644 120.618 -1.974 25085
1032 1 2 . 1 1 77 77 LEU HA H 77 3.557 3.557 3.928 -0.371 25085
1033 1 2 . 1 1 77 77 LEU C C 77 178.068 178.068 178.332 -0.264 25085
1034 1 2 . 1 1 77 77 LEU CA C 77 57.692 57.692 57.493 0.199 25085
1035 1 2 . 1 1 77 77 LEU CB C 77 40.077 40.077 41.272 -1.195 25085
1036 1 2 . 1 1 77 77 LEU H H 77 8.146 8.146 7.972 0.174 25085
1037 1 2 . 1 1 78 78 ALA N N 78 119.668 119.668 119.601 0.067 25085
1038 1 2 . 1 1 78 78 ALA HA H 78 3.990 3.990 3.962 0.028 25085
1039 1 2 . 1 1 78 78 ALA C C 78 179.542 179.542 177.947 1.595 25085
1040 1 2 . 1 1 78 78 ALA CA C 78 54.937 54.937 54.168 0.769 25085
1041 1 2 . 1 1 78 78 ALA CB C 78 18.080 18.080 18.351 -0.271 25085
1042 1 2 . 1 1 78 78 ALA H H 78 8.136 8.136 7.905 0.231 25085
1043 1 2 . 1 1 79 79 ALA N N 79 118.918 118.918 119.984 -1.066 25085
1044 1 2 . 1 1 79 79 ALA HA H 79 4.139 4.139 4.011 0.128 25085
1045 1 2 . 1 1 79 79 ALA C C 79 180.800 180.800 179.416 1.384 25085
1046 1 2 . 1 1 79 79 ALA CA C 79 54.571 54.571 54.507 0.064 25085
1047 1 2 . 1 1 79 79 ALA CB C 79 18.268 18.268 18.805 -0.537 25085
1048 1 2 . 1 1 79 79 ALA H H 79 7.319 7.319 7.453 -0.134 25085
1049 1 2 . 1 1 80 80 ILE N N 80 118.438 118.438 115.157 3.281 25085
1050 1 2 . 1 1 80 80 ILE HA H 80 3.801 3.801 4.002 -0.201 25085
1051 1 2 . 1 1 80 80 ILE C C 80 177.302 177.302 176.749 0.553 25085
1052 1 2 . 1 1 80 80 ILE CA C 80 64.252 64.252 62.121 2.131 25085
1053 1 2 . 1 1 80 80 ILE CB C 80 39.115 39.115 37.791 1.324 25085
1054 1 2 . 1 1 80 80 ILE H H 80 8.227 8.227 7.291 0.936 25085
1055 1 2 . 1 1 81 81 ALA N N 81 117.917 117.917 119.807 -1.890 25085
1056 1 2 . 1 1 81 81 ALA HA H 81 4.466 4.466 4.367 0.099 25085
1057 1 2 . 1 1 81 81 ALA C C 81 176.153 176.153 176.634 -0.481 25085
1058 1 2 . 1 1 81 81 ALA CA C 81 51.404 51.404 51.710 -0.306 25085
1059 1 2 . 1 1 81 81 ALA CB C 81 20.200 20.200 19.349 0.851 25085
1060 1 2 . 1 1 81 81 ALA H H 81 7.913 7.913 7.922 -0.009 25085
1061 1 2 . 1 1 82 82 ALA N N 82 124.086 124.086 120.877 3.209 25085
1062 1 2 . 1 1 82 82 ALA HA H 82 4.457 4.457 4.039 0.418 25085
1063 1 2 . 1 1 82 82 ALA CA C 82 52.276 52.276 52.474 -0.198 25085
1064 1 2 . 1 1 82 82 ALA CB C 82 17.243 17.243 16.620 0.623 25085
1065 1 2 . 1 1 82 82 ALA H H 82 7.223 7.223 7.174 0.049 25085
1066 1 2 . 1 1 83 83 PRO HA H 83 4.692 4.692 4.237 0.455 25085
1067 1 2 . 1 1 83 83 PRO C C 83 175.169 175.169 176.098 -0.929 25085
1068 1 2 . 1 1 83 83 PRO CA C 83 63.767 63.767 63.465 0.301 25085
1069 1 2 . 1 1 83 83 PRO CB C 83 32.624 32.624 31.101 1.523 25085
1070 1 2 . 1 1 84 84 ALA N N 84 127.741 127.741 121.998 5.743 25085
1071 1 2 . 1 1 84 84 ALA HA H 84 4.138 4.138 4.107 0.031 25085
1072 1 2 . 1 1 84 84 ALA C C 84 176.494 176.494 177.443 -0.949 25085
1073 1 2 . 1 1 84 84 ALA CA C 84 53.432 53.432 52.513 0.919 25085
1074 1 2 . 1 1 84 84 ALA CB C 84 19.719 19.719 19.345 0.374 25085
1075 1 2 . 1 1 84 84 ALA H H 84 8.528 8.528 7.177 1.351 25085
1076 1 2 . 1 1 85 85 GLU N N 85 121.634 121.634 119.748 1.886 25085
1077 1 2 . 1 1 85 85 GLU HA H 85 4.228 4.228 4.150 0.078 25085
1078 1 2 . 1 1 85 85 GLU C C 85 175.094 175.094 175.010 0.084 25085
1079 1 2 . 1 1 85 85 GLU CA C 85 56.444 56.444 56.529 -0.085 25085
1080 1 2 . 1 1 85 85 GLU CB C 85 30.803 30.803 28.821 1.982 25085
1081 1 2 . 1 1 85 85 GLU H H 85 8.166 8.166 8.517 -0.351 25085
1082 1 2 . 1 1 86 86 ILE N N 86 122.543 122.543 123.165 -0.622 25085
1083 1 2 . 1 1 86 86 ILE HA H 86 5.269 5.269 4.630 0.639 25085
1084 1 2 . 1 1 86 86 ILE C C 86 174.463 174.463 174.619 -0.156 25085
1085 1 2 . 1 1 86 86 ILE CA C 86 59.329 59.329 59.885 -0.556 25085
1086 1 2 . 1 1 86 86 ILE CB C 86 40.546 40.546 39.510 1.036 25085
1087 1 2 . 1 1 86 86 ILE H H 86 7.925 7.925 7.571 0.354 25085
1088 1 2 . 1 1 87 87 PHE N N 87 122.457 122.457 124.480 -2.023 25085
1089 1 2 . 1 1 87 87 PHE HA H 87 5.428 5.428 5.648 -0.220 25085
1090 1 2 . 1 1 87 87 PHE C C 87 174.450 174.450 174.937 -0.487 25085
1091 1 2 . 1 1 87 87 PHE CA C 87 55.029 55.029 55.855 -0.826 25085
1092 1 2 . 1 1 87 87 PHE CB C 87 43.626 43.626 43.353 0.273 25085
1093 1 2 . 1 1 87 87 PHE H H 87 9.050 9.050 7.913 1.137 25085
1094 1 2 . 1 1 88 88 LEU N N 88 119.959 119.959 119.782 0.177 25085
1095 1 2 . 1 1 88 88 LEU HA H 88 5.358 5.358 4.927 0.431 25085
1096 1 2 . 1 1 88 88 LEU C C 88 176.627 176.627 175.529 1.098 25085
1097 1 2 . 1 1 88 88 LEU CA C 88 52.654 52.654 53.499 -0.845 25085
1098 1 2 . 1 1 88 88 LEU CB C 88 43.094 43.094 45.108 -2.014 25085
1099 1 2 . 1 1 88 88 LEU H H 88 8.824 8.824 8.677 0.147 25085
1100 1 2 . 1 1 89 89 LEU N N 89 124.096 124.096 125.203 -1.107 25085
1101 1 2 . 1 1 89 89 LEU HA H 89 4.432 4.432 4.683 -0.251 25085
1102 1 2 . 1 1 89 89 LEU C C 89 176.693 176.693 175.690 1.003 25085
1103 1 2 . 1 1 89 89 LEU CA C 89 55.385 55.385 54.053 1.332 25085
1104 1 2 . 1 1 89 89 LEU CB C 89 43.537 43.537 42.497 1.040 25085
1105 1 2 . 1 1 89 89 LEU H H 89 8.293 8.293 8.253 0.040 25085
1106 1 2 . 1 1 90 90 GLU N N 90 102.942 102.942 127.669 -24.727 25085
1107 1 2 . 1 1 90 90 GLU HA H 90 3.895 3.895 3.990 -0.095 25085
1108 1 2 . 1 1 90 90 GLU C C 90 175.199 175.199 177.275 -2.076 25085
1109 1 2 . 1 1 90 90 GLU CA C 90 58.586 58.586 59.020 -0.434 25085
1110 1 2 . 1 1 90 90 GLU CB C 90 30.831 30.831 30.360 0.471 25085
1111 1 2 . 1 1 90 90 GLU H H 90 9.394 9.394 8.862 0.532 25085
1112 1 2 . 1 1 91 91 ASP N N 91 120.515 120.515 119.120 1.395 25085
1113 1 2 . 1 1 91 91 ASP HA H 91 4.184 4.184 4.255 -0.071 25085
1114 1 2 . 1 1 91 91 ASP C C 91 176.159 176.159 176.214 -0.055 25085
1115 1 2 . 1 1 91 91 ASP CA C 91 55.814 55.814 56.831 -1.017 25085
1116 1 2 . 1 1 91 91 ASP CB C 91 39.033 39.033 40.367 -1.334 25085
1117 1 2 . 1 1 91 91 ASP H H 91 9.210 9.210 8.890 0.320 25085
1118 1 2 . 1 1 92 92 GLY N N 92 104.313 104.313 106.240 -1.927 25085
1119 1 2 . 1 1 92 92 GLY C C 92 172.980 172.980 174.972 -1.992 25085
1120 1 2 . 1 1 92 92 GLY CA C 92 46.946 46.946 44.536 2.410 25085
1121 1 2 . 1 1 92 92 GLY H H 92 7.902 7.902 8.099 -0.197 25085
1122 1 2 . 1 1 93 93 ILE N N 93 121.445 121.445 123.165 -1.720 25085
1123 1 2 . 1 1 93 93 ILE HA H 93 3.902 3.902 3.871 0.031 25085
1124 1 2 . 1 1 93 93 ILE C C 93 176.528 176.528 177.426 -0.898 25085
1125 1 2 . 1 1 93 93 ILE CA C 93 63.908 63.908 65.067 -1.159 25085
1126 1 2 . 1 1 93 93 ILE CB C 93 38.416 38.416 37.403 1.013 25085
1127 1 2 . 1 1 93 93 ILE H H 93 8.129 8.129 7.981 0.148 25085
1128 1 2 . 1 1 94 94 ASP N N 94 126.304 126.304 119.606 6.698 25085
1129 1 2 . 1 1 94 94 ASP HA H 94 4.436 4.436 4.422 0.014 25085
1130 1 2 . 1 1 94 94 ASP C C 94 180.174 180.174 179.003 1.171 25085
1131 1 2 . 1 1 94 94 ASP CA C 94 58.351 58.351 57.650 0.702 25085
1132 1 2 . 1 1 94 94 ASP CB C 94 39.223 39.223 40.439 -1.216 25085
1133 1 2 . 1 1 94 94 ASP H H 94 9.161 9.161 8.278 0.883 25085
1134 1 2 . 1 1 95 95 GLY N N 95 110.690 110.690 107.757 2.933 25085
1135 1 2 . 1 1 95 95 GLY C C 95 176.108 176.108 175.908 0.200 25085
1136 1 2 . 1 1 95 95 GLY CA C 95 46.873 46.873 46.711 0.162 25085
1137 1 2 . 1 1 95 95 GLY H H 95 8.080 8.080 8.150 -0.070 25085
1138 1 2 . 1 1 96 96 TRP N N 96 126.965 126.965 123.676 3.289 25085
1139 1 2 . 1 1 96 96 TRP HA H 96 3.795 3.795 4.371 -0.576 25085
1140 1 2 . 1 1 96 96 TRP C C 96 177.058 177.058 177.899 -0.841 25085
1141 1 2 . 1 1 96 96 TRP CA C 96 61.633 61.633 61.903 -0.270 25085
1142 1 2 . 1 1 96 96 TRP CB C 96 29.512 29.512 29.570 -0.058 25085
1143 1 2 . 1 1 96 96 TRP H H 96 8.007 8.007 7.997 0.010 25085
1144 1 2 . 1 1 97 97 LYS N N 97 116.604 116.604 118.727 -2.123 25085
1145 1 2 . 1 1 97 97 LYS HA H 97 4.090 4.090 4.331 -0.241 25085
1146 1 2 . 1 1 97 97 LYS C C 97 182.010 182.010 178.885 3.125 25085
1147 1 2 . 1 1 97 97 LYS CA C 97 59.776 59.776 58.339 1.437 25085
1148 1 2 . 1 1 97 97 LYS CB C 97 32.208 32.208 32.607 -0.399 25085
1149 1 2 . 1 1 97 97 LYS H H 97 8.696 8.696 8.469 0.227 25085
1150 1 2 . 1 1 98 98 ARG N N 98 122.491 122.491 119.454 3.037 25085
1151 1 2 . 1 1 98 98 ARG HA H 98 4.050 4.050 4.147 -0.097 25085
1152 1 2 . 1 1 98 98 ARG C C 98 177.666 177.666 178.222 -0.556 25085
1153 1 2 . 1 1 98 98 ARG CA C 98 59.509 59.509 58.544 0.965 25085
1154 1 2 . 1 1 98 98 ARG CB C 98 30.471 30.471 30.249 0.222 25085
1155 1 2 . 1 1 98 98 ARG H H 98 8.280 8.280 7.718 0.562 25085
1156 1 2 . 1 1 99 99 ALA N N 99 119.546 119.546 119.666 -0.120 25085
1157 1 2 . 1 1 99 99 ALA HA H 99 4.276 4.276 4.246 0.030 25085
1158 1 2 . 1 1 99 99 ALA C C 99 176.800 176.800 177.836 -1.036 25085
1159 1 2 . 1 1 99 99 ALA CA C 99 52.254 52.254 53.652 -1.398 25085
1160 1 2 . 1 1 99 99 ALA CB C 99 18.270 18.270 19.664 -1.394 25085
1161 1 2 . 1 1 99 99 ALA H H 99 7.519 7.519 8.259 -0.740 25085
1162 1 2 . 1 1 100 100 GLY N N 100 106.339 106.339 104.390 1.949 25085
1163 1 2 . 1 1 100 100 GLY C C 100 174.232 174.232 173.409 0.823 25085
1164 1 2 . 1 1 100 100 GLY CA C 100 45.050 45.050 44.618 0.432 25085
1165 1 2 . 1 1 100 100 GLY H H 100 7.926 7.926 7.577 0.349 25085
1166 1 2 . 1 1 101 101 LEU N N 101 122.181 122.181 120.424 1.757 25085
1167 1 2 . 1 1 101 101 LEU HA H 101 4.286 4.286 4.503 -0.217 25085
1168 1 2 . 1 1 101 101 LEU CA C 101 53.183 53.183 50.850 2.333 25085
1169 1 2 . 1 1 101 101 LEU CB C 101 37.320 37.320 41.971 -4.651 25085
1170 1 2 . 1 1 101 101 LEU H H 101 6.976 6.976 7.295 -0.319 25085
1171 1 2 . 1 1 102 102 PRO HA H 102 4.476 4.476 4.324 0.152 25085
1172 1 2 . 1 1 102 102 PRO C C 102 177.424 177.424 176.167 1.257 25085
1173 1 2 . 1 1 102 102 PRO CA C 102 64.014 64.014 63.239 0.775 25085
1174 1 2 . 1 1 102 102 PRO CB C 102 33.200 33.200 31.978 1.222 25085
1175 1 2 . 1 1 103 103 VAL N N 103 110.512 110.512 116.144 -5.632 25085
1176 1 2 . 1 1 103 103 VAL HA H 103 4.643 4.643 4.437 0.206 25085
1177 1 2 . 1 1 103 103 VAL C C 103 174.297 174.297 174.607 -0.310 25085
1178 1 2 . 1 1 103 103 VAL CA C 103 59.693 59.693 59.940 -0.246 25085
1179 1 2 . 1 1 103 103 VAL CB C 103 35.980 35.980 33.960 2.020 25085
1180 1 2 . 1 1 103 103 VAL H H 103 8.073 8.073 7.977 0.096 25085
1181 1 2 . 1 1 104 104 ALA N N 104 125.898 125.898 123.859 2.039 25085
1182 1 2 . 1 1 104 104 ALA HA H 104 4.550 4.550 4.929 -0.379 25085
1183 1 2 . 1 1 104 104 ALA C C 104 176.190 176.190 175.573 0.617 25085
1184 1 2 . 1 1 104 104 ALA CA C 104 50.699 50.699 50.899 -0.200 25085
1185 1 2 . 1 1 104 104 ALA CB C 104 19.534 19.534 21.955 -2.421 25085
1186 1 2 . 1 1 104 104 ALA H H 104 8.996 8.996 8.056 0.940 25085
1187 1 2 . 1 1 105 105 VAL N N 105 119.534 119.534 121.561 -2.027 25085
1188 1 2 . 1 1 105 105 VAL HA H 105 4.615 4.615 4.145 0.470 25085
1189 1 2 . 1 1 105 105 VAL C C 105 175.576 175.576 175.137 0.439 25085
1190 1 2 . 1 1 105 105 VAL CA C 105 60.234 60.234 61.004 -0.770 25085
1191 1 2 . 1 1 105 105 VAL CB C 105 34.683 34.683 33.055 1.628 25085
1192 1 2 . 1 1 105 105 VAL H H 105 8.276 8.276 8.438 -0.162 25085
1193 1 2 . 1 1 106 106 ASN N N 106 123.346 123.346 126.863 -3.517 25085
1194 1 2 . 1 1 106 106 ASN HA H 106 4.748 4.748 4.206 0.542 25085
1195 1 2 . 1 1 106 106 ASN C C 106 173.877 173.877 175.349 -1.472 25085
1196 1 2 . 1 1 106 106 ASN CA C 106 53.465 53.465 52.983 0.482 25085
1197 1 2 . 1 1 106 106 ASN CB C 106 39.424 39.424 37.838 1.586 25085
1198 1 2 . 1 1 106 106 ASN H H 106 8.190 8.190 7.980 0.210 25085
1199 1 3 . 1 1 2 2 ALA N N 2 125.104 125.104 123.063 2.041 25085
1200 1 3 . 1 1 2 2 ALA HA H 2 4.287 4.287 4.533 -0.246 25085
1201 1 3 . 1 1 2 2 ALA C C 2 176.800 176.800 177.188 -0.388 25085
1202 1 3 . 1 1 2 2 ALA CA C 2 52.429 52.429 52.061 0.368 25085
1203 1 3 . 1 1 2 2 ALA CB C 2 19.407 19.407 19.118 0.289 25085
1204 1 3 . 1 1 2 2 ALA H H 2 8.344 8.344 8.106 0.238 25085
1205 1 3 . 1 1 3 3 LEU N N 3 120.515 120.515 117.730 2.785 25085
1206 1 3 . 1 1 3 3 LEU HA H 3 4.452 4.452 5.119 -0.667 25085
1207 1 3 . 1 1 3 3 LEU C C 3 176.497 176.497 176.454 0.043 25085
1208 1 3 . 1 1 3 3 LEU CA C 3 54.698 54.698 54.731 -0.033 25085
1209 1 3 . 1 1 3 3 LEU CB C 3 43.203 43.203 42.607 0.596 25085
1210 1 3 . 1 1 3 3 LEU H H 3 8.070 8.070 7.527 0.543 25085
1211 1 3 . 1 1 4 4 THR N N 4 117.803 117.803 117.605 0.198 25085
1212 1 3 . 1 1 4 4 THR HA H 4 4.480 4.480 4.739 -0.259 25085
1213 1 3 . 1 1 4 4 THR C C 4 173.872 173.872 173.939 -0.067 25085
1214 1 3 . 1 1 4 4 THR CA C 4 62.247 62.247 61.193 1.054 25085
1215 1 3 . 1 1 4 4 THR CB C 4 70.533 70.533 72.248 -1.715 25085
1216 1 3 . 1 1 4 4 THR H H 4 7.954 7.954 8.587 -0.633 25085
1217 1 3 . 1 1 5 5 THR N N 5 121.501 121.501 116.225 5.276 25085
1218 1 3 . 1 1 5 5 THR HA H 5 5.289 5.289 4.573 0.716 25085
1219 1 3 . 1 1 5 5 THR C C 5 174.162 174.162 173.618 0.544 25085
1220 1 3 . 1 1 5 5 THR CA C 5 62.102 62.102 62.156 -0.054 25085
1221 1 3 . 1 1 5 5 THR CB C 5 69.457 69.457 69.532 -0.075 25085
1222 1 3 . 1 1 5 5 THR H H 5 8.640 8.640 8.495 0.145 25085
1223 1 3 . 1 1 6 6 ILE N N 6 122.023 122.023 122.967 -0.944 25085
1224 1 3 . 1 1 6 6 ILE HA H 6 4.988 4.988 4.513 0.475 25085
1225 1 3 . 1 1 6 6 ILE C C 6 173.377 173.377 173.597 -0.220 25085
1226 1 3 . 1 1 6 6 ILE CA C 6 58.611 58.611 59.922 -1.311 25085
1227 1 3 . 1 1 6 6 ILE CB C 6 42.821 42.821 42.498 0.323 25085
1228 1 3 . 1 1 6 6 ILE H H 6 8.977 8.977 9.061 -0.084 25085
1229 1 3 . 1 1 7 7 SER N N 7 122.659 122.659 119.189 3.470 25085
1230 1 3 . 1 1 7 7 SER HA H 7 4.768 4.768 5.143 -0.375 25085
1231 1 3 . 1 1 7 7 SER CA C 7 56.790 56.790 55.660 1.131 25085
1232 1 3 . 1 1 7 7 SER CB C 7 63.235 63.235 62.896 0.339 25085
1233 1 3 . 1 1 7 7 SER H H 7 9.242 9.242 8.456 0.786 25085
1234 1 3 . 1 1 8 8 PRO HA H 8 4.207 4.207 4.277 -0.070 25085
1235 1 3 . 1 1 8 8 PRO C C 8 176.787 176.787 178.342 -1.555 25085
1236 1 3 . 1 1 8 8 PRO CA C 8 66.443 66.443 65.392 1.050 25085
1237 1 3 . 1 1 8 8 PRO CB C 8 32.724 32.724 31.932 0.792 25085
1238 1 3 . 1 1 9 9 HIS N N 9 113.700 113.700 115.581 -1.881 25085
1239 1 3 . 1 1 9 9 HIS HA H 9 3.990 3.990 4.430 -0.440 25085
1240 1 3 . 1 1 9 9 HIS C C 9 178.123 178.123 177.649 0.474 25085
1241 1 3 . 1 1 9 9 HIS CA C 9 60.827 60.827 58.654 2.172 25085
1242 1 3 . 1 1 9 9 HIS CB C 9 29.552 29.552 29.780 -0.228 25085
1243 1 3 . 1 1 9 9 HIS H H 9 8.172 8.172 8.220 -0.048 25085
1244 1 3 . 1 1 10 10 ASP N N 10 120.665 120.665 119.883 0.782 25085
1245 1 3 . 1 1 10 10 ASP HA H 10 4.369 4.369 4.426 -0.057 25085
1246 1 3 . 1 1 10 10 ASP C C 10 179.100 179.100 177.878 1.222 25085
1247 1 3 . 1 1 10 10 ASP CA C 10 57.071 57.071 57.561 -0.490 25085
1248 1 3 . 1 1 10 10 ASP CB C 10 39.529 39.529 41.241 -1.712 25085
1249 1 3 . 1 1 10 10 ASP H H 10 7.706 7.706 8.699 -0.993 25085
1250 1 3 . 1 1 11 11 ALA N N 11 123.686 123.686 121.628 2.058 25085
1251 1 3 . 1 1 11 11 ALA HA H 11 3.782 3.782 3.963 -0.181 25085
1252 1 3 . 1 1 11 11 ALA C C 11 178.260 178.260 179.489 -1.229 25085
1253 1 3 . 1 1 11 11 ALA CA C 11 55.142 55.142 54.835 0.307 25085
1254 1 3 . 1 1 11 11 ALA CB C 11 18.293 18.293 18.193 0.100 25085
1255 1 3 . 1 1 11 11 ALA H H 11 8.896 8.896 7.707 1.189 25085
1256 1 3 . 1 1 12 12 GLN N N 12 117.521 117.521 118.280 -0.759 25085
1257 1 3 . 1 1 12 12 GLN HA H 12 4.000 4.000 4.210 -0.210 25085
1258 1 3 . 1 1 12 12 GLN C C 12 178.499 178.499 178.321 0.178 25085
1259 1 3 . 1 1 12 12 GLN CA C 12 60.102 60.102 59.064 1.038 25085
1260 1 3 . 1 1 12 12 GLN CB C 12 28.743 28.743 28.610 0.133 25085
1261 1 3 . 1 1 12 12 GLN H H 12 8.431 8.431 7.994 0.437 25085
1262 1 3 . 1 1 13 13 GLU N N 13 118.578 118.578 119.240 -0.662 25085
1263 1 3 . 1 1 13 13 GLU HA H 13 4.059 4.059 4.130 -0.071 25085
1264 1 3 . 1 1 13 13 GLU C C 13 178.352 178.352 178.946 -0.594 25085
1265 1 3 . 1 1 13 13 GLU CA C 13 59.079 59.079 58.774 0.305 25085
1266 1 3 . 1 1 13 13 GLU CB C 13 29.213 29.213 29.535 -0.322 25085
1267 1 3 . 1 1 13 13 GLU H H 13 7.234 7.234 8.039 -0.805 25085
1268 1 3 . 1 1 14 14 LEU N N 14 119.848 119.848 119.296 0.552 25085
1269 1 3 . 1 1 14 14 LEU HA H 14 3.891 3.891 4.185 -0.294 25085
1270 1 3 . 1 1 14 14 LEU C C 14 180.773 180.773 178.716 2.057 25085
1271 1 3 . 1 1 14 14 LEU CA C 14 57.958 57.958 57.320 0.638 25085
1272 1 3 . 1 1 14 14 LEU CB C 14 41.715 41.715 42.099 -0.383 25085
1273 1 3 . 1 1 14 14 LEU H H 14 7.582 7.582 7.563 0.019 25085
1274 1 3 . 1 1 15 15 ILE N N 15 122.392 122.392 118.640 3.752 25085
1275 1 3 . 1 1 15 15 ILE HA H 15 3.924 3.924 3.648 0.276 25085
1276 1 3 . 1 1 15 15 ILE C C 15 180.109 180.109 177.837 2.272 25085
1277 1 3 . 1 1 15 15 ILE CA C 15 64.663 64.663 64.801 -0.138 25085
1278 1 3 . 1 1 15 15 ILE CB C 15 38.900 38.900 37.703 1.197 25085
1279 1 3 . 1 1 15 15 ILE H H 15 8.772 8.772 8.183 0.589 25085
1280 1 3 . 1 1 16 16 ALA N N 16 123.856 123.856 120.207 3.649 25085
1281 1 3 . 1 1 16 16 ALA HA H 16 4.183 4.183 4.213 -0.030 25085
1282 1 3 . 1 1 16 16 ALA C C 16 179.100 179.100 178.731 0.369 25085
1283 1 3 . 1 1 16 16 ALA CA C 16 54.806 54.806 54.021 0.785 25085
1284 1 3 . 1 1 16 16 ALA CB C 16 17.646 17.646 18.712 -1.066 25085
1285 1 3 . 1 1 16 16 ALA H H 16 7.808 7.808 7.636 0.172 25085
1286 1 3 . 1 1 17 17 ARG N N 17 115.329 115.329 117.933 -2.604 25085
1287 1 3 . 1 1 17 17 ARG HA H 17 4.404 4.404 4.345 0.059 25085
1288 1 3 . 1 1 17 17 ARG C C 17 176.446 176.446 177.076 -0.630 25085
1289 1 3 . 1 1 17 17 ARG CA C 17 56.015 56.015 57.016 -1.001 25085
1290 1 3 . 1 1 17 17 ARG CB C 17 30.676 30.676 31.490 -0.814 25085
1291 1 3 . 1 1 17 17 ARG H H 17 7.280 7.280 8.457 -1.177 25085
1292 1 3 . 1 1 18 18 GLY N N 18 107.395 107.395 105.336 2.059 25085
1293 1 3 . 1 1 18 18 GLY C C 18 174.072 174.072 173.385 0.687 25085
1294 1 3 . 1 1 18 18 GLY CA C 18 45.218 45.218 44.451 0.767 25085
1295 1 3 . 1 1 18 18 GLY H H 18 7.795 7.795 8.223 -0.428 25085
1296 1 3 . 1 1 19 19 ALA N N 19 123.197 123.197 122.893 0.304 25085
1297 1 3 . 1 1 19 19 ALA HA H 19 4.217 4.217 4.178 0.039 25085
1298 1 3 . 1 1 19 19 ALA C C 19 176.261 176.261 177.187 -0.926 25085
1299 1 3 . 1 1 19 19 ALA CA C 19 52.674 52.674 52.409 0.265 25085
1300 1 3 . 1 1 19 19 ALA CB C 19 19.411 19.411 19.722 -0.311 25085
1301 1 3 . 1 1 19 19 ALA H H 19 7.980 7.980 7.455 0.525 25085
1302 1 3 . 1 1 20 20 LYS N N 20 118.629 118.629 122.206 -3.577 25085
1303 1 3 . 1 1 20 20 LYS HA H 20 4.308 4.308 4.390 -0.082 25085
1304 1 3 . 1 1 20 20 LYS C C 20 173.981 173.981 174.924 -0.943 25085
1305 1 3 . 1 1 20 20 LYS CA C 20 53.820 53.820 55.254 -1.434 25085
1306 1 3 . 1 1 20 20 LYS CB C 20 33.571 33.571 32.893 0.678 25085
1307 1 3 . 1 1 20 20 LYS H H 20 7.589 7.589 7.989 -0.400 25085
1308 1 3 . 1 1 21 21 LEU N N 21 126.686 126.686 126.086 0.600 25085
1309 1 3 . 1 1 21 21 LEU HA H 21 5.154 5.154 4.651 0.503 25085
1310 1 3 . 1 1 21 21 LEU C C 21 174.076 174.076 175.999 -1.923 25085
1311 1 3 . 1 1 21 21 LEU CA C 21 53.262 53.262 54.758 -1.496 25085
1312 1 3 . 1 1 21 21 LEU CB C 21 44.350 44.350 42.656 1.694 25085
1313 1 3 . 1 1 21 21 LEU H H 21 8.812 8.812 8.548 0.264 25085
1314 1 3 . 1 1 22 22 ILE N N 22 127.566 127.566 121.430 6.136 25085
1315 1 3 . 1 1 22 22 ILE HA H 22 4.678 4.678 5.126 -0.448 25085
1316 1 3 . 1 1 22 22 ILE C C 22 173.136 173.136 174.144 -1.008 25085
1317 1 3 . 1 1 22 22 ILE CA C 22 60.160 60.160 59.349 0.811 25085
1318 1 3 . 1 1 22 22 ILE CB C 22 39.842 39.842 41.729 -1.887 25085
1319 1 3 . 1 1 22 22 ILE H H 22 9.416 9.416 9.046 0.370 25085
1320 1 3 . 1 1 23 23 ASP N N 23 129.217 129.217 123.212 6.005 25085
1321 1 3 . 1 1 23 23 ASP HA H 23 3.806 3.806 4.900 -1.094 25085
1322 1 3 . 1 1 23 23 ASP C C 23 176.042 176.042 175.287 0.755 25085
1323 1 3 . 1 1 23 23 ASP CA C 23 52.005 52.005 51.435 0.570 25085
1324 1 3 . 1 1 23 23 ASP CB C 23 42.984 42.984 44.010 -1.026 25085
1325 1 3 . 1 1 23 23 ASP H H 23 8.619 8.619 8.350 0.269 25085
1326 1 3 . 1 1 24 24 ILE N N 24 115.522 115.522 116.279 -0.757 25085
1327 1 3 . 1 1 24 24 ILE HA H 24 5.255 5.255 4.897 0.358 25085
1328 1 3 . 1 1 24 24 ILE C C 24 178.920 178.920 173.540 5.380 25085
1329 1 3 . 1 1 24 24 ILE CA C 24 60.188 60.188 60.490 -0.302 25085
1330 1 3 . 1 1 24 24 ILE CB C 24 38.015 38.015 39.387 -1.372 25085
1331 1 3 . 1 1 24 24 ILE H H 24 7.877 7.877 7.563 0.314 25085
1332 1 3 . 1 1 25 25 ARG N N 25 124.317 124.317 123.331 0.986 25085
1333 1 3 . 1 1 25 25 ARG HA H 25 4.170 4.170 4.315 -0.145 25085
1334 1 3 . 1 1 25 25 ARG C C 25 171.756 171.756 174.059 -2.303 25085
1335 1 3 . 1 1 25 25 ARG CA C 25 56.547 56.547 55.798 0.749 25085
1336 1 3 . 1 1 25 25 ARG CB C 25 30.897 30.897 33.481 -2.584 25085
1337 1 3 . 1 1 25 25 ARG H H 25 8.235 8.235 7.852 0.383 25085
1338 1 3 . 1 1 26 26 ASP N N 26 112.059 112.059 120.306 -8.247 25085
1339 1 3 . 1 1 26 26 ASP HA H 26 4.609 4.609 4.823 -0.214 25085
1340 1 3 . 1 1 26 26 ASP C C 26 177.934 177.934 176.851 1.083 25085
1341 1 3 . 1 1 26 26 ASP CA C 26 54.398 54.398 54.260 0.138 25085
1342 1 3 . 1 1 26 26 ASP CB C 26 42.029 42.029 41.788 0.241 25085
1343 1 3 . 1 1 26 26 ASP H H 26 7.730 7.730 8.583 -0.853 25085
1344 1 3 . 1 1 27 27 ALA N N 27 121.435 121.435 128.964 -7.529 25085
1345 1 3 . 1 1 27 27 ALA HA H 27 3.959 3.959 4.078 -0.119 25085
1346 1 3 . 1 1 27 27 ALA C C 27 179.388 179.388 178.860 0.528 25085
1347 1 3 . 1 1 27 27 ALA CA C 27 55.829 55.829 55.307 0.521 25085
1348 1 3 . 1 1 27 27 ALA CB C 27 18.572 18.572 18.882 -0.310 25085
1349 1 3 . 1 1 27 27 ALA H H 27 8.797 8.797 8.855 -0.058 25085
1350 1 3 . 1 1 28 28 ASP N N 28 114.759 114.759 117.550 -2.791 25085
1351 1 3 . 1 1 28 28 ASP HA H 28 4.314 4.314 4.300 0.014 25085
1352 1 3 . 1 1 28 28 ASP C C 28 178.738 178.738 178.574 0.164 25085
1353 1 3 . 1 1 28 28 ASP CA C 28 56.997 56.997 57.521 -0.524 25085
1354 1 3 . 1 1 28 28 ASP CB C 28 39.811 39.811 40.247 -0.436 25085
1355 1 3 . 1 1 28 28 ASP H H 28 8.755 8.755 8.889 -0.134 25085
1356 1 3 . 1 1 29 29 GLU N N 29 119.562 119.562 119.658 -0.096 25085
1357 1 3 . 1 1 29 29 GLU HA H 29 4.116 4.116 4.280 -0.164 25085
1358 1 3 . 1 1 29 29 GLU C C 29 178.473 178.473 178.927 -0.454 25085
1359 1 3 . 1 1 29 29 GLU CA C 29 58.928 58.928 58.478 0.450 25085
1360 1 3 . 1 1 29 29 GLU CB C 29 29.395 29.395 30.142 -0.747 25085
1361 1 3 . 1 1 29 29 GLU H H 29 7.446 7.446 7.791 -0.345 25085
1362 1 3 . 1 1 30 30 TYR N N 30 120.494 120.494 121.310 -0.816 25085
1363 1 3 . 1 1 30 30 TYR HA H 30 4.092 4.092 4.496 -0.404 25085
1364 1 3 . 1 1 30 30 TYR C C 30 176.988 176.988 177.908 -0.920 25085
1365 1 3 . 1 1 30 30 TYR CA C 30 60.931 60.931 60.867 0.064 25085
1366 1 3 . 1 1 30 30 TYR CB C 30 39.534 39.534 38.756 0.778 25085
1367 1 3 . 1 1 30 30 TYR H H 30 7.545 7.545 7.789 -0.244 25085
1368 1 3 . 1 1 31 31 LEU N N 31 118.227 118.227 119.597 -1.370 25085
1369 1 3 . 1 1 31 31 LEU HA H 31 3.916 3.916 3.819 0.097 25085
1370 1 3 . 1 1 31 31 LEU C C 31 178.824 178.824 177.785 1.039 25085
1371 1 3 . 1 1 31 31 LEU CA C 31 57.444 57.444 58.135 -0.691 25085
1372 1 3 . 1 1 31 31 LEU CB C 31 41.941 41.941 42.229 -0.288 25085
1373 1 3 . 1 1 31 31 LEU H H 31 8.235 8.235 8.883 -0.648 25085
1374 1 3 . 1 1 32 32 ARG N N 32 117.334 117.334 116.238 1.096 25085
1375 1 3 . 1 1 32 32 ARG HA H 32 4.112 4.112 4.004 0.108 25085
1376 1 3 . 1 1 32 32 ARG C C 32 177.008 177.008 175.887 1.121 25085
1377 1 3 . 1 1 32 32 ARG CA C 32 59.366 59.366 58.161 1.204 25085
1378 1 3 . 1 1 32 32 ARG CB C 32 30.938 30.938 30.431 0.507 25085
1379 1 3 . 1 1 32 32 ARG H H 32 7.133 7.133 7.600 -0.467 25085
1380 1 3 . 1 1 33 33 GLU N N 33 117.282 117.282 119.371 -2.089 25085
1381 1 3 . 1 1 33 33 GLU HA H 33 4.893 4.893 4.539 0.354 25085
1382 1 3 . 1 1 33 33 GLU C C 33 173.503 173.503 173.914 -0.411 25085
1383 1 3 . 1 1 33 33 GLU CA C 33 56.291 56.291 55.621 0.670 25085
1384 1 3 . 1 1 33 33 GLU CB C 33 32.248 32.248 32.255 -0.007 25085
1385 1 3 . 1 1 33 33 GLU H H 33 7.521 7.521 7.191 0.330 25085
1386 1 3 . 1 1 34 34 HIS N N 34 117.828 117.828 122.107 -4.279 25085
1387 1 3 . 1 1 34 34 HIS HA H 34 4.627 4.627 4.017 0.610 25085
1388 1 3 . 1 1 34 34 HIS C C 34 171.950 171.950 172.516 -0.566 25085
1389 1 3 . 1 1 34 34 HIS CA C 34 54.304 54.304 53.632 0.672 25085
1390 1 3 . 1 1 34 34 HIS CB C 34 30.712 30.712 32.096 -1.385 25085
1391 1 3 . 1 1 34 34 HIS H H 34 8.354 8.354 9.424 -1.070 25085
1392 1 3 . 1 1 35 35 ILE N N 35 126.965 126.965 118.880 8.085 25085
1393 1 3 . 1 1 35 35 ILE HA H 35 3.973 3.973 4.206 -0.233 25085
1394 1 3 . 1 1 35 35 ILE CA C 35 60.500 60.500 58.028 2.473 25085
1395 1 3 . 1 1 35 35 ILE CB C 35 38.822 38.822 38.749 0.073 25085
1396 1 3 . 1 1 35 35 ILE H H 35 10.032 10.032 8.372 1.660 25085
1397 1 3 . 1 1 36 36 PRO HA H 36 4.033 4.033 3.998 0.034 25085
1398 1 3 . 1 1 36 36 PRO C C 36 177.308 177.308 175.819 1.489 25085
1399 1 3 . 1 1 36 36 PRO CA C 36 66.191 66.191 63.686 2.505 25085
1400 1 3 . 1 1 36 36 PRO CB C 36 31.701 31.701 30.674 1.026 25085
1401 1 3 . 1 1 37 37 GLU N N 37 113.735 113.735 116.447 -2.712 25085
1402 1 3 . 1 1 37 37 GLU HA H 37 4.083 4.083 4.471 -0.388 25085
1403 1 3 . 1 1 37 37 GLU C C 37 176.274 176.274 174.502 1.772 25085
1404 1 3 . 1 1 37 37 GLU CA C 37 58.285 58.285 55.541 2.744 25085
1405 1 3 . 1 1 37 37 GLU CB C 37 28.895 28.895 30.281 -1.386 25085
1406 1 3 . 1 1 37 37 GLU H H 37 8.625 8.625 8.293 0.332 25085
1407 1 3 . 1 1 38 38 ALA N N 38 122.325 122.325 121.045 1.280 25085
1408 1 3 . 1 1 38 38 ALA HA H 38 4.484 4.484 4.636 -0.152 25085
1409 1 3 . 1 1 38 38 ALA C C 38 178.043 178.043 174.919 3.124 25085
1410 1 3 . 1 1 38 38 ALA CA C 38 52.385 52.385 51.276 1.109 25085
1411 1 3 . 1 1 38 38 ALA CB C 38 21.151 21.151 22.190 -1.039 25085
1412 1 3 . 1 1 38 38 ALA H H 38 8.160 8.160 7.530 0.630 25085
1413 1 3 . 1 1 39 39 ASP N N 39 123.726 123.726 120.931 2.795 25085
1414 1 3 . 1 1 39 39 ASP HA H 39 4.856 4.856 4.811 0.045 25085
1415 1 3 . 1 1 39 39 ASP C C 39 174.077 174.077 175.101 -1.024 25085
1416 1 3 . 1 1 39 39 ASP CA C 39 53.498 53.498 53.763 -0.265 25085
1417 1 3 . 1 1 39 39 ASP CB C 39 45.176 45.176 43.309 1.867 25085
1418 1 3 . 1 1 39 39 ASP H H 39 9.095 9.095 8.689 0.406 25085
1419 1 3 . 1 1 40 40 LEU N N 40 123.111 123.111 126.460 -3.349 25085
1420 1 3 . 1 1 40 40 LEU HA H 40 4.339 4.339 4.368 -0.029 25085
1421 1 3 . 1 1 40 40 LEU C C 40 176.159 176.159 175.258 0.901 25085
1422 1 3 . 1 1 40 40 LEU CA C 40 54.766 54.766 54.918 -0.152 25085
1423 1 3 . 1 1 40 40 LEU CB C 40 41.988 41.988 42.822 -0.834 25085
1424 1 3 . 1 1 40 40 LEU H H 40 8.199 8.199 8.649 -0.450 25085
1425 1 3 . 1 1 41 41 ALA N N 41 130.678 130.678 130.431 0.247 25085
1426 1 3 . 1 1 41 41 ALA HA H 41 4.430 4.430 4.734 -0.304 25085
1427 1 3 . 1 1 41 41 ALA CA C 41 49.844 49.844 49.469 0.375 25085
1428 1 3 . 1 1 41 41 ALA CB C 41 18.765 18.765 19.747 -0.982 25085
1429 1 3 . 1 1 41 41 ALA H H 41 8.705 8.705 8.317 0.388 25085
1430 1 3 . 1 1 42 42 PRO HA H 42 4.133 4.133 4.481 -0.348 25085
1431 1 3 . 1 1 42 42 PRO C C 42 178.946 178.946 178.067 0.879 25085
1432 1 3 . 1 1 42 42 PRO CA C 42 62.119 62.119 63.031 -0.912 25085
1433 1 3 . 1 1 42 42 PRO CB C 42 33.383 33.383 31.802 1.581 25085
1434 1 3 . 1 1 43 43 LEU N N 43 124.604 124.604 124.355 0.249 25085
1435 1 3 . 1 1 43 43 LEU HA H 43 3.881 3.881 3.881 0.000 25085
1436 1 3 . 1 1 43 43 LEU C C 43 176.869 176.869 177.949 -1.080 25085
1437 1 3 . 1 1 43 43 LEU CA C 43 58.639 58.639 58.125 0.514 25085
1438 1 3 . 1 1 43 43 LEU CB C 43 41.848 41.848 41.466 0.382 25085
1439 1 3 . 1 1 43 43 LEU H H 43 8.330 8.330 8.690 -0.360 25085
1440 1 3 . 1 1 44 44 SER N N 44 110.167 110.167 113.726 -3.559 25085
1441 1 3 . 1 1 44 44 SER HA H 44 4.147 4.147 4.126 0.021 25085
1442 1 3 . 1 1 44 44 SER C C 44 177.107 177.107 176.588 0.519 25085
1443 1 3 . 1 1 44 44 SER CA C 44 61.043 61.043 60.769 0.274 25085
1444 1 3 . 1 1 44 44 SER CB C 44 61.765 61.765 62.855 -1.090 25085
1445 1 3 . 1 1 44 44 SER H H 44 8.553 8.553 7.901 0.652 25085
1446 1 3 . 1 1 45 45 VAL N N 45 123.549 123.549 123.468 0.081 25085
1447 1 3 . 1 1 45 45 VAL HA H 45 3.825 3.825 3.763 0.062 25085
1448 1 3 . 1 1 45 45 VAL C C 45 178.328 178.328 177.268 1.060 25085
1449 1 3 . 1 1 45 45 VAL CA C 45 65.576 65.576 66.013 -0.437 25085
1450 1 3 . 1 1 45 45 VAL CB C 45 31.889 31.889 31.832 0.057 25085
1451 1 3 . 1 1 45 45 VAL H H 45 7.181 7.181 8.465 -1.284 25085
1452 1 3 . 1 1 46 46 LEU N N 46 120.336 120.336 120.724 -0.388 25085
1453 1 3 . 1 1 46 46 LEU HA H 46 3.826 3.826 4.001 -0.175 25085
1454 1 3 . 1 1 46 46 LEU C C 46 179.996 179.996 178.707 1.289 25085
1455 1 3 . 1 1 46 46 LEU CA C 46 57.602 57.602 58.159 -0.557 25085
1456 1 3 . 1 1 46 46 LEU CB C 46 41.691 41.691 42.066 -0.375 25085
1457 1 3 . 1 1 46 46 LEU H H 46 8.040 8.040 7.688 0.352 25085
1458 1 3 . 1 1 47 47 GLU N N 47 115.713 115.713 118.147 -2.434 25085
1459 1 3 . 1 1 47 47 GLU HA H 47 3.820 3.820 3.993 -0.173 25085
1460 1 3 . 1 1 47 47 GLU C C 47 177.029 177.029 178.330 -1.301 25085
1461 1 3 . 1 1 47 47 GLU CA C 47 59.317 59.317 59.017 0.300 25085
1462 1 3 . 1 1 47 47 GLU CB C 47 30.526 30.526 29.774 0.752 25085
1463 1 3 . 1 1 47 47 GLU H H 47 8.567 8.567 7.850 0.717 25085
1464 1 3 . 1 1 48 48 GLN N N 48 116.740 116.740 115.537 1.203 25085
1465 1 3 . 1 1 48 48 GLN HA H 48 4.281 4.281 4.323 -0.042 25085
1466 1 3 . 1 1 48 48 GLN C C 48 177.605 177.605 177.356 0.249 25085
1467 1 3 . 1 1 48 48 GLN CA C 48 57.827 57.827 57.420 0.407 25085
1468 1 3 . 1 1 48 48 GLN CB C 48 29.985 29.985 29.131 0.854 25085
1469 1 3 . 1 1 48 48 GLN H H 48 7.472 7.472 7.735 -0.263 25085
1470 1 3 . 1 1 49 49 SER N N 49 111.004 111.004 114.667 -3.663 25085
1471 1 3 . 1 1 49 49 SER HA H 49 4.648 4.648 4.443 0.205 25085
1472 1 3 . 1 1 49 49 SER C C 49 174.859 174.859 175.229 -0.370 25085
1473 1 3 . 1 1 49 49 SER CA C 49 58.406 58.406 58.938 -0.532 25085
1474 1 3 . 1 1 49 49 SER CB C 49 64.758 64.758 64.379 0.379 25085
1475 1 3 . 1 1 49 49 SER H H 49 8.657 8.657 8.281 0.376 25085
1476 1 3 . 1 1 50 50 GLY N N 50 110.839 110.839 110.662 0.177 25085
1477 1 3 . 1 1 50 50 GLY C C 50 172.398 172.398 173.982 -1.584 25085
1478 1 3 . 1 1 50 50 GLY CA C 50 44.444 44.444 45.481 -1.038 25085
1479 1 3 . 1 1 50 50 GLY H H 50 7.846 7.846 7.850 -0.004 25085
1480 1 3 . 1 1 51 51 LEU N N 51 121.009 121.009 123.168 -2.159 25085
1481 1 3 . 1 1 51 51 LEU HA H 51 4.244 4.244 4.752 -0.508 25085
1482 1 3 . 1 1 51 51 LEU CA C 51 52.593 52.593 52.023 0.570 25085
1483 1 3 . 1 1 51 51 LEU CB C 51 43.381 43.381 43.519 -0.138 25085
1484 1 3 . 1 1 51 51 LEU H H 51 8.647 8.647 7.819 0.828 25085
1485 1 3 . 1 1 52 52 PRO HA H 52 4.349 4.349 4.683 -0.334 25085
1486 1 3 . 1 1 52 52 PRO C C 52 177.247 177.247 177.325 -0.078 25085
1487 1 3 . 1 1 52 52 PRO CA C 52 62.980 62.980 62.152 0.828 25085
1488 1 3 . 1 1 52 52 PRO CB C 52 32.423 32.423 30.301 2.122 25085
1489 1 3 . 1 1 53 53 ALA N N 53 126.595 126.595 125.641 0.954 25085
1490 1 3 . 1 1 53 53 ALA HA H 53 3.870 3.870 3.919 -0.049 25085
1491 1 3 . 1 1 53 53 ALA C C 53 180.484 180.484 179.251 1.233 25085
1492 1 3 . 1 1 53 53 ALA CA C 53 55.829 55.829 55.148 0.681 25085
1493 1 3 . 1 1 53 53 ALA CB C 53 18.248 18.248 18.494 -0.246 25085
1494 1 3 . 1 1 53 53 ALA H H 53 8.643 8.643 8.314 0.329 25085
1495 1 3 . 1 1 54 54 LYS N N 54 113.898 113.898 119.021 -5.123 25085
1496 1 3 . 1 1 54 54 LYS HA H 54 4.167 4.167 4.106 0.061 25085
1497 1 3 . 1 1 54 54 LYS C C 54 176.704 176.704 178.785 -2.081 25085
1498 1 3 . 1 1 54 54 LYS CA C 54 57.893 57.893 58.605 -0.712 25085
1499 1 3 . 1 1 54 54 LYS CB C 54 31.892 31.892 32.192 -0.300 25085
1500 1 3 . 1 1 54 54 LYS H H 54 8.442 8.442 8.012 0.430 25085
1501 1 3 . 1 1 55 55 LEU N N 55 117.932 117.932 119.291 -1.359 25085
1502 1 3 . 1 1 55 55 LEU HA H 55 4.308 4.308 4.291 0.017 25085
1503 1 3 . 1 1 55 55 LEU C C 55 174.589 174.589 177.697 -3.108 25085
1504 1 3 . 1 1 55 55 LEU CA C 55 54.003 54.003 56.558 -2.555 25085
1505 1 3 . 1 1 55 55 LEU CB C 55 41.649 41.649 42.330 -0.681 25085
1506 1 3 . 1 1 55 55 LEU H H 55 7.805 7.805 8.524 -0.719 25085
1507 1 3 . 1 1 56 56 ARG N N 56 116.873 116.873 117.600 -0.727 25085
1508 1 3 . 1 1 56 56 ARG HA H 56 4.006 4.006 4.439 -0.433 25085
1509 1 3 . 1 1 56 56 ARG C C 56 175.542 175.542 175.597 -0.055 25085
1510 1 3 . 1 1 56 56 ARG CA C 56 57.428 57.428 55.925 1.503 25085
1511 1 3 . 1 1 56 56 ARG CB C 56 29.651 29.651 31.081 -1.430 25085
1512 1 3 . 1 1 56 56 ARG H H 56 6.971 6.971 8.312 -1.341 25085
1513 1 3 . 1 1 57 57 HIS N N 57 122.622 122.622 117.142 5.480 25085
1514 1 3 . 1 1 57 57 HIS HA H 57 4.596 4.596 4.575 0.021 25085
1515 1 3 . 1 1 57 57 HIS C C 57 173.855 173.855 173.051 0.804 25085
1516 1 3 . 1 1 57 57 HIS CA C 57 55.780 55.780 56.294 -0.514 25085
1517 1 3 . 1 1 57 57 HIS CB C 57 33.878 33.878 30.954 2.924 25085
1518 1 3 . 1 1 57 57 HIS H H 57 7.281 7.281 7.538 -0.257 25085
1519 1 3 . 1 1 58 58 GLU N N 58 120.479 120.479 119.177 1.302 25085
1520 1 3 . 1 1 58 58 GLU HA H 58 4.052 4.052 4.468 -0.416 25085
1521 1 3 . 1 1 58 58 GLU C C 58 176.762 176.762 175.258 1.504 25085
1522 1 3 . 1 1 58 58 GLU CA C 58 59.634 59.634 56.268 3.366 25085
1523 1 3 . 1 1 58 58 GLU CB C 58 29.931 29.931 31.477 -1.546 25085
1524 1 3 . 1 1 58 58 GLU H H 58 7.626 7.626 8.492 -0.866 25085
1525 1 3 . 1 1 59 59 GLN N N 59 118.110 118.110 118.288 -0.178 25085
1526 1 3 . 1 1 59 59 GLN HA H 59 5.479 5.479 5.200 0.279 25085
1527 1 3 . 1 1 59 59 GLN C C 59 174.322 174.322 175.050 -0.728 25085
1528 1 3 . 1 1 59 59 GLN CA C 59 55.486 55.486 55.125 0.361 25085
1529 1 3 . 1 1 59 59 GLN CB C 59 33.151 33.151 31.786 1.365 25085
1530 1 3 . 1 1 59 59 GLN H H 59 8.560 8.560 8.191 0.369 25085
1531 1 3 . 1 1 60 60 ILE N N 60 122.789 122.789 122.281 0.508 25085
1532 1 3 . 1 1 60 60 ILE HA H 60 4.531 4.531 4.785 -0.254 25085
1533 1 3 . 1 1 60 60 ILE C C 60 173.352 173.352 174.399 -1.047 25085
1534 1 3 . 1 1 60 60 ILE CA C 60 59.794 59.794 60.016 -0.222 25085
1535 1 3 . 1 1 60 60 ILE CB C 60 43.188 43.188 41.518 1.670 25085
1536 1 3 . 1 1 60 60 ILE H H 60 8.735 8.735 8.336 0.399 25085
1537 1 3 . 1 1 61 61 ILE N N 61 125.871 125.871 121.013 4.858 25085
1538 1 3 . 1 1 61 61 ILE HA H 61 5.002 5.002 4.881 0.121 25085
1539 1 3 . 1 1 61 61 ILE C C 61 175.195 175.195 174.319 0.876 25085
1540 1 3 . 1 1 61 61 ILE CA C 61 58.419 58.419 59.538 -1.119 25085
1541 1 3 . 1 1 61 61 ILE CB C 61 40.270 40.270 41.910 -1.640 25085
1542 1 3 . 1 1 61 61 ILE H H 61 9.057 9.057 8.895 0.162 25085
1543 1 3 . 1 1 62 62 PHE N N 62 123.742 123.742 123.767 -0.025 25085
1544 1 3 . 1 1 62 62 PHE HA H 62 5.810 5.810 5.776 0.035 25085
1545 1 3 . 1 1 62 62 PHE C C 62 176.135 176.135 174.645 1.490 25085
1546 1 3 . 1 1 62 62 PHE CA C 62 56.960 56.960 55.974 0.986 25085
1547 1 3 . 1 1 62 62 PHE CB C 62 43.352 43.352 42.560 0.792 25085
1548 1 3 . 1 1 62 62 PHE H H 62 8.977 8.977 8.309 0.668 25085
1549 1 3 . 1 1 63 63 HIS N N 63 116.939 116.939 116.779 0.160 25085
1550 1 3 . 1 1 63 63 HIS HA H 63 5.979 5.979 5.168 0.811 25085
1551 1 3 . 1 1 63 63 HIS C C 63 171.108 171.108 173.166 -2.058 25085
1552 1 3 . 1 1 63 63 HIS CA C 63 54.115 54.115 54.860 -0.745 25085
1553 1 3 . 1 1 63 63 HIS CB C 63 36.861 36.861 31.708 5.153 25085
1554 1 3 . 1 1 63 63 HIS H H 63 9.298 9.298 8.614 0.684 25085
1555 1 3 . 1 1 64 64 CYS N N 64 119.251 119.251 123.069 -3.818 25085
1556 1 3 . 1 1 64 64 CYS HA H 64 5.044 5.044 4.669 0.375 25085
1557 1 3 . 1 1 64 64 CYS C C 64 177.438 177.438 175.831 1.607 25085
1558 1 3 . 1 1 64 64 CYS CA C 64 56.886 56.886 56.975 -0.089 25085
1559 1 3 . 1 1 64 64 CYS CB C 64 29.425 29.425 32.101 -2.676 25085
1560 1 3 . 1 1 64 64 CYS H H 64 8.156 8.156 8.683 -0.527 25085
1561 1 3 . 1 1 65 65 GLN N N 65 125.627 125.627 123.690 1.937 25085
1562 1 3 . 1 1 65 65 GLN HA H 65 4.220 4.220 3.960 0.260 25085
1563 1 3 . 1 1 65 65 GLN C C 65 174.440 174.440 175.603 -1.163 25085
1564 1 3 . 1 1 65 65 GLN CA C 65 59.788 59.788 59.934 -0.146 25085
1565 1 3 . 1 1 65 65 GLN CB C 65 29.370 29.370 28.896 0.474 25085
1566 1 3 . 1 1 65 65 GLN H H 65 8.937 8.937 9.076 -0.139 25085
1567 1 3 . 1 1 66 66 ALA N N 66 118.880 118.880 117.216 1.664 25085
1568 1 3 . 1 1 66 66 ALA HA H 66 5.115 5.115 4.942 0.173 25085
1569 1 3 . 1 1 66 66 ALA C C 66 177.625 177.625 177.180 0.445 25085
1570 1 3 . 1 1 66 66 ALA CA C 66 50.744 50.744 52.505 -1.761 25085
1571 1 3 . 1 1 66 66 ALA CB C 66 20.658 20.658 20.251 0.407 25085
1572 1 3 . 1 1 66 66 ALA H H 66 9.024 9.024 8.264 0.760 25085
1573 1 3 . 1 1 67 67 GLY N N 67 112.878 112.878 106.801 6.077 25085
1574 1 3 . 1 1 67 67 GLY C C 67 174.810 174.810 175.114 -0.304 25085
1575 1 3 . 1 1 67 67 GLY CA C 67 45.642 45.642 45.418 0.224 25085
1576 1 3 . 1 1 67 67 GLY H H 67 8.845 8.845 7.816 1.029 25085
1577 1 3 . 1 1 68 68 LYS N N 68 120.133 120.133 120.979 -0.846 25085
1578 1 3 . 1 1 68 68 LYS HA H 68 4.158 4.158 3.975 0.183 25085
1579 1 3 . 1 1 68 68 LYS C C 68 177.939 177.939 178.104 -0.165 25085
1580 1 3 . 1 1 68 68 LYS CA C 68 58.811 58.811 58.865 -0.054 25085
1581 1 3 . 1 1 68 68 LYS CB C 68 32.796 32.796 32.397 0.400 25085
1582 1 3 . 1 1 68 68 LYS H H 68 7.936 7.936 8.404 -0.468 25085
1583 1 3 . 1 1 69 69 ARG N N 69 125.804 125.804 116.487 9.317 25085
1584 1 3 . 1 1 69 69 ARG HA H 69 4.217 4.217 4.303 -0.086 25085
1585 1 3 . 1 1 69 69 ARG C C 69 180.944 180.944 178.153 2.791 25085
1586 1 3 . 1 1 69 69 ARG CA C 69 60.010 60.010 58.970 1.040 25085
1587 1 3 . 1 1 69 69 ARG CB C 69 30.974 30.974 29.613 1.361 25085
1588 1 3 . 1 1 69 69 ARG H H 69 8.981 8.981 8.285 0.696 25085
1589 1 3 . 1 1 70 70 THR N N 70 116.681 116.681 115.664 1.017 25085
1590 1 3 . 1 1 70 70 THR HA H 70 3.607 3.607 3.965 -0.358 25085
1591 1 3 . 1 1 70 70 THR C C 70 176.434 176.434 176.481 -0.047 25085
1592 1 3 . 1 1 70 70 THR CA C 70 65.914 65.914 66.669 -0.755 25085
1593 1 3 . 1 1 70 70 THR CB C 70 68.169 68.169 68.155 0.014 25085
1594 1 3 . 1 1 70 70 THR H H 70 10.382 10.382 8.283 2.099 25085
1595 1 3 . 1 1 71 71 SER N N 71 113.046 113.046 116.356 -3.310 25085
1596 1 3 . 1 1 71 71 SER HA H 71 3.993 3.993 4.188 -0.195 25085
1597 1 3 . 1 1 71 71 SER C C 71 177.594 177.594 175.905 1.689 25085
1598 1 3 . 1 1 71 71 SER CA C 71 62.500 62.500 61.210 1.290 25085
1599 1 3 . 1 1 71 71 SER H H 71 7.346 7.346 8.031 -0.685 25085
1600 1 3 . 1 1 72 72 ASN N N 72 117.540 117.540 118.239 -0.699 25085
1601 1 3 . 1 1 72 72 ASN HA H 72 4.598 4.598 4.589 0.009 25085
1602 1 3 . 1 1 72 72 ASN C C 72 175.595 175.595 175.983 -0.388 25085
1603 1 3 . 1 1 72 72 ASN CA C 72 55.147 55.147 55.415 -0.268 25085
1604 1 3 . 1 1 72 72 ASN CB C 72 38.821 38.821 38.904 -0.083 25085
1605 1 3 . 1 1 72 72 ASN H H 72 8.078 8.078 7.434 0.644 25085
1606 1 3 . 1 1 73 73 ASN N N 73 114.869 114.869 117.578 -2.709 25085
1607 1 3 . 1 1 73 73 ASN HA H 73 5.159 5.159 4.632 0.527 25085
1608 1 3 . 1 1 73 73 ASN C C 73 174.375 174.375 176.308 -1.933 25085
1609 1 3 . 1 1 73 73 ASN CA C 73 52.976 52.976 53.790 -0.814 25085
1610 1 3 . 1 1 73 73 ASN CB C 73 39.862 39.862 39.268 0.594 25085
1611 1 3 . 1 1 73 73 ASN H H 73 7.290 7.290 8.049 -0.759 25085
1612 1 3 . 1 1 74 74 ALA N N 74 124.647 124.647 123.029 1.618 25085
1613 1 3 . 1 1 74 74 ALA HA H 74 3.721 3.721 3.865 -0.144 25085
1614 1 3 . 1 1 74 74 ALA C C 74 177.908 177.908 178.884 -0.976 25085
1615 1 3 . 1 1 74 74 ALA CA C 74 57.085 57.085 55.686 1.399 25085
1616 1 3 . 1 1 74 74 ALA CB C 74 19.427 19.427 18.225 1.202 25085
1617 1 3 . 1 1 74 74 ALA H H 74 7.105 7.105 8.633 -1.528 25085
1618 1 3 . 1 1 75 75 ASP N N 75 114.917 114.917 116.173 -1.256 25085
1619 1 3 . 1 1 75 75 ASP HA H 75 4.250 4.250 4.492 -0.242 25085
1620 1 3 . 1 1 75 75 ASP C C 75 179.100 179.100 178.310 0.790 25085
1621 1 3 . 1 1 75 75 ASP CA C 75 57.236 57.236 56.862 0.374 25085
1622 1 3 . 1 1 75 75 ASP CB C 75 39.783 39.783 40.407 -0.624 25085
1623 1 3 . 1 1 75 75 ASP H H 75 8.403 8.403 8.449 -0.046 25085
1624 1 3 . 1 1 76 76 LYS N N 76 121.888 121.888 120.426 1.462 25085
1625 1 3 . 1 1 76 76 LYS HA H 76 4.053 4.053 4.162 -0.109 25085
1626 1 3 . 1 1 76 76 LYS C C 76 178.832 178.832 178.837 -0.005 25085
1627 1 3 . 1 1 76 76 LYS CA C 76 58.864 58.864 57.985 0.879 25085
1628 1 3 . 1 1 76 76 LYS CB C 76 32.423 32.423 32.383 0.040 25085
1629 1 3 . 1 1 76 76 LYS H H 76 7.652 7.652 7.876 -0.224 25085
1630 1 3 . 1 1 77 77 LEU N N 77 118.644 118.644 119.944 -1.300 25085
1631 1 3 . 1 1 77 77 LEU HA H 77 3.557 3.557 3.914 -0.357 25085
1632 1 3 . 1 1 77 77 LEU C C 77 178.068 178.068 178.740 -0.672 25085
1633 1 3 . 1 1 77 77 LEU CA C 77 57.692 57.692 58.030 -0.338 25085
1634 1 3 . 1 1 77 77 LEU CB C 77 40.077 40.077 41.063 -0.987 25085
1635 1 3 . 1 1 77 77 LEU H H 77 8.146 8.146 8.517 -0.371 25085
1636 1 3 . 1 1 78 78 ALA N N 78 119.668 119.668 120.038 -0.370 25085
1637 1 3 . 1 1 78 78 ALA HA H 78 3.990 3.990 3.915 0.075 25085
1638 1 3 . 1 1 78 78 ALA C C 78 179.542 179.542 178.452 1.090 25085
1639 1 3 . 1 1 78 78 ALA CA C 78 54.937 54.937 54.598 0.339 25085
1640 1 3 . 1 1 78 78 ALA CB C 78 18.080 18.080 18.133 -0.053 25085
1641 1 3 . 1 1 78 78 ALA H H 78 8.136 8.136 7.602 0.534 25085
1642 1 3 . 1 1 79 79 ALA N N 79 118.918 118.918 120.091 -1.173 25085
1643 1 3 . 1 1 79 79 ALA HA H 79 4.139 4.139 4.085 0.054 25085
1644 1 3 . 1 1 79 79 ALA C C 79 180.800 180.800 179.942 0.858 25085
1645 1 3 . 1 1 79 79 ALA CA C 79 54.571 54.571 54.521 0.050 25085
1646 1 3 . 1 1 79 79 ALA CB C 79 18.268 18.268 18.505 -0.237 25085
1647 1 3 . 1 1 79 79 ALA H H 79 7.319 7.319 7.450 -0.131 25085
1648 1 3 . 1 1 80 80 ILE N N 80 118.438 118.438 118.363 0.075 25085
1649 1 3 . 1 1 80 80 ILE HA H 80 3.801 3.801 3.897 -0.096 25085
1650 1 3 . 1 1 80 80 ILE C C 80 177.302 177.302 177.193 0.109 25085
1651 1 3 . 1 1 80 80 ILE CA C 80 64.252 64.252 63.413 0.839 25085
1652 1 3 . 1 1 80 80 ILE CB C 80 39.115 39.115 37.347 1.768 25085
1653 1 3 . 1 1 80 80 ILE H H 80 8.227 8.227 7.731 0.496 25085
1654 1 3 . 1 1 81 81 ALA N N 81 117.917 117.917 120.512 -2.595 25085
1655 1 3 . 1 1 81 81 ALA HA H 81 4.466 4.466 4.292 0.174 25085
1656 1 3 . 1 1 81 81 ALA C C 81 176.153 176.153 176.799 -0.646 25085
1657 1 3 . 1 1 81 81 ALA CA C 81 51.404 51.404 51.940 -0.536 25085
1658 1 3 . 1 1 81 81 ALA CB C 81 20.200 20.200 18.798 1.402 25085
1659 1 3 . 1 1 81 81 ALA H H 81 7.913 7.913 8.148 -0.235 25085
1660 1 3 . 1 1 82 82 ALA N N 82 124.086 124.086 121.741 2.345 25085
1661 1 3 . 1 1 82 82 ALA HA H 82 4.457 4.457 4.058 0.399 25085
1662 1 3 . 1 1 82 82 ALA CA C 82 52.276 52.276 52.698 -0.422 25085
1663 1 3 . 1 1 82 82 ALA CB C 82 17.243 17.243 16.646 0.597 25085
1664 1 3 . 1 1 82 82 ALA H H 82 7.223 7.223 7.371 -0.148 25085
1665 1 3 . 1 1 83 83 PRO HA H 83 4.692 4.692 4.300 0.392 25085
1666 1 3 . 1 1 83 83 PRO C C 83 175.169 175.169 175.766 -0.597 25085
1667 1 3 . 1 1 83 83 PRO CA C 83 63.767 63.767 63.218 0.549 25085
1668 1 3 . 1 1 83 83 PRO CB C 83 32.624 32.624 30.448 2.176 25085
1669 1 3 . 1 1 84 84 ALA N N 84 127.741 127.741 122.085 5.656 25085
1670 1 3 . 1 1 84 84 ALA HA H 84 4.138 4.138 4.292 -0.154 25085
1671 1 3 . 1 1 84 84 ALA C C 84 176.494 176.494 177.402 -0.908 25085
1672 1 3 . 1 1 84 84 ALA CA C 84 53.432 53.432 51.625 1.807 25085
1673 1 3 . 1 1 84 84 ALA CB C 84 19.719 19.719 20.031 -0.312 25085
1674 1 3 . 1 1 84 84 ALA H H 84 8.528 8.528 7.820 0.708 25085
1675 1 3 . 1 1 85 85 GLU N N 85 121.634 121.634 119.298 2.336 25085
1676 1 3 . 1 1 85 85 GLU HA H 85 4.228 4.228 4.455 -0.227 25085
1677 1 3 . 1 1 85 85 GLU C C 85 175.094 175.094 174.472 0.622 25085
1678 1 3 . 1 1 85 85 GLU CA C 85 56.444 56.444 55.046 1.398 25085
1679 1 3 . 1 1 85 85 GLU CB C 85 30.803 30.803 29.822 0.981 25085
1680 1 3 . 1 1 85 85 GLU H H 85 8.166 8.166 8.216 -0.050 25085
1681 1 3 . 1 1 86 86 ILE N N 86 122.543 122.543 123.762 -1.219 25085
1682 1 3 . 1 1 86 86 ILE HA H 86 5.269 5.269 4.957 0.312 25085
1683 1 3 . 1 1 86 86 ILE C C 86 174.463 174.463 174.809 -0.346 25085
1684 1 3 . 1 1 86 86 ILE CA C 86 59.329 59.329 59.980 -0.651 25085
1685 1 3 . 1 1 86 86 ILE CB C 86 40.546 40.546 40.019 0.527 25085
1686 1 3 . 1 1 86 86 ILE H H 86 7.925 7.925 8.011 -0.086 25085
1687 1 3 . 1 1 87 87 PHE N N 87 122.457 122.457 124.778 -2.321 25085
1688 1 3 . 1 1 87 87 PHE HA H 87 5.428 5.428 5.668 -0.240 25085
1689 1 3 . 1 1 87 87 PHE C C 87 174.450 174.450 174.757 -0.307 25085
1690 1 3 . 1 1 87 87 PHE CA C 87 55.029 55.029 55.982 -0.953 25085
1691 1 3 . 1 1 87 87 PHE CB C 87 43.626 43.626 42.740 0.886 25085
1692 1 3 . 1 1 87 87 PHE H H 87 9.050 9.050 8.488 0.562 25085
1693 1 3 . 1 1 88 88 LEU N N 88 119.959 119.959 121.028 -1.069 25085
1694 1 3 . 1 1 88 88 LEU HA H 88 5.358 5.358 5.064 0.294 25085
1695 1 3 . 1 1 88 88 LEU C C 88 176.627 176.627 174.547 2.080 25085
1696 1 3 . 1 1 88 88 LEU CA C 88 52.654 52.654 53.783 -1.129 25085
1697 1 3 . 1 1 88 88 LEU CB C 88 43.094 43.094 46.551 -3.457 25085
1698 1 3 . 1 1 88 88 LEU H H 88 8.824 8.824 8.941 -0.117 25085
1699 1 3 . 1 1 89 89 LEU N N 89 124.096 124.096 127.646 -3.550 25085
1700 1 3 . 1 1 89 89 LEU HA H 89 4.432 4.432 5.137 -0.705 25085
1701 1 3 . 1 1 89 89 LEU C C 89 176.693 176.693 175.722 0.971 25085
1702 1 3 . 1 1 89 89 LEU CA C 89 55.385 55.385 53.712 1.673 25085
1703 1 3 . 1 1 89 89 LEU CB C 89 43.537 43.537 43.499 0.037 25085
1704 1 3 . 1 1 89 89 LEU H H 89 8.293 8.293 8.149 0.144 25085
1705 1 3 . 1 1 90 90 GLU N N 90 102.942 102.942 127.146 -24.204 25085
1706 1 3 . 1 1 90 90 GLU HA H 90 3.895 3.895 4.181 -0.286 25085
1707 1 3 . 1 1 90 90 GLU C C 90 175.199 175.199 177.144 -1.945 25085
1708 1 3 . 1 1 90 90 GLU CA C 90 58.586 58.586 58.437 0.149 25085
1709 1 3 . 1 1 90 90 GLU CB C 90 30.831 30.831 30.623 0.208 25085
1710 1 3 . 1 1 90 90 GLU H H 90 9.394 9.394 8.024 1.370 25085
1711 1 3 . 1 1 91 91 ASP N N 91 120.515 120.515 119.434 1.081 25085
1712 1 3 . 1 1 91 91 ASP HA H 91 4.184 4.184 4.255 -0.071 25085
1713 1 3 . 1 1 91 91 ASP C C 91 176.159 176.159 176.148 0.011 25085
1714 1 3 . 1 1 91 91 ASP CA C 91 55.814 55.814 55.489 0.325 25085
1715 1 3 . 1 1 91 91 ASP CB C 91 39.033 39.033 40.279 -1.246 25085
1716 1 3 . 1 1 91 91 ASP H H 91 9.210 9.210 8.844 0.366 25085
1717 1 3 . 1 1 92 92 GLY N N 92 104.313 104.313 106.834 -2.521 25085
1718 1 3 . 1 1 92 92 GLY C C 92 172.980 172.980 175.080 -2.100 25085
1719 1 3 . 1 1 92 92 GLY CA C 92 46.946 46.946 44.574 2.372 25085
1720 1 3 . 1 1 92 92 GLY H H 92 7.902 7.902 7.813 0.089 25085
1721 1 3 . 1 1 93 93 ILE N N 93 121.445 121.445 121.776 -0.331 25085
1722 1 3 . 1 1 93 93 ILE HA H 93 3.902 3.902 3.851 0.051 25085
1723 1 3 . 1 1 93 93 ILE C C 93 176.528 176.528 176.557 -0.029 25085
1724 1 3 . 1 1 93 93 ILE CA C 93 63.908 63.908 64.068 -0.160 25085
1725 1 3 . 1 1 93 93 ILE CB C 93 38.416 38.416 38.148 0.268 25085
1726 1 3 . 1 1 93 93 ILE H H 93 8.129 8.129 8.715 -0.586 25085
1727 1 3 . 1 1 94 94 ASP N N 94 126.304 126.304 120.113 6.191 25085
1728 1 3 . 1 1 94 94 ASP HA H 94 4.436 4.436 4.360 0.076 25085
1729 1 3 . 1 1 94 94 ASP C C 94 180.174 180.174 178.167 2.007 25085
1730 1 3 . 1 1 94 94 ASP CA C 94 58.351 58.351 57.647 0.704 25085
1731 1 3 . 1 1 94 94 ASP CB C 94 39.223 39.223 40.614 -1.391 25085
1732 1 3 . 1 1 94 94 ASP H H 94 9.161 9.161 8.574 0.587 25085
1733 1 3 . 1 1 95 95 GLY N N 95 110.690 110.690 107.117 3.573 25085
1734 1 3 . 1 1 95 95 GLY C C 95 176.108 176.108 175.399 0.709 25085
1735 1 3 . 1 1 95 95 GLY CA C 95 46.873 46.873 46.246 0.627 25085
1736 1 3 . 1 1 95 95 GLY H H 95 8.080 8.080 8.704 -0.624 25085
1737 1 3 . 1 1 96 96 TRP N N 96 126.965 126.965 123.873 3.092 25085
1738 1 3 . 1 1 96 96 TRP HA H 96 3.795 3.795 4.213 -0.418 25085
1739 1 3 . 1 1 96 96 TRP C C 96 177.058 177.058 177.596 -0.538 25085
1740 1 3 . 1 1 96 96 TRP CA C 96 61.633 61.633 61.444 0.189 25085
1741 1 3 . 1 1 96 96 TRP CB C 96 29.512 29.512 29.472 0.040 25085
1742 1 3 . 1 1 96 96 TRP H H 96 8.007 8.007 7.687 0.320 25085
1743 1 3 . 1 1 97 97 LYS N N 97 116.604 116.604 118.469 -1.865 25085
1744 1 3 . 1 1 97 97 LYS HA H 97 4.090 4.090 4.455 -0.365 25085
1745 1 3 . 1 1 97 97 LYS C C 97 182.010 182.010 179.575 2.435 25085
1746 1 3 . 1 1 97 97 LYS CA C 97 59.776 59.776 58.789 0.987 25085
1747 1 3 . 1 1 97 97 LYS CB C 97 32.208 32.208 32.508 -0.299 25085
1748 1 3 . 1 1 97 97 LYS H H 97 8.696 8.696 7.766 0.930 25085
1749 1 3 . 1 1 98 98 ARG N N 98 122.491 122.491 119.640 2.851 25085
1750 1 3 . 1 1 98 98 ARG HA H 98 4.050 4.050 4.036 0.014 25085
1751 1 3 . 1 1 98 98 ARG C C 98 177.666 177.666 178.563 -0.897 25085
1752 1 3 . 1 1 98 98 ARG CA C 98 59.509 59.509 58.460 1.049 25085
1753 1 3 . 1 1 98 98 ARG CB C 98 30.471 30.471 30.081 0.390 25085
1754 1 3 . 1 1 98 98 ARG H H 98 8.280 8.280 7.439 0.841 25085
1755 1 3 . 1 1 99 99 ALA N N 99 119.546 119.546 119.115 0.431 25085
1756 1 3 . 1 1 99 99 ALA HA H 99 4.276 4.276 3.929 0.347 25085
1757 1 3 . 1 1 99 99 ALA C C 99 176.800 176.800 177.745 -0.945 25085
1758 1 3 . 1 1 99 99 ALA CA C 99 52.254 52.254 53.783 -1.529 25085
1759 1 3 . 1 1 99 99 ALA CB C 99 18.270 18.270 18.924 -0.654 25085
1760 1 3 . 1 1 99 99 ALA H H 99 7.519 7.519 8.327 -0.808 25085
1761 1 3 . 1 1 100 100 GLY N N 100 106.339 106.339 103.416 2.923 25085
1762 1 3 . 1 1 100 100 GLY C C 100 174.232 174.232 173.406 0.826 25085
1763 1 3 . 1 1 100 100 GLY CA C 100 45.050 45.050 44.551 0.499 25085
1764 1 3 . 1 1 100 100 GLY H H 100 7.926 7.926 7.534 0.392 25085
1765 1 3 . 1 1 101 101 LEU N N 101 122.181 122.181 120.456 1.725 25085
1766 1 3 . 1 1 101 101 LEU HA H 101 4.286 4.286 4.607 -0.321 25085
1767 1 3 . 1 1 101 101 LEU CA C 101 53.183 53.183 50.826 2.357 25085
1768 1 3 . 1 1 101 101 LEU CB C 101 37.320 37.320 42.426 -5.106 25085
1769 1 3 . 1 1 101 101 LEU H H 101 6.976 6.976 7.293 -0.317 25085
1770 1 3 . 1 1 102 102 PRO HA H 102 4.476 4.476 4.433 0.043 25085
1771 1 3 . 1 1 102 102 PRO C C 102 177.424 177.424 176.113 1.311 25085
1772 1 3 . 1 1 102 102 PRO CA C 102 64.014 64.014 62.759 1.255 25085
1773 1 3 . 1 1 102 102 PRO CB C 102 33.200 33.200 31.949 1.251 25085
1774 1 3 . 1 1 103 103 VAL N N 103 110.512 110.512 114.741 -4.229 25085
1775 1 3 . 1 1 103 103 VAL HA H 103 4.643 4.643 4.489 0.154 25085
1776 1 3 . 1 1 103 103 VAL C C 103 174.297 174.297 174.720 -0.423 25085
1777 1 3 . 1 1 103 103 VAL CA C 103 59.693 59.693 59.618 0.075 25085
1778 1 3 . 1 1 103 103 VAL CB C 103 35.980 35.980 33.718 2.262 25085
1779 1 3 . 1 1 103 103 VAL H H 103 8.073 8.073 8.038 0.035 25085
1780 1 3 . 1 1 104 104 ALA N N 104 125.898 125.898 124.048 1.850 25085
1781 1 3 . 1 1 104 104 ALA HA H 104 4.550 4.550 4.858 -0.308 25085
1782 1 3 . 1 1 104 104 ALA C C 104 176.190 176.190 175.892 0.298 25085
1783 1 3 . 1 1 104 104 ALA CA C 104 50.699 50.699 51.378 -0.679 25085
1784 1 3 . 1 1 104 104 ALA CB C 104 19.534 19.534 21.890 -2.356 25085
1785 1 3 . 1 1 104 104 ALA H H 104 8.996 8.996 8.081 0.915 25085
1786 1 3 . 1 1 105 105 VAL N N 105 119.534 119.534 122.248 -2.714 25085
1787 1 3 . 1 1 105 105 VAL HA H 105 4.615 4.615 4.068 0.547 25085
1788 1 3 . 1 1 105 105 VAL C C 105 175.576 175.576 175.324 0.252 25085
1789 1 3 . 1 1 105 105 VAL CA C 105 60.234 60.234 61.018 -0.784 25085
1790 1 3 . 1 1 105 105 VAL CB C 105 34.683 34.683 33.514 1.169 25085
1791 1 3 . 1 1 105 105 VAL H H 105 8.276 8.276 8.448 -0.172 25085
1792 1 3 . 1 1 106 106 ASN N N 106 123.346 123.346 122.530 0.816 25085
1793 1 3 . 1 1 106 106 ASN HA H 106 4.748 4.748 4.415 0.333 25085
1794 1 3 . 1 1 106 106 ASN C C 106 173.877 173.877 174.322 -0.445 25085
1795 1 3 . 1 1 106 106 ASN CA C 106 53.465 53.465 52.820 0.645 25085
1796 1 3 . 1 1 106 106 ASN CB C 106 39.424 39.424 37.982 1.442 25085
1797 1 3 . 1 1 106 106 ASN H H 106 8.190 8.190 7.909 0.281 25085
1798 1 4 . 1 1 2 2 ALA N N 2 125.104 125.104 121.881 3.223 25085
1799 1 4 . 1 1 2 2 ALA HA H 2 4.287 4.287 4.490 -0.203 25085
1800 1 4 . 1 1 2 2 ALA C C 2 176.800 176.800 176.404 0.396 25085
1801 1 4 . 1 1 2 2 ALA CA C 2 52.429 52.429 51.624 0.805 25085
1802 1 4 . 1 1 2 2 ALA CB C 2 19.407 19.407 19.147 0.260 25085
1803 1 4 . 1 1 2 2 ALA H H 2 8.344 8.344 8.051 0.293 25085
1804 1 4 . 1 1 3 3 LEU N N 3 120.515 120.515 117.731 2.784 25085
1805 1 4 . 1 1 3 3 LEU HA H 3 4.452 4.452 4.340 0.112 25085
1806 1 4 . 1 1 3 3 LEU C C 3 176.497 176.497 176.614 -0.117 25085
1807 1 4 . 1 1 3 3 LEU CA C 3 54.698 54.698 54.952 -0.254 25085
1808 1 4 . 1 1 3 3 LEU CB C 3 43.203 43.203 41.561 1.642 25085
1809 1 4 . 1 1 3 3 LEU H H 3 8.070 8.070 7.438 0.632 25085
1810 1 4 . 1 1 4 4 THR N N 4 117.803 117.803 118.863 -1.060 25085
1811 1 4 . 1 1 4 4 THR HA H 4 4.480 4.480 4.682 -0.202 25085
1812 1 4 . 1 1 4 4 THR C C 4 173.872 173.872 173.664 0.208 25085
1813 1 4 . 1 1 4 4 THR CA C 4 62.247 62.247 60.998 1.250 25085
1814 1 4 . 1 1 4 4 THR CB C 4 70.533 70.533 71.696 -1.163 25085
1815 1 4 . 1 1 4 4 THR H H 4 7.954 7.954 8.206 -0.252 25085
1816 1 4 . 1 1 5 5 THR N N 5 121.501 121.501 115.996 5.505 25085
1817 1 4 . 1 1 5 5 THR HA H 5 5.289 5.289 4.740 0.549 25085
1818 1 4 . 1 1 5 5 THR C C 5 174.162 174.162 173.823 0.339 25085
1819 1 4 . 1 1 5 5 THR CA C 5 62.102 62.102 62.264 -0.162 25085
1820 1 4 . 1 1 5 5 THR CB C 5 69.457 69.457 69.847 -0.390 25085
1821 1 4 . 1 1 5 5 THR H H 5 8.640 8.640 8.489 0.151 25085
1822 1 4 . 1 1 6 6 ILE N N 6 122.023 122.023 122.121 -0.098 25085
1823 1 4 . 1 1 6 6 ILE HA H 6 4.988 4.988 4.672 0.316 25085
1824 1 4 . 1 1 6 6 ILE C C 6 173.377 173.377 173.691 -0.314 25085
1825 1 4 . 1 1 6 6 ILE CA C 6 58.611 58.611 59.679 -1.069 25085
1826 1 4 . 1 1 6 6 ILE CB C 6 42.821 42.821 42.419 0.402 25085
1827 1 4 . 1 1 6 6 ILE H H 6 8.977 8.977 9.222 -0.245 25085
1828 1 4 . 1 1 7 7 SER N N 7 122.659 122.659 119.269 3.390 25085
1829 1 4 . 1 1 7 7 SER HA H 7 4.768 4.768 5.107 -0.339 25085
1830 1 4 . 1 1 7 7 SER CA C 7 56.790 56.790 55.649 1.141 25085
1831 1 4 . 1 1 7 7 SER CB C 7 63.235 63.235 63.058 0.177 25085
1832 1 4 . 1 1 7 7 SER H H 7 9.242 9.242 8.455 0.787 25085
1833 1 4 . 1 1 8 8 PRO HA H 8 4.207 4.207 4.239 -0.032 25085
1834 1 4 . 1 1 8 8 PRO C C 8 176.787 176.787 178.331 -1.544 25085
1835 1 4 . 1 1 8 8 PRO CA C 8 66.443 66.443 65.462 0.981 25085
1836 1 4 . 1 1 8 8 PRO CB C 8 32.724 32.724 31.700 1.024 25085
1837 1 4 . 1 1 9 9 HIS N N 9 113.700 113.700 115.245 -1.545 25085
1838 1 4 . 1 1 9 9 HIS HA H 9 3.990 3.990 4.346 -0.356 25085
1839 1 4 . 1 1 9 9 HIS C C 9 178.123 178.123 177.605 0.518 25085
1840 1 4 . 1 1 9 9 HIS CA C 9 60.827 60.827 58.855 1.972 25085
1841 1 4 . 1 1 9 9 HIS CB C 9 29.552 29.552 29.733 -0.181 25085
1842 1 4 . 1 1 9 9 HIS H H 9 8.172 8.172 8.035 0.137 25085
1843 1 4 . 1 1 10 10 ASP N N 10 120.665 120.665 119.922 0.743 25085
1844 1 4 . 1 1 10 10 ASP HA H 10 4.369 4.369 4.393 -0.024 25085
1845 1 4 . 1 1 10 10 ASP C C 10 179.100 179.100 177.801 1.299 25085
1846 1 4 . 1 1 10 10 ASP CA C 10 57.071 57.071 56.949 0.122 25085
1847 1 4 . 1 1 10 10 ASP CB C 10 39.529 39.529 41.328 -1.799 25085
1848 1 4 . 1 1 10 10 ASP H H 10 7.706 7.706 8.725 -1.019 25085
1849 1 4 . 1 1 11 11 ALA N N 11 123.686 123.686 122.305 1.381 25085
1850 1 4 . 1 1 11 11 ALA HA H 11 3.782 3.782 3.911 -0.129 25085
1851 1 4 . 1 1 11 11 ALA C C 11 178.260 178.260 179.694 -1.434 25085
1852 1 4 . 1 1 11 11 ALA CA C 11 55.142 55.142 55.121 0.021 25085
1853 1 4 . 1 1 11 11 ALA CB C 11 18.293 18.293 18.101 0.192 25085
1854 1 4 . 1 1 11 11 ALA H H 11 8.896 8.896 7.713 1.183 25085
1855 1 4 . 1 1 12 12 GLN N N 12 117.521 117.521 117.664 -0.143 25085
1856 1 4 . 1 1 12 12 GLN HA H 12 4.000 4.000 4.249 -0.249 25085
1857 1 4 . 1 1 12 12 GLN C C 12 178.499 178.499 178.484 0.015 25085
1858 1 4 . 1 1 12 12 GLN CA C 12 60.102 60.102 59.196 0.906 25085
1859 1 4 . 1 1 12 12 GLN CB C 12 28.743 28.743 28.633 0.110 25085
1860 1 4 . 1 1 12 12 GLN H H 12 8.431 8.431 8.106 0.325 25085
1861 1 4 . 1 1 13 13 GLU N N 13 118.578 118.578 119.613 -1.035 25085
1862 1 4 . 1 1 13 13 GLU HA H 13 4.059 4.059 4.113 -0.054 25085
1863 1 4 . 1 1 13 13 GLU C C 13 178.352 178.352 179.651 -1.299 25085
1864 1 4 . 1 1 13 13 GLU CA C 13 59.079 59.079 59.095 -0.016 25085
1865 1 4 . 1 1 13 13 GLU CB C 13 29.213 29.213 29.580 -0.367 25085
1866 1 4 . 1 1 13 13 GLU H H 13 7.234 7.234 8.013 -0.779 25085
1867 1 4 . 1 1 14 14 LEU N N 14 119.848 119.848 120.809 -0.961 25085
1868 1 4 . 1 1 14 14 LEU HA H 14 3.891 3.891 3.971 -0.080 25085
1869 1 4 . 1 1 14 14 LEU C C 14 180.773 180.773 178.875 1.898 25085
1870 1 4 . 1 1 14 14 LEU CA C 14 57.958 57.958 57.771 0.187 25085
1871 1 4 . 1 1 14 14 LEU CB C 14 41.715 41.715 41.614 0.101 25085
1872 1 4 . 1 1 14 14 LEU H H 14 7.582 7.582 8.368 -0.786 25085
1873 1 4 . 1 1 15 15 ILE N N 15 122.392 122.392 117.564 4.828 25085
1874 1 4 . 1 1 15 15 ILE HA H 15 3.924 3.924 3.644 0.280 25085
1875 1 4 . 1 1 15 15 ILE C C 15 180.109 180.109 177.668 2.441 25085
1876 1 4 . 1 1 15 15 ILE CA C 15 64.663 64.663 64.626 0.037 25085
1877 1 4 . 1 1 15 15 ILE CB C 15 38.900 38.900 37.693 1.207 25085
1878 1 4 . 1 1 15 15 ILE H H 15 8.772 8.772 8.130 0.642 25085
1879 1 4 . 1 1 16 16 ALA N N 16 123.856 123.856 120.329 3.527 25085
1880 1 4 . 1 1 16 16 ALA HA H 16 4.183 4.183 4.222 -0.039 25085
1881 1 4 . 1 1 16 16 ALA C C 16 179.100 179.100 178.811 0.289 25085
1882 1 4 . 1 1 16 16 ALA CA C 16 54.806 54.806 54.113 0.693 25085
1883 1 4 . 1 1 16 16 ALA CB C 16 17.646 17.646 18.693 -1.047 25085
1884 1 4 . 1 1 16 16 ALA H H 16 7.808 7.808 7.468 0.340 25085
1885 1 4 . 1 1 17 17 ARG N N 17 115.329 115.329 117.852 -2.523 25085
1886 1 4 . 1 1 17 17 ARG HA H 17 4.404 4.404 4.334 0.070 25085
1887 1 4 . 1 1 17 17 ARG C C 17 176.446 176.446 176.908 -0.462 25085
1888 1 4 . 1 1 17 17 ARG CA C 17 56.015 56.015 56.689 -0.674 25085
1889 1 4 . 1 1 17 17 ARG CB C 17 30.676 30.676 31.366 -0.690 25085
1890 1 4 . 1 1 17 17 ARG H H 17 7.280 7.280 8.430 -1.150 25085
1891 1 4 . 1 1 18 18 GLY N N 18 107.395 107.395 105.892 1.503 25085
1892 1 4 . 1 1 18 18 GLY C C 18 174.072 174.072 173.609 0.463 25085
1893 1 4 . 1 1 18 18 GLY CA C 18 45.218 45.218 44.437 0.781 25085
1894 1 4 . 1 1 18 18 GLY H H 18 7.795 7.795 8.143 -0.348 25085
1895 1 4 . 1 1 19 19 ALA N N 19 123.197 123.197 122.626 0.571 25085
1896 1 4 . 1 1 19 19 ALA HA H 19 4.217 4.217 4.062 0.155 25085
1897 1 4 . 1 1 19 19 ALA C C 19 176.261 176.261 177.228 -0.967 25085
1898 1 4 . 1 1 19 19 ALA CA C 19 52.674 52.674 52.493 0.181 25085
1899 1 4 . 1 1 19 19 ALA CB C 19 19.411 19.411 19.654 -0.243 25085
1900 1 4 . 1 1 19 19 ALA H H 19 7.980 7.980 7.389 0.591 25085
1901 1 4 . 1 1 20 20 LYS N N 20 118.629 118.629 121.825 -3.196 25085
1902 1 4 . 1 1 20 20 LYS HA H 20 4.308 4.308 4.377 -0.069 25085
1903 1 4 . 1 1 20 20 LYS C C 20 173.981 173.981 174.972 -0.991 25085
1904 1 4 . 1 1 20 20 LYS CA C 20 53.820 53.820 55.175 -1.355 25085
1905 1 4 . 1 1 20 20 LYS CB C 20 33.571 33.571 32.831 0.740 25085
1906 1 4 . 1 1 20 20 LYS H H 20 7.589 7.589 7.964 -0.375 25085
1907 1 4 . 1 1 21 21 LEU N N 21 126.686 126.686 126.082 0.604 25085
1908 1 4 . 1 1 21 21 LEU HA H 21 5.154 5.154 4.794 0.360 25085
1909 1 4 . 1 1 21 21 LEU C C 21 174.076 174.076 175.569 -1.493 25085
1910 1 4 . 1 1 21 21 LEU CA C 21 53.262 53.262 54.330 -1.068 25085
1911 1 4 . 1 1 21 21 LEU CB C 21 44.350 44.350 43.617 0.733 25085
1912 1 4 . 1 1 21 21 LEU H H 21 8.812 8.812 8.435 0.377 25085
1913 1 4 . 1 1 22 22 ILE N N 22 127.566 127.566 121.110 6.456 25085
1914 1 4 . 1 1 22 22 ILE HA H 22 4.678 4.678 4.691 -0.013 25085
1915 1 4 . 1 1 22 22 ILE C C 22 173.136 173.136 173.799 -0.663 25085
1916 1 4 . 1 1 22 22 ILE CA C 22 60.160 60.160 59.373 0.787 25085
1917 1 4 . 1 1 22 22 ILE CB C 22 39.842 39.842 41.464 -1.622 25085
1918 1 4 . 1 1 22 22 ILE H H 22 9.416 9.416 8.806 0.610 25085
1919 1 4 . 1 1 23 23 ASP N N 23 129.217 129.217 122.453 6.764 25085
1920 1 4 . 1 1 23 23 ASP HA H 23 3.806 3.806 5.030 -1.224 25085
1921 1 4 . 1 1 23 23 ASP C C 23 176.042 176.042 175.813 0.229 25085
1922 1 4 . 1 1 23 23 ASP CA C 23 52.005 52.005 51.117 0.888 25085
1923 1 4 . 1 1 23 23 ASP CB C 23 42.984 42.984 43.368 -0.384 25085
1924 1 4 . 1 1 23 23 ASP H H 23 8.619 8.619 8.363 0.256 25085
1925 1 4 . 1 1 24 24 ILE N N 24 115.522 115.522 119.999 -4.477 25085
1926 1 4 . 1 1 24 24 ILE HA H 24 5.255 5.255 4.781 0.474 25085
1927 1 4 . 1 1 24 24 ILE C C 24 178.920 178.920 176.824 2.096 25085
1928 1 4 . 1 1 24 24 ILE CA C 24 60.188 60.188 61.393 -1.205 25085
1929 1 4 . 1 1 24 24 ILE CB C 24 38.015 38.015 39.442 -1.427 25085
1930 1 4 . 1 1 24 24 ILE H H 24 7.877 7.877 7.464 0.413 25085
1931 1 4 . 1 1 25 25 ARG N N 25 124.317 124.317 121.601 2.716 25085
1932 1 4 . 1 1 25 25 ARG HA H 25 4.170 4.170 3.886 0.284 25085
1933 1 4 . 1 1 25 25 ARG C C 25 171.756 171.756 174.832 -3.076 25085
1934 1 4 . 1 1 25 25 ARG CA C 25 56.547 56.547 57.670 -1.123 25085
1935 1 4 . 1 1 25 25 ARG CB C 25 30.897 30.897 28.979 1.918 25085
1936 1 4 . 1 1 25 25 ARG H H 25 8.235 8.235 8.320 -0.085 25085
1937 1 4 . 1 1 26 26 ASP N N 26 112.059 112.059 120.262 -8.203 25085
1938 1 4 . 1 1 26 26 ASP HA H 26 4.609 4.609 4.900 -0.291 25085
1939 1 4 . 1 1 26 26 ASP C C 26 177.934 177.934 176.626 1.308 25085
1940 1 4 . 1 1 26 26 ASP CA C 26 54.398 54.398 52.760 1.638 25085
1941 1 4 . 1 1 26 26 ASP CB C 26 42.029 42.029 42.061 -0.032 25085
1942 1 4 . 1 1 26 26 ASP H H 26 7.730 7.730 8.387 -0.657 25085
1943 1 4 . 1 1 27 27 ALA N N 27 121.435 121.435 128.432 -6.997 25085
1944 1 4 . 1 1 27 27 ALA HA H 27 3.959 3.959 3.918 0.041 25085
1945 1 4 . 1 1 27 27 ALA C C 27 179.388 179.388 178.763 0.625 25085
1946 1 4 . 1 1 27 27 ALA CA C 27 55.829 55.829 55.932 -0.103 25085
1947 1 4 . 1 1 27 27 ALA CB C 27 18.572 18.572 18.103 0.469 25085
1948 1 4 . 1 1 27 27 ALA H H 27 8.797 8.797 8.931 -0.134 25085
1949 1 4 . 1 1 28 28 ASP N N 28 114.759 114.759 117.775 -3.016 25085
1950 1 4 . 1 1 28 28 ASP HA H 28 4.314 4.314 4.346 -0.032 25085
1951 1 4 . 1 1 28 28 ASP C C 28 178.738 178.738 179.151 -0.413 25085
1952 1 4 . 1 1 28 28 ASP CA C 28 56.997 56.997 57.554 -0.557 25085
1953 1 4 . 1 1 28 28 ASP CB C 28 39.811 39.811 40.245 -0.434 25085
1954 1 4 . 1 1 28 28 ASP H H 28 8.755 8.755 8.749 0.006 25085
1955 1 4 . 1 1 29 29 GLU N N 29 119.562 119.562 117.473 2.089 25085
1956 1 4 . 1 1 29 29 GLU HA H 29 4.116 4.116 4.278 -0.162 25085
1957 1 4 . 1 1 29 29 GLU C C 29 178.473 178.473 177.878 0.595 25085
1958 1 4 . 1 1 29 29 GLU CA C 29 58.928 58.928 57.713 1.215 25085
1959 1 4 . 1 1 29 29 GLU CB C 29 29.395 29.395 30.106 -0.711 25085
1960 1 4 . 1 1 29 29 GLU H H 29 7.446 7.446 8.854 -1.408 25085
1961 1 4 . 1 1 30 30 TYR N N 30 120.494 120.494 120.262 0.232 25085
1962 1 4 . 1 1 30 30 TYR HA H 30 4.092 4.092 4.645 -0.553 25085
1963 1 4 . 1 1 30 30 TYR C C 30 176.988 176.988 177.473 -0.485 25085
1964 1 4 . 1 1 30 30 TYR CA C 30 60.931 60.931 60.068 0.863 25085
1965 1 4 . 1 1 30 30 TYR CB C 30 39.534 39.534 39.371 0.163 25085
1966 1 4 . 1 1 30 30 TYR H H 30 7.545 7.545 7.944 -0.399 25085
1967 1 4 . 1 1 31 31 LEU N N 31 118.227 118.227 120.033 -1.806 25085
1968 1 4 . 1 1 31 31 LEU HA H 31 3.916 3.916 3.911 0.005 25085
1969 1 4 . 1 1 31 31 LEU C C 31 178.824 178.824 178.307 0.517 25085
1970 1 4 . 1 1 31 31 LEU CA C 31 57.444 57.444 58.294 -0.850 25085
1971 1 4 . 1 1 31 31 LEU CB C 31 41.941 41.941 42.175 -0.234 25085
1972 1 4 . 1 1 31 31 LEU H H 31 8.235 8.235 9.022 -0.787 25085
1973 1 4 . 1 1 32 32 ARG N N 32 117.334 117.334 115.984 1.350 25085
1974 1 4 . 1 1 32 32 ARG HA H 32 4.112 4.112 4.166 -0.054 25085
1975 1 4 . 1 1 32 32 ARG C C 32 177.008 177.008 175.801 1.207 25085
1976 1 4 . 1 1 32 32 ARG CA C 32 59.366 59.366 57.679 1.687 25085
1977 1 4 . 1 1 32 32 ARG CB C 32 30.938 30.938 30.860 0.078 25085
1978 1 4 . 1 1 32 32 ARG H H 32 7.133 7.133 7.857 -0.724 25085
1979 1 4 . 1 1 33 33 GLU N N 33 117.282 117.282 118.138 -0.856 25085
1980 1 4 . 1 1 33 33 GLU HA H 33 4.893 4.893 4.492 0.401 25085
1981 1 4 . 1 1 33 33 GLU C C 33 173.503 173.503 173.734 -0.231 25085
1982 1 4 . 1 1 33 33 GLU CA C 33 56.291 56.291 56.163 0.129 25085
1983 1 4 . 1 1 33 33 GLU CB C 33 32.248 32.248 32.823 -0.575 25085
1984 1 4 . 1 1 33 33 GLU H H 33 7.521 7.521 7.305 0.216 25085
1985 1 4 . 1 1 34 34 HIS N N 34 117.828 117.828 120.423 -2.595 25085
1986 1 4 . 1 1 34 34 HIS HA H 34 4.627 4.627 3.696 0.931 25085
1987 1 4 . 1 1 34 34 HIS C C 34 171.950 171.950 172.611 -0.661 25085
1988 1 4 . 1 1 34 34 HIS CA C 34 54.304 54.304 53.661 0.643 25085
1989 1 4 . 1 1 34 34 HIS CB C 34 30.712 30.712 32.638 -1.926 25085
1990 1 4 . 1 1 34 34 HIS H H 34 8.354 8.354 9.010 -0.656 25085
1991 1 4 . 1 1 35 35 ILE N N 35 126.965 126.965 121.708 5.257 25085
1992 1 4 . 1 1 35 35 ILE HA H 35 3.973 3.973 4.292 -0.319 25085
1993 1 4 . 1 1 35 35 ILE CA C 35 60.500 60.500 58.436 2.064 25085
1994 1 4 . 1 1 35 35 ILE CB C 35 38.822 38.822 38.179 0.643 25085
1995 1 4 . 1 1 35 35 ILE H H 35 10.032 10.032 8.688 1.344 25085
1996 1 4 . 1 1 36 36 PRO HA H 36 4.033 4.033 4.563 -0.530 25085
1997 1 4 . 1 1 36 36 PRO C C 36 177.308 177.308 176.031 1.277 25085
1998 1 4 . 1 1 36 36 PRO CA C 36 66.191 66.191 63.336 2.855 25085
1999 1 4 . 1 1 36 36 PRO CB C 36 31.701 31.701 31.623 0.078 25085
2000 1 4 . 1 1 37 37 GLU N N 37 113.735 113.735 117.898 -4.163 25085
2001 1 4 . 1 1 37 37 GLU HA H 37 4.083 4.083 4.521 -0.438 25085
2002 1 4 . 1 1 37 37 GLU C C 37 176.274 176.274 174.432 1.842 25085
2003 1 4 . 1 1 37 37 GLU CA C 37 58.285 58.285 56.111 2.174 25085
2004 1 4 . 1 1 37 37 GLU CB C 37 28.895 28.895 30.028 -1.133 25085
2005 1 4 . 1 1 37 37 GLU H H 37 8.625 8.625 8.286 0.339 25085
2006 1 4 . 1 1 38 38 ALA N N 38 122.325 122.325 120.544 1.781 25085
2007 1 4 . 1 1 38 38 ALA HA H 38 4.484 4.484 4.703 -0.219 25085
2008 1 4 . 1 1 38 38 ALA C C 38 178.043 178.043 175.338 2.705 25085
2009 1 4 . 1 1 38 38 ALA CA C 38 52.385 52.385 51.584 0.801 25085
2010 1 4 . 1 1 38 38 ALA CB C 38 21.151 21.151 21.687 -0.536 25085
2011 1 4 . 1 1 38 38 ALA H H 38 8.160 8.160 7.355 0.805 25085
2012 1 4 . 1 1 39 39 ASP N N 39 123.726 123.726 119.986 3.740 25085
2013 1 4 . 1 1 39 39 ASP HA H 39 4.856 4.856 4.821 0.035 25085
2014 1 4 . 1 1 39 39 ASP C C 39 174.077 174.077 175.004 -0.927 25085
2015 1 4 . 1 1 39 39 ASP CA C 39 53.498 53.498 53.364 0.134 25085
2016 1 4 . 1 1 39 39 ASP CB C 39 45.176 45.176 43.450 1.726 25085
2017 1 4 . 1 1 39 39 ASP H H 39 9.095 9.095 8.475 0.620 25085
2018 1 4 . 1 1 40 40 LEU N N 40 123.111 123.111 121.803 1.308 25085
2019 1 4 . 1 1 40 40 LEU HA H 40 4.339 4.339 4.644 -0.305 25085
2020 1 4 . 1 1 40 40 LEU C C 40 176.159 176.159 175.396 0.763 25085
2021 1 4 . 1 1 40 40 LEU CA C 40 54.766 54.766 53.793 0.973 25085
2022 1 4 . 1 1 40 40 LEU CB C 40 41.988 41.988 44.107 -2.119 25085
2023 1 4 . 1 1 40 40 LEU H H 40 8.199 8.199 8.198 0.001 25085
2024 1 4 . 1 1 41 41 ALA N N 41 130.678 130.678 129.688 0.990 25085
2025 1 4 . 1 1 41 41 ALA HA H 41 4.430 4.430 4.662 -0.232 25085
2026 1 4 . 1 1 41 41 ALA CA C 41 49.844 49.844 50.518 -0.674 25085
2027 1 4 . 1 1 41 41 ALA CB C 41 18.765 18.765 20.067 -1.302 25085
2028 1 4 . 1 1 41 41 ALA H H 41 8.705 8.705 9.059 -0.354 25085
2029 1 4 . 1 1 42 42 PRO HA H 42 4.133 4.133 4.465 -0.332 25085
2030 1 4 . 1 1 42 42 PRO C C 42 178.946 178.946 177.884 1.062 25085
2031 1 4 . 1 1 42 42 PRO CA C 42 62.119 62.119 62.896 -0.777 25085
2032 1 4 . 1 1 42 42 PRO CB C 42 33.383 33.383 32.196 1.187 25085
2033 1 4 . 1 1 43 43 LEU N N 43 124.604 124.604 120.442 4.162 25085
2034 1 4 . 1 1 43 43 LEU HA H 43 3.881 3.881 4.199 -0.318 25085
2035 1 4 . 1 1 43 43 LEU C C 43 176.869 176.869 178.353 -1.484 25085
2036 1 4 . 1 1 43 43 LEU CA C 43 58.639 58.639 57.834 0.805 25085
2037 1 4 . 1 1 43 43 LEU CB C 43 41.848 41.848 41.619 0.229 25085
2038 1 4 . 1 1 43 43 LEU H H 43 8.330 8.330 8.603 -0.273 25085
2039 1 4 . 1 1 44 44 SER N N 44 110.167 110.167 115.153 -4.986 25085
2040 1 4 . 1 1 44 44 SER HA H 44 4.147 4.147 4.201 -0.054 25085
2041 1 4 . 1 1 44 44 SER C C 44 177.107 177.107 176.087 1.020 25085
2042 1 4 . 1 1 44 44 SER CA C 44 61.043 61.043 61.142 -0.098 25085
2043 1 4 . 1 1 44 44 SER CB C 44 61.765 61.765 63.126 -1.361 25085
2044 1 4 . 1 1 44 44 SER H H 44 8.553 8.553 8.340 0.213 25085
2045 1 4 . 1 1 45 45 VAL N N 45 123.549 123.549 119.490 4.059 25085
2046 1 4 . 1 1 45 45 VAL HA H 45 3.825 3.825 4.036 -0.211 25085
2047 1 4 . 1 1 45 45 VAL C C 45 178.328 178.328 177.017 1.311 25085
2048 1 4 . 1 1 45 45 VAL CA C 45 65.576 65.576 63.948 1.628 25085
2049 1 4 . 1 1 45 45 VAL CB C 45 31.889 31.889 31.520 0.369 25085
2050 1 4 . 1 1 45 45 VAL H H 45 7.181 7.181 7.431 -0.250 25085
2051 1 4 . 1 1 46 46 LEU N N 46 120.336 120.336 121.522 -1.186 25085
2052 1 4 . 1 1 46 46 LEU HA H 46 3.826 3.826 4.003 -0.177 25085
2053 1 4 . 1 1 46 46 LEU C C 46 179.996 179.996 178.329 1.667 25085
2054 1 4 . 1 1 46 46 LEU CA C 46 57.602 57.602 58.532 -0.930 25085
2055 1 4 . 1 1 46 46 LEU CB C 46 41.691 41.691 41.829 -0.138 25085
2056 1 4 . 1 1 46 46 LEU H H 46 8.040 8.040 8.131 -0.091 25085
2057 1 4 . 1 1 47 47 GLU N N 47 115.713 115.713 118.364 -2.651 25085
2058 1 4 . 1 1 47 47 GLU HA H 47 3.820 3.820 3.968 -0.148 25085
2059 1 4 . 1 1 47 47 GLU C C 47 177.029 177.029 178.331 -1.302 25085
2060 1 4 . 1 1 47 47 GLU CA C 47 59.317 59.317 59.214 0.103 25085
2061 1 4 . 1 1 47 47 GLU CB C 47 30.526 30.526 29.540 0.986 25085
2062 1 4 . 1 1 47 47 GLU H H 47 8.567 8.567 7.664 0.903 25085
2063 1 4 . 1 1 48 48 GLN N N 48 116.740 116.740 116.972 -0.232 25085
2064 1 4 . 1 1 48 48 GLN HA H 48 4.281 4.281 4.188 0.093 25085
2065 1 4 . 1 1 48 48 GLN C C 48 177.605 177.605 177.949 -0.344 25085
2066 1 4 . 1 1 48 48 GLN CA C 48 57.827 57.827 57.212 0.615 25085
2067 1 4 . 1 1 48 48 GLN CB C 48 29.985 29.985 28.981 1.004 25085
2068 1 4 . 1 1 48 48 GLN H H 48 7.472 7.472 7.705 -0.233 25085
2069 1 4 . 1 1 49 49 SER N N 49 111.004 111.004 114.974 -3.970 25085
2070 1 4 . 1 1 49 49 SER HA H 49 4.648 4.648 4.336 0.312 25085
2071 1 4 . 1 1 49 49 SER C C 49 174.859 174.859 175.057 -0.198 25085
2072 1 4 . 1 1 49 49 SER CA C 49 58.406 58.406 59.650 -1.244 25085
2073 1 4 . 1 1 49 49 SER CB C 49 64.758 64.758 64.936 -0.178 25085
2074 1 4 . 1 1 49 49 SER H H 49 8.657 8.657 8.139 0.518 25085
2075 1 4 . 1 1 50 50 GLY N N 50 110.839 110.839 110.611 0.228 25085
2076 1 4 . 1 1 50 50 GLY C C 50 172.398 172.398 173.024 -0.626 25085
2077 1 4 . 1 1 50 50 GLY CA C 50 44.444 44.444 44.887 -0.443 25085
2078 1 4 . 1 1 50 50 GLY H H 50 7.846 7.846 7.895 -0.049 25085
2079 1 4 . 1 1 51 51 LEU N N 51 121.009 121.009 123.619 -2.610 25085
2080 1 4 . 1 1 51 51 LEU HA H 51 4.244 4.244 4.849 -0.605 25085
2081 1 4 . 1 1 51 51 LEU CA C 51 52.593 52.593 51.299 1.294 25085
2082 1 4 . 1 1 51 51 LEU CB C 51 43.381 43.381 43.220 0.161 25085
2083 1 4 . 1 1 51 51 LEU H H 51 8.647 8.647 8.043 0.604 25085
2084 1 4 . 1 1 52 52 PRO HA H 52 4.349 4.349 4.448 -0.099 25085
2085 1 4 . 1 1 52 52 PRO C C 52 177.247 177.247 177.018 0.229 25085
2086 1 4 . 1 1 52 52 PRO CA C 52 62.980 62.980 63.023 -0.043 25085
2087 1 4 . 1 1 52 52 PRO CB C 52 32.423 32.423 30.071 2.352 25085
2088 1 4 . 1 1 53 53 ALA N N 53 126.595 126.595 126.845 -0.250 25085
2089 1 4 . 1 1 53 53 ALA HA H 53 3.870 3.870 4.014 -0.144 25085
2090 1 4 . 1 1 53 53 ALA C C 53 180.484 180.484 179.236 1.248 25085
2091 1 4 . 1 1 53 53 ALA CA C 53 55.829 55.829 55.103 0.726 25085
2092 1 4 . 1 1 53 53 ALA CB C 53 18.248 18.248 18.740 -0.492 25085
2093 1 4 . 1 1 53 53 ALA H H 53 8.643 8.643 8.757 -0.114 25085
2094 1 4 . 1 1 54 54 LYS N N 54 113.898 113.898 118.358 -4.460 25085
2095 1 4 . 1 1 54 54 LYS HA H 54 4.167 4.167 4.078 0.089 25085
2096 1 4 . 1 1 54 54 LYS C C 54 176.704 176.704 178.333 -1.629 25085
2097 1 4 . 1 1 54 54 LYS CA C 54 57.893 57.893 58.727 -0.834 25085
2098 1 4 . 1 1 54 54 LYS CB C 54 31.892 31.892 31.929 -0.037 25085
2099 1 4 . 1 1 54 54 LYS H H 54 8.442 8.442 8.417 0.025 25085
2100 1 4 . 1 1 55 55 LEU N N 55 117.932 117.932 119.117 -1.185 25085
2101 1 4 . 1 1 55 55 LEU HA H 55 4.308 4.308 4.284 0.024 25085
2102 1 4 . 1 1 55 55 LEU C C 55 174.589 174.589 178.118 -3.529 25085
2103 1 4 . 1 1 55 55 LEU CA C 55 54.003 54.003 56.749 -2.747 25085
2104 1 4 . 1 1 55 55 LEU CB C 55 41.649 41.649 42.353 -0.704 25085
2105 1 4 . 1 1 55 55 LEU H H 55 7.805 7.805 7.950 -0.145 25085
2106 1 4 . 1 1 56 56 ARG N N 56 116.873 116.873 117.389 -0.516 25085
2107 1 4 . 1 1 56 56 ARG HA H 56 4.006 4.006 4.428 -0.422 25085
2108 1 4 . 1 1 56 56 ARG C C 56 175.542 175.542 175.793 -0.251 25085
2109 1 4 . 1 1 56 56 ARG CA C 56 57.428 57.428 56.218 1.210 25085
2110 1 4 . 1 1 56 56 ARG CB C 56 29.651 29.651 30.404 -0.753 25085
2111 1 4 . 1 1 56 56 ARG H H 56 6.971 6.971 8.191 -1.220 25085
2112 1 4 . 1 1 57 57 HIS N N 57 122.622 122.622 115.921 6.701 25085
2113 1 4 . 1 1 57 57 HIS HA H 57 4.596 4.596 4.580 0.016 25085
2114 1 4 . 1 1 57 57 HIS C C 57 173.855 173.855 172.828 1.027 25085
2115 1 4 . 1 1 57 57 HIS CA C 57 55.780 55.780 56.515 -0.735 25085
2116 1 4 . 1 1 57 57 HIS CB C 57 33.878 33.878 30.934 2.944 25085
2117 1 4 . 1 1 57 57 HIS H H 57 7.281 7.281 7.524 -0.243 25085
2118 1 4 . 1 1 58 58 GLU N N 58 120.479 120.479 119.326 1.153 25085
2119 1 4 . 1 1 58 58 GLU HA H 58 4.052 4.052 4.507 -0.455 25085
2120 1 4 . 1 1 58 58 GLU C C 58 176.762 176.762 175.218 1.544 25085
2121 1 4 . 1 1 58 58 GLU CA C 58 59.634 59.634 56.769 2.865 25085
2122 1 4 . 1 1 58 58 GLU CB C 58 29.931 29.931 31.839 -1.908 25085
2123 1 4 . 1 1 58 58 GLU H H 58 7.626 7.626 8.956 -1.330 25085
2124 1 4 . 1 1 59 59 GLN N N 59 118.110 118.110 118.517 -0.407 25085
2125 1 4 . 1 1 59 59 GLN HA H 59 5.479 5.479 5.434 0.045 25085
2126 1 4 . 1 1 59 59 GLN C C 59 174.322 174.322 175.013 -0.691 25085
2127 1 4 . 1 1 59 59 GLN CA C 59 55.486 55.486 55.120 0.366 25085
2128 1 4 . 1 1 59 59 GLN CB C 59 33.151 33.151 31.416 1.734 25085
2129 1 4 . 1 1 59 59 GLN H H 59 8.560 8.560 8.160 0.400 25085
2130 1 4 . 1 1 60 60 ILE N N 60 122.789 122.789 122.508 0.281 25085
2131 1 4 . 1 1 60 60 ILE HA H 60 4.531 4.531 4.874 -0.343 25085
2132 1 4 . 1 1 60 60 ILE C C 60 173.352 173.352 174.469 -1.117 25085
2133 1 4 . 1 1 60 60 ILE CA C 60 59.794 59.794 60.360 -0.566 25085
2134 1 4 . 1 1 60 60 ILE CB C 60 43.188 43.188 42.262 0.926 25085
2135 1 4 . 1 1 60 60 ILE H H 60 8.735 8.735 8.147 0.588 25085
2136 1 4 . 1 1 61 61 ILE N N 61 125.871 125.871 120.130 5.741 25085
2137 1 4 . 1 1 61 61 ILE HA H 61 5.002 5.002 5.055 -0.053 25085
2138 1 4 . 1 1 61 61 ILE C C 61 175.195 175.195 174.410 0.785 25085
2139 1 4 . 1 1 61 61 ILE CA C 61 58.419 58.419 59.883 -1.464 25085
2140 1 4 . 1 1 61 61 ILE CB C 61 40.270 40.270 41.859 -1.589 25085
2141 1 4 . 1 1 61 61 ILE H H 61 9.057 9.057 9.048 0.009 25085
2142 1 4 . 1 1 62 62 PHE N N 62 123.742 123.742 123.238 0.504 25085
2143 1 4 . 1 1 62 62 PHE HA H 62 5.810 5.810 5.817 -0.007 25085
2144 1 4 . 1 1 62 62 PHE C C 62 176.135 176.135 174.729 1.406 25085
2145 1 4 . 1 1 62 62 PHE CA C 62 56.960 56.960 56.021 0.939 25085
2146 1 4 . 1 1 62 62 PHE CB C 62 43.352 43.352 43.131 0.221 25085
2147 1 4 . 1 1 62 62 PHE H H 62 8.977 8.977 8.390 0.587 25085
2148 1 4 . 1 1 63 63 HIS N N 63 116.939 116.939 116.477 0.462 25085
2149 1 4 . 1 1 63 63 HIS HA H 63 5.979 5.979 5.036 0.943 25085
2150 1 4 . 1 1 63 63 HIS C C 63 171.108 171.108 172.740 -1.632 25085
2151 1 4 . 1 1 63 63 HIS CA C 63 54.115 54.115 55.458 -1.343 25085
2152 1 4 . 1 1 63 63 HIS CB C 63 36.861 36.861 32.526 4.335 25085
2153 1 4 . 1 1 63 63 HIS H H 63 9.298 9.298 8.476 0.822 25085
2154 1 4 . 1 1 64 64 CYS N N 64 119.251 119.251 121.796 -2.545 25085
2155 1 4 . 1 1 64 64 CYS HA H 64 5.044 5.044 5.157 -0.113 25085
2156 1 4 . 1 1 64 64 CYS C C 64 177.438 177.438 175.836 1.602 25085
2157 1 4 . 1 1 64 64 CYS CA C 64 56.886 56.886 56.491 0.395 25085
2158 1 4 . 1 1 64 64 CYS CB C 64 29.425 29.425 31.950 -2.525 25085
2159 1 4 . 1 1 64 64 CYS H H 64 8.156 8.156 8.662 -0.506 25085
2160 1 4 . 1 1 65 65 GLN N N 65 125.627 125.627 124.730 0.897 25085
2161 1 4 . 1 1 65 65 GLN HA H 65 4.220 4.220 3.959 0.261 25085
2162 1 4 . 1 1 65 65 GLN C C 65 174.440 174.440 176.022 -1.582 25085
2163 1 4 . 1 1 65 65 GLN CA C 65 59.788 59.788 59.997 -0.209 25085
2164 1 4 . 1 1 65 65 GLN CB C 65 29.370 29.370 28.450 0.921 25085
2165 1 4 . 1 1 65 65 GLN H H 65 8.937 8.937 9.016 -0.079 25085
2166 1 4 . 1 1 66 66 ALA N N 66 118.880 118.880 115.661 3.219 25085
2167 1 4 . 1 1 66 66 ALA HA H 66 5.115 5.115 4.823 0.292 25085
2168 1 4 . 1 1 66 66 ALA C C 66 177.625 177.625 176.791 0.834 25085
2169 1 4 . 1 1 66 66 ALA CA C 66 50.744 50.744 51.820 -1.076 25085
2170 1 4 . 1 1 66 66 ALA CB C 66 20.658 20.658 20.813 -0.155 25085
2171 1 4 . 1 1 66 66 ALA H H 66 9.024 9.024 7.565 1.459 25085
2172 1 4 . 1 1 67 67 GLY N N 67 112.878 112.878 105.365 7.513 25085
2173 1 4 . 1 1 67 67 GLY C C 67 174.810 174.810 175.560 -0.750 25085
2174 1 4 . 1 1 67 67 GLY CA C 67 45.642 45.642 46.224 -0.582 25085
2175 1 4 . 1 1 67 67 GLY H H 67 8.845 8.845 7.604 1.241 25085
2176 1 4 . 1 1 68 68 LYS N N 68 120.133 120.133 122.443 -2.310 25085
2177 1 4 . 1 1 68 68 LYS HA H 68 4.158 4.158 3.880 0.278 25085
2178 1 4 . 1 1 68 68 LYS C C 68 177.939 177.939 178.449 -0.510 25085
2179 1 4 . 1 1 68 68 LYS CA C 68 58.811 58.811 59.067 -0.256 25085
2180 1 4 . 1 1 68 68 LYS CB C 68 32.796 32.796 31.520 1.276 25085
2181 1 4 . 1 1 68 68 LYS H H 68 7.936 7.936 8.468 -0.532 25085
2182 1 4 . 1 1 69 69 ARG N N 69 125.804 125.804 119.425 6.379 25085
2183 1 4 . 1 1 69 69 ARG HA H 69 4.217 4.217 4.040 0.177 25085
2184 1 4 . 1 1 69 69 ARG C C 69 180.944 180.944 178.541 2.403 25085
2185 1 4 . 1 1 69 69 ARG CA C 69 60.010 60.010 59.450 0.560 25085
2186 1 4 . 1 1 69 69 ARG CB C 69 30.974 30.974 29.784 1.190 25085
2187 1 4 . 1 1 69 69 ARG H H 69 8.981 8.981 8.467 0.514 25085
2188 1 4 . 1 1 70 70 THR N N 70 116.681 116.681 115.795 0.886 25085
2189 1 4 . 1 1 70 70 THR HA H 70 3.607 3.607 4.019 -0.412 25085
2190 1 4 . 1 1 70 70 THR C C 70 176.434 176.434 176.944 -0.510 25085
2191 1 4 . 1 1 70 70 THR CA C 70 65.914 65.914 66.467 -0.553 25085
2192 1 4 . 1 1 70 70 THR CB C 70 68.169 68.169 68.194 -0.025 25085
2193 1 4 . 1 1 70 70 THR H H 70 10.382 10.382 8.071 2.311 25085
2194 1 4 . 1 1 71 71 SER N N 71 113.046 113.046 116.399 -3.353 25085
2195 1 4 . 1 1 71 71 SER HA H 71 3.993 3.993 4.227 -0.234 25085
2196 1 4 . 1 1 71 71 SER C C 71 177.594 177.594 175.938 1.656 25085
2197 1 4 . 1 1 71 71 SER CA C 71 62.500 62.500 61.257 1.243 25085
2198 1 4 . 1 1 71 71 SER H H 71 7.346 7.346 8.388 -1.042 25085
2199 1 4 . 1 1 72 72 ASN N N 72 117.540 117.540 120.279 -2.739 25085
2200 1 4 . 1 1 72 72 ASN HA H 72 4.598 4.598 4.685 -0.087 25085
2201 1 4 . 1 1 72 72 ASN C C 72 175.595 175.595 177.660 -2.065 25085
2202 1 4 . 1 1 72 72 ASN CA C 72 55.147 55.147 55.505 -0.359 25085
2203 1 4 . 1 1 72 72 ASN CB C 72 38.821 38.821 39.301 -0.480 25085
2204 1 4 . 1 1 72 72 ASN H H 72 8.078 8.078 7.728 0.350 25085
2205 1 4 . 1 1 73 73 ASN N N 73 114.869 114.869 119.000 -4.131 25085
2206 1 4 . 1 1 73 73 ASN HA H 73 5.159 5.159 4.648 0.511 25085
2207 1 4 . 1 1 73 73 ASN C C 73 174.375 174.375 176.533 -2.158 25085
2208 1 4 . 1 1 73 73 ASN CA C 73 52.976 52.976 54.409 -1.433 25085
2209 1 4 . 1 1 73 73 ASN CB C 73 39.862 39.862 38.946 0.916 25085
2210 1 4 . 1 1 73 73 ASN H H 73 7.290 7.290 8.645 -1.355 25085
2211 1 4 . 1 1 74 74 ALA N N 74 124.647 124.647 122.219 2.428 25085
2212 1 4 . 1 1 74 74 ALA HA H 74 3.721 3.721 3.783 -0.062 25085
2213 1 4 . 1 1 74 74 ALA C C 74 177.908 177.908 178.559 -0.651 25085
2214 1 4 . 1 1 74 74 ALA CA C 74 57.085 57.085 55.015 2.070 25085
2215 1 4 . 1 1 74 74 ALA CB C 74 19.427 19.427 18.351 1.076 25085
2216 1 4 . 1 1 74 74 ALA H H 74 7.105 7.105 8.163 -1.058 25085
2217 1 4 . 1 1 75 75 ASP N N 75 114.917 114.917 117.019 -2.102 25085
2218 1 4 . 1 1 75 75 ASP HA H 75 4.250 4.250 4.434 -0.184 25085
2219 1 4 . 1 1 75 75 ASP C C 75 179.100 179.100 178.218 0.882 25085
2220 1 4 . 1 1 75 75 ASP CA C 75 57.236 57.236 56.855 0.381 25085
2221 1 4 . 1 1 75 75 ASP CB C 75 39.783 39.783 40.913 -1.130 25085
2222 1 4 . 1 1 75 75 ASP H H 75 8.403 8.403 7.794 0.609 25085
2223 1 4 . 1 1 76 76 LYS N N 76 121.888 121.888 118.591 3.297 25085
2224 1 4 . 1 1 76 76 LYS HA H 76 4.053 4.053 4.122 -0.069 25085
2225 1 4 . 1 1 76 76 LYS C C 76 178.832 178.832 178.848 -0.016 25085
2226 1 4 . 1 1 76 76 LYS CA C 76 58.864 58.864 58.102 0.762 25085
2227 1 4 . 1 1 76 76 LYS CB C 76 32.423 32.423 32.536 -0.113 25085
2228 1 4 . 1 1 76 76 LYS H H 76 7.652 7.652 7.876 -0.224 25085
2229 1 4 . 1 1 77 77 LEU N N 77 118.644 118.644 120.607 -1.963 25085
2230 1 4 . 1 1 77 77 LEU HA H 77 3.557 3.557 3.878 -0.321 25085
2231 1 4 . 1 1 77 77 LEU C C 77 178.068 178.068 178.393 -0.325 25085
2232 1 4 . 1 1 77 77 LEU CA C 77 57.692 57.692 57.640 0.052 25085
2233 1 4 . 1 1 77 77 LEU CB C 77 40.077 40.077 41.283 -1.206 25085
2234 1 4 . 1 1 77 77 LEU H H 77 8.146 8.146 7.678 0.468 25085
2235 1 4 . 1 1 78 78 ALA N N 78 119.668 119.668 119.998 -0.330 25085
2236 1 4 . 1 1 78 78 ALA HA H 78 3.990 3.990 3.835 0.155 25085
2237 1 4 . 1 1 78 78 ALA C C 78 179.542 179.542 177.936 1.606 25085
2238 1 4 . 1 1 78 78 ALA CA C 78 54.937 54.937 54.558 0.379 25085
2239 1 4 . 1 1 78 78 ALA CB C 78 18.080 18.080 18.294 -0.214 25085
2240 1 4 . 1 1 78 78 ALA H H 78 8.136 8.136 7.838 0.298 25085
2241 1 4 . 1 1 79 79 ALA N N 79 118.918 118.918 119.319 -0.401 25085
2242 1 4 . 1 1 79 79 ALA HA H 79 4.139 4.139 4.152 -0.013 25085
2243 1 4 . 1 1 79 79 ALA C C 79 180.800 180.800 179.960 0.840 25085
2244 1 4 . 1 1 79 79 ALA CA C 79 54.571 54.571 54.126 0.445 25085
2245 1 4 . 1 1 79 79 ALA CB C 79 18.268 18.268 18.712 -0.444 25085
2246 1 4 . 1 1 79 79 ALA H H 79 7.319 7.319 7.616 -0.297 25085
2247 1 4 . 1 1 80 80 ILE N N 80 118.438 118.438 118.936 -0.498 25085
2248 1 4 . 1 1 80 80 ILE HA H 80 3.801 3.801 3.854 -0.053 25085
2249 1 4 . 1 1 80 80 ILE C C 80 177.302 177.302 176.973 0.329 25085
2250 1 4 . 1 1 80 80 ILE CA C 80 64.252 64.252 63.338 0.914 25085
2251 1 4 . 1 1 80 80 ILE CB C 80 39.115 39.115 37.885 1.230 25085
2252 1 4 . 1 1 80 80 ILE H H 80 8.227 8.227 7.627 0.600 25085
2253 1 4 . 1 1 81 81 ALA N N 81 117.917 117.917 119.097 -1.180 25085
2254 1 4 . 1 1 81 81 ALA HA H 81 4.466 4.466 4.365 0.101 25085
2255 1 4 . 1 1 81 81 ALA C C 81 176.153 176.153 176.692 -0.539 25085
2256 1 4 . 1 1 81 81 ALA CA C 81 51.404 51.404 51.396 0.008 25085
2257 1 4 . 1 1 81 81 ALA CB C 81 20.200 20.200 18.974 1.226 25085
2258 1 4 . 1 1 81 81 ALA H H 81 7.913 7.913 8.126 -0.213 25085
2259 1 4 . 1 1 82 82 ALA N N 82 124.086 124.086 121.590 2.496 25085
2260 1 4 . 1 1 82 82 ALA HA H 82 4.457 4.457 4.043 0.414 25085
2261 1 4 . 1 1 82 82 ALA CA C 82 52.276 52.276 52.681 -0.405 25085
2262 1 4 . 1 1 82 82 ALA CB C 82 17.243 17.243 16.398 0.845 25085
2263 1 4 . 1 1 82 82 ALA H H 82 7.223 7.223 7.217 0.006 25085
2264 1 4 . 1 1 83 83 PRO HA H 83 4.692 4.692 4.256 0.436 25085
2265 1 4 . 1 1 83 83 PRO C C 83 175.169 175.169 176.066 -0.897 25085
2266 1 4 . 1 1 83 83 PRO CA C 83 63.767 63.767 63.646 0.121 25085
2267 1 4 . 1 1 83 83 PRO CB C 83 32.624 32.624 31.240 1.384 25085
2268 1 4 . 1 1 84 84 ALA N N 84 127.741 127.741 122.460 5.281 25085
2269 1 4 . 1 1 84 84 ALA HA H 84 4.138 4.138 4.218 -0.080 25085
2270 1 4 . 1 1 84 84 ALA C C 84 176.494 176.494 177.444 -0.950 25085
2271 1 4 . 1 1 84 84 ALA CA C 84 53.432 53.432 52.504 0.928 25085
2272 1 4 . 1 1 84 84 ALA CB C 84 19.719 19.719 19.514 0.205 25085
2273 1 4 . 1 1 84 84 ALA H H 84 8.528 8.528 7.320 1.208 25085
2274 1 4 . 1 1 85 85 GLU N N 85 121.634 121.634 118.979 2.655 25085
2275 1 4 . 1 1 85 85 GLU HA H 85 4.228 4.228 4.616 -0.388 25085
2276 1 4 . 1 1 85 85 GLU C C 85 175.094 175.094 174.932 0.162 25085
2277 1 4 . 1 1 85 85 GLU CA C 85 56.444 56.444 54.910 1.534 25085
2278 1 4 . 1 1 85 85 GLU CB C 85 30.803 30.803 29.033 1.770 25085
2279 1 4 . 1 1 85 85 GLU H H 85 8.166 8.166 8.331 -0.165 25085
2280 1 4 . 1 1 86 86 ILE N N 86 122.543 122.543 120.075 2.468 25085
2281 1 4 . 1 1 86 86 ILE HA H 86 5.269 5.269 5.220 0.049 25085
2282 1 4 . 1 1 86 86 ILE C C 86 174.463 174.463 174.741 -0.278 25085
2283 1 4 . 1 1 86 86 ILE CA C 86 59.329 59.329 59.879 -0.550 25085
2284 1 4 . 1 1 86 86 ILE CB C 86 40.546 40.546 40.523 0.023 25085
2285 1 4 . 1 1 86 86 ILE H H 86 7.925 7.925 8.010 -0.085 25085
2286 1 4 . 1 1 87 87 PHE N N 87 122.457 122.457 123.379 -0.922 25085
2287 1 4 . 1 1 87 87 PHE HA H 87 5.428 5.428 5.774 -0.346 25085
2288 1 4 . 1 1 87 87 PHE C C 87 174.450 174.450 174.771 -0.321 25085
2289 1 4 . 1 1 87 87 PHE CA C 87 55.029 55.029 56.368 -1.339 25085
2290 1 4 . 1 1 87 87 PHE CB C 87 43.626 43.626 43.666 -0.040 25085
2291 1 4 . 1 1 87 87 PHE H H 87 9.050 9.050 8.574 0.476 25085
2292 1 4 . 1 1 88 88 LEU N N 88 119.959 119.959 120.841 -0.882 25085
2293 1 4 . 1 1 88 88 LEU HA H 88 5.358 5.358 4.907 0.451 25085
2294 1 4 . 1 1 88 88 LEU C C 88 176.627 176.627 174.611 2.016 25085
2295 1 4 . 1 1 88 88 LEU CA C 88 52.654 52.654 54.205 -1.551 25085
2296 1 4 . 1 1 88 88 LEU CB C 88 43.094 43.094 47.008 -3.913 25085
2297 1 4 . 1 1 88 88 LEU H H 88 8.824 8.824 9.083 -0.259 25085
2298 1 4 . 1 1 89 89 LEU N N 89 124.096 124.096 127.600 -3.504 25085
2299 1 4 . 1 1 89 89 LEU HA H 89 4.432 4.432 4.837 -0.405 25085
2300 1 4 . 1 1 89 89 LEU C C 89 176.693 176.693 175.544 1.149 25085
2301 1 4 . 1 1 89 89 LEU CA C 89 55.385 55.385 54.151 1.234 25085
2302 1 4 . 1 1 89 89 LEU CB C 89 43.537 43.537 43.174 0.363 25085
2303 1 4 . 1 1 89 89 LEU H H 89 8.293 8.293 8.253 0.040 25085
2304 1 4 . 1 1 90 90 GLU N N 90 102.942 102.942 127.537 -24.595 25085
2305 1 4 . 1 1 90 90 GLU HA H 90 3.895 3.895 4.181 -0.286 25085
2306 1 4 . 1 1 90 90 GLU C C 90 175.199 175.199 177.171 -1.972 25085
2307 1 4 . 1 1 90 90 GLU CA C 90 58.586 58.586 58.127 0.459 25085
2308 1 4 . 1 1 90 90 GLU CB C 90 30.831 30.831 30.519 0.312 25085
2309 1 4 . 1 1 90 90 GLU H H 90 9.394 9.394 8.183 1.211 25085
2310 1 4 . 1 1 91 91 ASP N N 91 120.515 120.515 121.550 -1.035 25085
2311 1 4 . 1 1 91 91 ASP HA H 91 4.184 4.184 4.349 -0.165 25085
2312 1 4 . 1 1 91 91 ASP C C 91 176.159 176.159 175.910 0.249 25085
2313 1 4 . 1 1 91 91 ASP CA C 91 55.814 55.814 56.254 -0.440 25085
2314 1 4 . 1 1 91 91 ASP CB C 91 39.033 39.033 40.710 -1.677 25085
2315 1 4 . 1 1 91 91 ASP H H 91 9.210 9.210 8.902 0.308 25085
2316 1 4 . 1 1 92 92 GLY N N 92 104.313 104.313 105.322 -1.009 25085
2317 1 4 . 1 1 92 92 GLY C C 92 172.980 172.980 175.074 -2.094 25085
2318 1 4 . 1 1 92 92 GLY CA C 92 46.946 46.946 44.479 2.467 25085
2319 1 4 . 1 1 92 92 GLY H H 92 7.902 7.902 7.539 0.363 25085
2320 1 4 . 1 1 93 93 ILE N N 93 121.445 121.445 122.097 -0.652 25085
2321 1 4 . 1 1 93 93 ILE HA H 93 3.902 3.902 3.754 0.148 25085
2322 1 4 . 1 1 93 93 ILE C C 93 176.528 176.528 176.421 0.107 25085
2323 1 4 . 1 1 93 93 ILE CA C 93 63.908 63.908 63.819 0.089 25085
2324 1 4 . 1 1 93 93 ILE CB C 93 38.416 38.416 37.978 0.438 25085
2325 1 4 . 1 1 93 93 ILE H H 93 8.129 8.129 8.527 -0.398 25085
2326 1 4 . 1 1 94 94 ASP N N 94 126.304 126.304 120.283 6.021 25085
2327 1 4 . 1 1 94 94 ASP HA H 94 4.436 4.436 4.384 0.052 25085
2328 1 4 . 1 1 94 94 ASP C C 94 180.174 180.174 178.525 1.649 25085
2329 1 4 . 1 1 94 94 ASP CA C 94 58.351 58.351 57.188 1.163 25085
2330 1 4 . 1 1 94 94 ASP CB C 94 39.223 39.223 40.556 -1.333 25085
2331 1 4 . 1 1 94 94 ASP H H 94 9.161 9.161 7.874 1.287 25085
2332 1 4 . 1 1 95 95 GLY N N 95 110.690 110.690 106.936 3.754 25085
2333 1 4 . 1 1 95 95 GLY C C 95 176.108 176.108 175.666 0.442 25085
2334 1 4 . 1 1 95 95 GLY CA C 95 46.873 46.873 46.410 0.464 25085
2335 1 4 . 1 1 95 95 GLY H H 95 8.080 8.080 8.636 -0.556 25085
2336 1 4 . 1 1 96 96 TRP N N 96 126.965 126.965 123.224 3.741 25085
2337 1 4 . 1 1 96 96 TRP HA H 96 3.795 3.795 4.321 -0.526 25085
2338 1 4 . 1 1 96 96 TRP C C 96 177.058 177.058 177.650 -0.592 25085
2339 1 4 . 1 1 96 96 TRP CA C 96 61.633 61.633 61.456 0.177 25085
2340 1 4 . 1 1 96 96 TRP CB C 96 29.512 29.512 29.613 -0.101 25085
2341 1 4 . 1 1 96 96 TRP H H 96 8.007 8.007 7.499 0.508 25085
2342 1 4 . 1 1 97 97 LYS N N 97 116.604 116.604 118.823 -2.219 25085
2343 1 4 . 1 1 97 97 LYS HA H 97 4.090 4.090 4.131 -0.041 25085
2344 1 4 . 1 1 97 97 LYS C C 97 182.010 182.010 179.738 2.272 25085
2345 1 4 . 1 1 97 97 LYS CA C 97 59.776 59.776 59.263 0.513 25085
2346 1 4 . 1 1 97 97 LYS CB C 97 32.208 32.208 32.421 -0.213 25085
2347 1 4 . 1 1 97 97 LYS H H 97 8.696 8.696 7.956 0.740 25085
2348 1 4 . 1 1 98 98 ARG N N 98 122.491 122.491 119.508 2.983 25085
2349 1 4 . 1 1 98 98 ARG HA H 98 4.050 4.050 4.119 -0.069 25085
2350 1 4 . 1 1 98 98 ARG C C 98 177.666 177.666 177.764 -0.098 25085
2351 1 4 . 1 1 98 98 ARG CA C 98 59.509 59.509 58.079 1.430 25085
2352 1 4 . 1 1 98 98 ARG CB C 98 30.471 30.471 30.257 0.214 25085
2353 1 4 . 1 1 98 98 ARG H H 98 8.280 8.280 7.468 0.812 25085
2354 1 4 . 1 1 99 99 ALA N N 99 119.546 119.546 118.298 1.248 25085
2355 1 4 . 1 1 99 99 ALA HA H 99 4.276 4.276 4.012 0.264 25085
2356 1 4 . 1 1 99 99 ALA C C 99 176.800 176.800 177.842 -1.042 25085
2357 1 4 . 1 1 99 99 ALA CA C 99 52.254 52.254 52.796 -0.542 25085
2358 1 4 . 1 1 99 99 ALA CB C 99 18.270 18.270 18.932 -0.662 25085
2359 1 4 . 1 1 99 99 ALA H H 99 7.519 7.519 7.826 -0.307 25085
2360 1 4 . 1 1 100 100 GLY N N 100 106.339 106.339 104.805 1.534 25085
2361 1 4 . 1 1 100 100 GLY C C 100 174.232 174.232 173.933 0.299 25085
2362 1 4 . 1 1 100 100 GLY CA C 100 45.050 45.050 44.773 0.277 25085
2363 1 4 . 1 1 100 100 GLY H H 100 7.926 7.926 7.370 0.556 25085
2364 1 4 . 1 1 101 101 LEU N N 101 122.181 122.181 120.709 1.472 25085
2365 1 4 . 1 1 101 101 LEU HA H 101 4.286 4.286 4.467 -0.181 25085
2366 1 4 . 1 1 101 101 LEU CA C 101 53.183 53.183 51.274 1.909 25085
2367 1 4 . 1 1 101 101 LEU CB C 101 37.320 37.320 41.921 -4.601 25085
2368 1 4 . 1 1 101 101 LEU H H 101 6.976 6.976 7.288 -0.312 25085
2369 1 4 . 1 1 102 102 PRO HA H 102 4.476 4.476 4.305 0.171 25085
2370 1 4 . 1 1 102 102 PRO C C 102 177.424 177.424 176.229 1.195 25085
2371 1 4 . 1 1 102 102 PRO CA C 102 64.014 64.014 63.133 0.881 25085
2372 1 4 . 1 1 102 102 PRO CB C 102 33.200 33.200 32.001 1.199 25085
2373 1 4 . 1 1 103 103 VAL N N 103 110.512 110.512 114.355 -3.843 25085
2374 1 4 . 1 1 103 103 VAL HA H 103 4.643 4.643 4.275 0.368 25085
2375 1 4 . 1 1 103 103 VAL C C 103 174.297 174.297 174.631 -0.334 25085
2376 1 4 . 1 1 103 103 VAL CA C 103 59.693 59.693 59.907 -0.214 25085
2377 1 4 . 1 1 103 103 VAL CB C 103 35.980 35.980 33.686 2.294 25085
2378 1 4 . 1 1 103 103 VAL H H 103 8.073 8.073 7.882 0.191 25085
2379 1 4 . 1 1 104 104 ALA N N 104 125.898 125.898 123.927 1.971 25085
2380 1 4 . 1 1 104 104 ALA HA H 104 4.550 4.550 4.654 -0.104 25085
2381 1 4 . 1 1 104 104 ALA C C 104 176.190 176.190 175.403 0.787 25085
2382 1 4 . 1 1 104 104 ALA CA C 104 50.699 50.699 50.566 0.133 25085
2383 1 4 . 1 1 104 104 ALA CB C 104 19.534 19.534 20.803 -1.270 25085
2384 1 4 . 1 1 104 104 ALA H H 104 8.996 8.996 7.964 1.032 25085
2385 1 4 . 1 1 105 105 VAL N N 105 119.534 119.534 123.326 -3.792 25085
2386 1 4 . 1 1 105 105 VAL HA H 105 4.615 4.615 4.084 0.531 25085
2387 1 4 . 1 1 105 105 VAL C C 105 175.576 175.576 175.065 0.511 25085
2388 1 4 . 1 1 105 105 VAL CA C 105 60.234 60.234 61.904 -1.670 25085
2389 1 4 . 1 1 105 105 VAL CB C 105 34.683 34.683 32.897 1.786 25085
2390 1 4 . 1 1 105 105 VAL H H 105 8.276 8.276 8.485 -0.209 25085
2391 1 4 . 1 1 106 106 ASN N N 106 123.346 123.346 126.744 -3.398 25085
2392 1 4 . 1 1 106 106 ASN HA H 106 4.748 4.748 4.716 0.032 25085
2393 1 4 . 1 1 106 106 ASN C C 106 173.877 173.877 174.934 -1.057 25085
2394 1 4 . 1 1 106 106 ASN CA C 106 53.465 53.465 52.178 1.287 25085
2395 1 4 . 1 1 106 106 ASN CB C 106 39.424 39.424 38.725 0.699 25085
2396 1 4 . 1 1 106 106 ASN H H 106 8.190 8.190 8.386 -0.196 25085
2397 1 5 . 1 1 2 2 ALA N N 2 125.104 125.104 125.856 -0.752 25085
2398 1 5 . 1 1 2 2 ALA HA H 2 4.287 4.287 4.565 -0.278 25085
2399 1 5 . 1 1 2 2 ALA C C 2 176.800 176.800 177.209 -0.409 25085
2400 1 5 . 1 1 2 2 ALA CA C 2 52.429 52.429 52.036 0.393 25085
2401 1 5 . 1 1 2 2 ALA CB C 2 19.407 19.407 19.016 0.391 25085
2402 1 5 . 1 1 2 2 ALA H H 2 8.344 8.344 8.530 -0.186 25085
2403 1 5 . 1 1 3 3 LEU N N 3 120.515 120.515 118.361 2.154 25085
2404 1 5 . 1 1 3 3 LEU HA H 3 4.452 4.452 4.393 0.059 25085
2405 1 5 . 1 1 3 3 LEU C C 3 176.497 176.497 176.535 -0.038 25085
2406 1 5 . 1 1 3 3 LEU CA C 3 54.698 54.698 55.072 -0.374 25085
2407 1 5 . 1 1 3 3 LEU CB C 3 43.203 43.203 40.479 2.724 25085
2408 1 5 . 1 1 3 3 LEU H H 3 8.070 8.070 7.479 0.591 25085
2409 1 5 . 1 1 4 4 THR N N 4 117.803 117.803 121.565 -3.762 25085
2410 1 5 . 1 1 4 4 THR HA H 4 4.480 4.480 4.734 -0.254 25085
2411 1 5 . 1 1 4 4 THR C C 4 173.872 173.872 174.130 -0.258 25085
2412 1 5 . 1 1 4 4 THR CA C 4 62.247 62.247 61.697 0.551 25085
2413 1 5 . 1 1 4 4 THR CB C 4 70.533 70.533 71.431 -0.898 25085
2414 1 5 . 1 1 4 4 THR H H 4 7.954 7.954 8.207 -0.253 25085
2415 1 5 . 1 1 5 5 THR N N 5 121.501 121.501 116.719 4.782 25085
2416 1 5 . 1 1 5 5 THR HA H 5 5.289 5.289 4.582 0.707 25085
2417 1 5 . 1 1 5 5 THR C C 5 174.162 174.162 173.878 0.284 25085
2418 1 5 . 1 1 5 5 THR CA C 5 62.102 62.102 62.415 -0.313 25085
2419 1 5 . 1 1 5 5 THR CB C 5 69.457 69.457 69.730 -0.273 25085
2420 1 5 . 1 1 5 5 THR H H 5 8.640 8.640 8.486 0.154 25085
2421 1 5 . 1 1 6 6 ILE N N 6 122.023 122.023 122.833 -0.810 25085
2422 1 5 . 1 1 6 6 ILE HA H 6 4.988 4.988 4.531 0.457 25085
2423 1 5 . 1 1 6 6 ILE C C 6 173.377 173.377 174.080 -0.703 25085
2424 1 5 . 1 1 6 6 ILE CA C 6 58.611 58.611 59.897 -1.286 25085
2425 1 5 . 1 1 6 6 ILE CB C 6 42.821 42.821 42.480 0.341 25085
2426 1 5 . 1 1 6 6 ILE H H 6 8.977 8.977 9.237 -0.260 25085
2427 1 5 . 1 1 7 7 SER N N 7 122.659 122.659 119.344 3.315 25085
2428 1 5 . 1 1 7 7 SER HA H 7 4.768 4.768 5.119 -0.350 25085
2429 1 5 . 1 1 7 7 SER CA C 7 56.790 56.790 54.866 1.924 25085
2430 1 5 . 1 1 7 7 SER CB C 7 63.235 63.235 64.709 -1.474 25085
2431 1 5 . 1 1 7 7 SER H H 7 9.242 9.242 8.557 0.685 25085
2432 1 5 . 1 1 8 8 PRO HA H 8 4.207 4.207 4.188 0.019 25085
2433 1 5 . 1 1 8 8 PRO C C 8 176.787 176.787 178.256 -1.469 25085
2434 1 5 . 1 1 8 8 PRO CA C 8 66.443 66.443 65.432 1.011 25085
2435 1 5 . 1 1 8 8 PRO CB C 8 32.724 32.724 31.741 0.983 25085
2436 1 5 . 1 1 9 9 HIS N N 9 113.700 113.700 114.777 -1.077 25085
2437 1 5 . 1 1 9 9 HIS HA H 9 3.990 3.990 4.288 -0.298 25085
2438 1 5 . 1 1 9 9 HIS C C 9 178.123 178.123 177.859 0.264 25085
2439 1 5 . 1 1 9 9 HIS CA C 9 60.827 60.827 59.651 1.176 25085
2440 1 5 . 1 1 9 9 HIS CB C 9 29.552 29.552 29.327 0.225 25085
2441 1 5 . 1 1 9 9 HIS H H 9 8.172 8.172 8.380 -0.208 25085
2442 1 5 . 1 1 10 10 ASP N N 10 120.665 120.665 119.522 1.143 25085
2443 1 5 . 1 1 10 10 ASP HA H 10 4.369 4.369 4.463 -0.094 25085
2444 1 5 . 1 1 10 10 ASP C C 10 179.100 179.100 178.008 1.092 25085
2445 1 5 . 1 1 10 10 ASP CA C 10 57.071 57.071 56.714 0.357 25085
2446 1 5 . 1 1 10 10 ASP CB C 10 39.529 39.529 40.936 -1.407 25085
2447 1 5 . 1 1 10 10 ASP H H 10 7.706 7.706 8.664 -0.958 25085
2448 1 5 . 1 1 11 11 ALA N N 11 123.686 123.686 122.791 0.895 25085
2449 1 5 . 1 1 11 11 ALA HA H 11 3.782 3.782 3.843 -0.061 25085
2450 1 5 . 1 1 11 11 ALA C C 11 178.260 178.260 179.334 -1.074 25085
2451 1 5 . 1 1 11 11 ALA CA C 11 55.142 55.142 55.078 0.064 25085
2452 1 5 . 1 1 11 11 ALA CB C 11 18.293 18.293 18.159 0.134 25085
2453 1 5 . 1 1 11 11 ALA H H 11 8.896 8.896 7.566 1.330 25085
2454 1 5 . 1 1 12 12 GLN N N 12 117.521 117.521 117.623 -0.102 25085
2455 1 5 . 1 1 12 12 GLN HA H 12 4.000 4.000 4.048 -0.048 25085
2456 1 5 . 1 1 12 12 GLN C C 12 178.499 178.499 178.462 0.037 25085
2457 1 5 . 1 1 12 12 GLN CA C 12 60.102 60.102 59.112 0.990 25085
2458 1 5 . 1 1 12 12 GLN CB C 12 28.743 28.743 28.554 0.189 25085
2459 1 5 . 1 1 12 12 GLN H H 12 8.431 8.431 7.922 0.509 25085
2460 1 5 . 1 1 13 13 GLU N N 13 118.578 118.578 119.022 -0.444 25085
2461 1 5 . 1 1 13 13 GLU HA H 13 4.059 4.059 4.114 -0.055 25085
2462 1 5 . 1 1 13 13 GLU C C 13 178.352 178.352 179.265 -0.913 25085
2463 1 5 . 1 1 13 13 GLU CA C 13 59.079 59.079 58.886 0.193 25085
2464 1 5 . 1 1 13 13 GLU CB C 13 29.213 29.213 29.852 -0.639 25085
2465 1 5 . 1 1 13 13 GLU H H 13 7.234 7.234 8.069 -0.835 25085
2466 1 5 . 1 1 14 14 LEU N N 14 119.848 119.848 120.316 -0.468 25085
2467 1 5 . 1 1 14 14 LEU HA H 14 3.891 3.891 4.031 -0.140 25085
2468 1 5 . 1 1 14 14 LEU C C 14 180.773 180.773 179.031 1.742 25085
2469 1 5 . 1 1 14 14 LEU CA C 14 57.958 57.958 57.766 0.192 25085
2470 1 5 . 1 1 14 14 LEU CB C 14 41.715 41.715 41.656 0.059 25085
2471 1 5 . 1 1 14 14 LEU H H 14 7.582 7.582 7.937 -0.355 25085
2472 1 5 . 1 1 15 15 ILE N N 15 122.392 122.392 117.216 5.176 25085
2473 1 5 . 1 1 15 15 ILE HA H 15 3.924 3.924 3.721 0.203 25085
2474 1 5 . 1 1 15 15 ILE C C 15 180.109 180.109 177.514 2.595 25085
2475 1 5 . 1 1 15 15 ILE CA C 15 64.663 64.663 64.484 0.179 25085
2476 1 5 . 1 1 15 15 ILE CB C 15 38.900 38.900 37.858 1.042 25085
2477 1 5 . 1 1 15 15 ILE H H 15 8.772 8.772 8.701 0.071 25085
2478 1 5 . 1 1 16 16 ALA N N 16 123.856 123.856 119.365 4.491 25085
2479 1 5 . 1 1 16 16 ALA HA H 16 4.183 4.183 4.268 -0.085 25085
2480 1 5 . 1 1 16 16 ALA C C 16 179.100 179.100 178.584 0.516 25085
2481 1 5 . 1 1 16 16 ALA CA C 16 54.806 54.806 53.670 1.136 25085
2482 1 5 . 1 1 16 16 ALA CB C 16 17.646 17.646 18.840 -1.194 25085
2483 1 5 . 1 1 16 16 ALA H H 16 7.808 7.808 7.319 0.489 25085
2484 1 5 . 1 1 17 17 ARG N N 17 115.329 115.329 118.409 -3.080 25085
2485 1 5 . 1 1 17 17 ARG HA H 17 4.404 4.404 4.318 0.086 25085
2486 1 5 . 1 1 17 17 ARG C C 17 176.446 176.446 177.386 -0.940 25085
2487 1 5 . 1 1 17 17 ARG CA C 17 56.015 56.015 57.397 -1.382 25085
2488 1 5 . 1 1 17 17 ARG CB C 17 30.676 30.676 31.536 -0.860 25085
2489 1 5 . 1 1 17 17 ARG H H 17 7.280 7.280 8.335 -1.055 25085
2490 1 5 . 1 1 18 18 GLY N N 18 107.395 107.395 104.145 3.250 25085
2491 1 5 . 1 1 18 18 GLY C C 18 174.072 174.072 173.188 0.884 25085
2492 1 5 . 1 1 18 18 GLY CA C 18 45.218 45.218 44.952 0.266 25085
2493 1 5 . 1 1 18 18 GLY H H 18 7.795 7.795 8.310 -0.515 25085
2494 1 5 . 1 1 19 19 ALA N N 19 123.197 123.197 124.451 -1.254 25085
2495 1 5 . 1 1 19 19 ALA HA H 19 4.217 4.217 3.884 0.333 25085
2496 1 5 . 1 1 19 19 ALA C C 19 176.261 176.261 177.168 -0.907 25085
2497 1 5 . 1 1 19 19 ALA CA C 19 52.674 52.674 53.124 -0.450 25085
2498 1 5 . 1 1 19 19 ALA CB C 19 19.411 19.411 19.001 0.410 25085
2499 1 5 . 1 1 19 19 ALA H H 19 7.980 7.980 7.596 0.384 25085
2500 1 5 . 1 1 20 20 LYS N N 20 118.629 118.629 124.631 -6.002 25085
2501 1 5 . 1 1 20 20 LYS HA H 20 4.308 4.308 4.350 -0.042 25085
2502 1 5 . 1 1 20 20 LYS C C 20 173.981 173.981 175.245 -1.264 25085
2503 1 5 . 1 1 20 20 LYS CA C 20 53.820 53.820 54.985 -1.165 25085
2504 1 5 . 1 1 20 20 LYS CB C 20 33.571 33.571 32.354 1.217 25085
2505 1 5 . 1 1 20 20 LYS H H 20 7.589 7.589 7.792 -0.203 25085
2506 1 5 . 1 1 21 21 LEU N N 21 126.686 126.686 126.590 0.096 25085
2507 1 5 . 1 1 21 21 LEU HA H 21 5.154 5.154 4.545 0.609 25085
2508 1 5 . 1 1 21 21 LEU C C 21 174.076 174.076 175.651 -1.575 25085
2509 1 5 . 1 1 21 21 LEU CA C 21 53.262 53.262 54.561 -1.299 25085
2510 1 5 . 1 1 21 21 LEU CB C 21 44.350 44.350 43.353 0.997 25085
2511 1 5 . 1 1 21 21 LEU H H 21 8.812 8.812 8.515 0.297 25085
2512 1 5 . 1 1 22 22 ILE N N 22 127.566 127.566 121.679 5.887 25085
2513 1 5 . 1 1 22 22 ILE HA H 22 4.678 4.678 4.816 -0.138 25085
2514 1 5 . 1 1 22 22 ILE C C 22 173.136 173.136 173.942 -0.806 25085
2515 1 5 . 1 1 22 22 ILE CA C 22 60.160 60.160 59.270 0.890 25085
2516 1 5 . 1 1 22 22 ILE CB C 22 39.842 39.842 41.221 -1.379 25085
2517 1 5 . 1 1 22 22 ILE H H 22 9.416 9.416 8.913 0.503 25085
2518 1 5 . 1 1 23 23 ASP N N 23 129.217 129.217 124.184 5.033 25085
2519 1 5 . 1 1 23 23 ASP HA H 23 3.806 3.806 4.835 -1.029 25085
2520 1 5 . 1 1 23 23 ASP C C 23 176.042 176.042 175.348 0.694 25085
2521 1 5 . 1 1 23 23 ASP CA C 23 52.005 52.005 51.859 0.146 25085
2522 1 5 . 1 1 23 23 ASP CB C 23 42.984 42.984 43.182 -0.198 25085
2523 1 5 . 1 1 23 23 ASP H H 23 8.619 8.619 8.526 0.093 25085
2524 1 5 . 1 1 24 24 ILE N N 24 115.522 115.522 119.466 -3.944 25085
2525 1 5 . 1 1 24 24 ILE HA H 24 5.255 5.255 4.892 0.363 25085
2526 1 5 . 1 1 24 24 ILE C C 24 178.920 178.920 174.295 4.625 25085
2527 1 5 . 1 1 24 24 ILE CA C 24 60.188 60.188 59.986 0.202 25085
2528 1 5 . 1 1 24 24 ILE CB C 24 38.015 38.015 38.736 -0.721 25085
2529 1 5 . 1 1 24 24 ILE H H 24 7.877 7.877 7.576 0.301 25085
2530 1 5 . 1 1 25 25 ARG N N 25 124.317 124.317 122.931 1.386 25085
2531 1 5 . 1 1 25 25 ARG HA H 25 4.170 4.170 4.551 -0.381 25085
2532 1 5 . 1 1 25 25 ARG C C 25 171.756 171.756 174.157 -2.401 25085
2533 1 5 . 1 1 25 25 ARG CA C 25 56.547 56.547 54.186 2.361 25085
2534 1 5 . 1 1 25 25 ARG CB C 25 30.897 30.897 31.226 -0.329 25085
2535 1 5 . 1 1 25 25 ARG H H 25 8.235 8.235 7.548 0.687 25085
2536 1 5 . 1 1 26 26 ASP N N 26 112.059 112.059 120.241 -8.182 25085
2537 1 5 . 1 1 26 26 ASP HA H 26 4.609 4.609 4.822 -0.213 25085
2538 1 5 . 1 1 26 26 ASP C C 26 177.934 177.934 176.806 1.128 25085
2539 1 5 . 1 1 26 26 ASP CA C 26 54.398 54.398 54.267 0.131 25085
2540 1 5 . 1 1 26 26 ASP CB C 26 42.029 42.029 41.512 0.517 25085
2541 1 5 . 1 1 26 26 ASP H H 26 7.730 7.730 8.547 -0.817 25085
2542 1 5 . 1 1 27 27 ALA N N 27 121.435 121.435 129.075 -7.640 25085
2543 1 5 . 1 1 27 27 ALA HA H 27 3.959 3.959 3.918 0.041 25085
2544 1 5 . 1 1 27 27 ALA C C 27 179.388 179.388 178.373 1.015 25085
2545 1 5 . 1 1 27 27 ALA CA C 27 55.829 55.829 55.349 0.480 25085
2546 1 5 . 1 1 27 27 ALA CB C 27 18.572 18.572 18.419 0.153 25085
2547 1 5 . 1 1 27 27 ALA H H 27 8.797 8.797 8.833 -0.036 25085
2548 1 5 . 1 1 28 28 ASP N N 28 114.759 114.759 118.491 -3.732 25085
2549 1 5 . 1 1 28 28 ASP HA H 28 4.314 4.314 4.331 -0.017 25085
2550 1 5 . 1 1 28 28 ASP C C 28 178.738 178.738 179.078 -0.340 25085
2551 1 5 . 1 1 28 28 ASP CA C 28 56.997 56.997 57.597 -0.600 25085
2552 1 5 . 1 1 28 28 ASP CB C 28 39.811 39.811 39.917 -0.106 25085
2553 1 5 . 1 1 28 28 ASP H H 28 8.755 8.755 8.743 0.012 25085
2554 1 5 . 1 1 29 29 GLU N N 29 119.562 119.562 119.279 0.283 25085
2555 1 5 . 1 1 29 29 GLU HA H 29 4.116 4.116 4.163 -0.047 25085
2556 1 5 . 1 1 29 29 GLU C C 29 178.473 178.473 179.065 -0.592 25085
2557 1 5 . 1 1 29 29 GLU CA C 29 58.928 58.928 58.733 0.196 25085
2558 1 5 . 1 1 29 29 GLU CB C 29 29.395 29.395 29.982 -0.587 25085
2559 1 5 . 1 1 29 29 GLU H H 29 7.446 7.446 8.259 -0.813 25085
2560 1 5 . 1 1 30 30 TYR N N 30 120.494 120.494 120.951 -0.457 25085
2561 1 5 . 1 1 30 30 TYR HA H 30 4.092 4.092 4.474 -0.382 25085
2562 1 5 . 1 1 30 30 TYR C C 30 176.988 176.988 177.664 -0.676 25085
2563 1 5 . 1 1 30 30 TYR CA C 30 60.931 60.931 61.052 -0.121 25085
2564 1 5 . 1 1 30 30 TYR CB C 30 39.534 39.534 38.739 0.795 25085
2565 1 5 . 1 1 30 30 TYR H H 30 7.545 7.545 7.810 -0.265 25085
2566 1 5 . 1 1 31 31 LEU N N 31 118.227 118.227 120.013 -1.786 25085
2567 1 5 . 1 1 31 31 LEU HA H 31 3.916 3.916 4.024 -0.108 25085
2568 1 5 . 1 1 31 31 LEU C C 31 178.824 178.824 178.600 0.224 25085
2569 1 5 . 1 1 31 31 LEU CA C 31 57.444 57.444 57.255 0.189 25085
2570 1 5 . 1 1 31 31 LEU CB C 31 41.941 41.941 41.675 0.266 25085
2571 1 5 . 1 1 31 31 LEU H H 31 8.235 8.235 8.584 -0.349 25085
2572 1 5 . 1 1 32 32 ARG N N 32 117.334 117.334 115.885 1.449 25085
2573 1 5 . 1 1 32 32 ARG HA H 32 4.112 4.112 4.081 0.031 25085
2574 1 5 . 1 1 32 32 ARG C C 32 177.008 177.008 176.280 0.728 25085
2575 1 5 . 1 1 32 32 ARG CA C 32 59.366 59.366 58.428 0.938 25085
2576 1 5 . 1 1 32 32 ARG CB C 32 30.938 30.938 30.536 0.402 25085
2577 1 5 . 1 1 32 32 ARG H H 32 7.133 7.133 7.532 -0.399 25085
2578 1 5 . 1 1 33 33 GLU N N 33 117.282 117.282 114.867 2.415 25085
2579 1 5 . 1 1 33 33 GLU HA H 33 4.893 4.893 4.519 0.374 25085
2580 1 5 . 1 1 33 33 GLU C C 33 173.503 173.503 173.728 -0.225 25085
2581 1 5 . 1 1 33 33 GLU CA C 33 56.291 56.291 56.308 -0.017 25085
2582 1 5 . 1 1 33 33 GLU CB C 33 32.248 32.248 33.819 -1.571 25085
2583 1 5 . 1 1 33 33 GLU H H 33 7.521 7.521 7.439 0.082 25085
2584 1 5 . 1 1 34 34 HIS N N 34 117.828 117.828 117.100 0.728 25085
2585 1 5 . 1 1 34 34 HIS HA H 34 4.627 4.627 4.121 0.506 25085
2586 1 5 . 1 1 34 34 HIS C C 34 171.950 171.950 173.108 -1.158 25085
2587 1 5 . 1 1 34 34 HIS CA C 34 54.304 54.304 54.129 0.175 25085
2588 1 5 . 1 1 34 34 HIS CB C 34 30.712 30.712 32.441 -1.729 25085
2589 1 5 . 1 1 34 34 HIS H H 34 8.354 8.354 8.870 -0.516 25085
2590 1 5 . 1 1 35 35 ILE N N 35 126.965 126.965 119.476 7.489 25085
2591 1 5 . 1 1 35 35 ILE HA H 35 3.973 3.973 4.268 -0.295 25085
2592 1 5 . 1 1 35 35 ILE CA C 35 60.500 60.500 58.199 2.301 25085
2593 1 5 . 1 1 35 35 ILE CB C 35 38.822 38.822 38.063 0.759 25085
2594 1 5 . 1 1 35 35 ILE H H 35 10.032 10.032 7.769 2.263 25085
2595 1 5 . 1 1 36 36 PRO HA H 36 4.033 4.033 4.649 -0.616 25085
2596 1 5 . 1 1 36 36 PRO C C 36 177.308 177.308 175.915 1.393 25085
2597 1 5 . 1 1 36 36 PRO CA C 36 66.191 66.191 63.035 3.155 25085
2598 1 5 . 1 1 36 36 PRO CB C 36 31.701 31.701 30.082 1.619 25085
2599 1 5 . 1 1 37 37 GLU N N 37 113.735 113.735 117.926 -4.191 25085
2600 1 5 . 1 1 37 37 GLU HA H 37 4.083 4.083 4.413 -0.330 25085
2601 1 5 . 1 1 37 37 GLU C C 37 176.274 176.274 174.705 1.569 25085
2602 1 5 . 1 1 37 37 GLU CA C 37 58.285 58.285 55.959 2.326 25085
2603 1 5 . 1 1 37 37 GLU CB C 37 28.895 28.895 29.372 -0.477 25085
2604 1 5 . 1 1 37 37 GLU H H 37 8.625 8.625 8.452 0.173 25085
2605 1 5 . 1 1 38 38 ALA N N 38 122.325 122.325 121.544 0.781 25085
2606 1 5 . 1 1 38 38 ALA HA H 38 4.484 4.484 4.744 -0.260 25085
2607 1 5 . 1 1 38 38 ALA C C 38 178.043 178.043 175.299 2.744 25085
2608 1 5 . 1 1 38 38 ALA CA C 38 52.385 52.385 51.090 1.295 25085
2609 1 5 . 1 1 38 38 ALA CB C 38 21.151 21.151 22.142 -0.991 25085
2610 1 5 . 1 1 38 38 ALA H H 38 8.160 8.160 7.326 0.834 25085
2611 1 5 . 1 1 39 39 ASP N N 39 123.726 123.726 120.699 3.027 25085
2612 1 5 . 1 1 39 39 ASP HA H 39 4.856 4.856 4.711 0.145 25085
2613 1 5 . 1 1 39 39 ASP C C 39 174.077 174.077 175.213 -1.136 25085
2614 1 5 . 1 1 39 39 ASP CA C 39 53.498 53.498 53.309 0.189 25085
2615 1 5 . 1 1 39 39 ASP CB C 39 45.176 45.176 42.732 2.444 25085
2616 1 5 . 1 1 39 39 ASP H H 39 9.095 9.095 8.686 0.409 25085
2617 1 5 . 1 1 40 40 LEU N N 40 123.111 123.111 126.706 -3.595 25085
2618 1 5 . 1 1 40 40 LEU HA H 40 4.339 4.339 4.059 0.280 25085
2619 1 5 . 1 1 40 40 LEU C C 40 176.159 176.159 175.536 0.623 25085
2620 1 5 . 1 1 40 40 LEU CA C 40 54.766 54.766 54.593 0.173 25085
2621 1 5 . 1 1 40 40 LEU CB C 40 41.988 41.988 42.751 -0.763 25085
2622 1 5 . 1 1 40 40 LEU H H 40 8.199 8.199 8.512 -0.313 25085
2623 1 5 . 1 1 41 41 ALA N N 41 130.678 130.678 129.779 0.899 25085
2624 1 5 . 1 1 41 41 ALA HA H 41 4.430 4.430 4.666 -0.236 25085
2625 1 5 . 1 1 41 41 ALA CA C 41 49.844 49.844 49.510 0.334 25085
2626 1 5 . 1 1 41 41 ALA CB C 41 18.765 18.765 20.094 -1.329 25085
2627 1 5 . 1 1 41 41 ALA H H 41 8.705 8.705 8.731 -0.026 25085
2628 1 5 . 1 1 42 42 PRO HA H 42 4.133 4.133 4.413 -0.280 25085
2629 1 5 . 1 1 42 42 PRO C C 42 178.946 178.946 178.001 0.945 25085
2630 1 5 . 1 1 42 42 PRO CA C 42 62.119 62.119 62.922 -0.803 25085
2631 1 5 . 1 1 42 42 PRO CB C 42 33.383 33.383 31.964 1.419 25085
2632 1 5 . 1 1 43 43 LEU N N 43 124.604 124.604 126.712 -2.108 25085
2633 1 5 . 1 1 43 43 LEU HA H 43 3.881 3.881 3.876 0.005 25085
2634 1 5 . 1 1 43 43 LEU C C 43 176.869 176.869 178.500 -1.631 25085
2635 1 5 . 1 1 43 43 LEU CA C 43 58.639 58.639 58.762 -0.123 25085
2636 1 5 . 1 1 43 43 LEU CB C 43 41.848 41.848 41.952 -0.104 25085
2637 1 5 . 1 1 43 43 LEU H H 43 8.330 8.330 8.255 0.075 25085
2638 1 5 . 1 1 44 44 SER N N 44 110.167 110.167 112.178 -2.011 25085
2639 1 5 . 1 1 44 44 SER HA H 44 4.147 4.147 4.077 0.070 25085
2640 1 5 . 1 1 44 44 SER C C 44 177.107 177.107 176.574 0.533 25085
2641 1 5 . 1 1 44 44 SER CA C 44 61.043 61.043 61.460 -0.417 25085
2642 1 5 . 1 1 44 44 SER CB C 44 61.765 61.765 62.124 -0.360 25085
2643 1 5 . 1 1 44 44 SER H H 44 8.553 8.553 8.225 0.328 25085
2644 1 5 . 1 1 45 45 VAL N N 45 123.549 123.549 120.913 2.636 25085
2645 1 5 . 1 1 45 45 VAL HA H 45 3.825 3.825 3.831 -0.006 25085
2646 1 5 . 1 1 45 45 VAL C C 45 178.328 178.328 177.060 1.268 25085
2647 1 5 . 1 1 45 45 VAL CA C 45 65.576 65.576 65.928 -0.352 25085
2648 1 5 . 1 1 45 45 VAL CB C 45 31.889 31.889 31.889 0.000 25085
2649 1 5 . 1 1 45 45 VAL H H 45 7.181 7.181 8.620 -1.439 25085
2650 1 5 . 1 1 46 46 LEU N N 46 120.336 120.336 120.612 -0.276 25085
2651 1 5 . 1 1 46 46 LEU HA H 46 3.826 3.826 4.110 -0.284 25085
2652 1 5 . 1 1 46 46 LEU C C 46 179.996 179.996 178.088 1.908 25085
2653 1 5 . 1 1 46 46 LEU CA C 46 57.602 57.602 57.309 0.293 25085
2654 1 5 . 1 1 46 46 LEU CB C 46 41.691 41.691 41.940 -0.249 25085
2655 1 5 . 1 1 46 46 LEU H H 46 8.040 8.040 7.844 0.196 25085
2656 1 5 . 1 1 47 47 GLU N N 47 115.713 115.713 118.209 -2.496 25085
2657 1 5 . 1 1 47 47 GLU HA H 47 3.820 3.820 4.090 -0.270 25085
2658 1 5 . 1 1 47 47 GLU C C 47 177.029 177.029 178.127 -1.098 25085
2659 1 5 . 1 1 47 47 GLU CA C 47 59.317 59.317 58.792 0.525 25085
2660 1 5 . 1 1 47 47 GLU CB C 47 30.526 30.526 30.015 0.510 25085
2661 1 5 . 1 1 47 47 GLU H H 47 8.567 8.567 8.335 0.232 25085
2662 1 5 . 1 1 48 48 GLN N N 48 116.740 116.740 117.383 -0.643 25085
2663 1 5 . 1 1 48 48 GLN HA H 48 4.281 4.281 4.319 -0.038 25085
2664 1 5 . 1 1 48 48 GLN C C 48 177.605 177.605 177.408 0.197 25085
2665 1 5 . 1 1 48 48 GLN CA C 48 57.827 57.827 56.802 1.025 25085
2666 1 5 . 1 1 48 48 GLN CB C 48 29.985 29.985 29.332 0.653 25085
2667 1 5 . 1 1 48 48 GLN H H 48 7.472 7.472 7.745 -0.273 25085
2668 1 5 . 1 1 49 49 SER N N 49 111.004 111.004 115.527 -4.523 25085
2669 1 5 . 1 1 49 49 SER HA H 49 4.648 4.648 4.332 0.316 25085
2670 1 5 . 1 1 49 49 SER C C 49 174.859 174.859 174.847 0.012 25085
2671 1 5 . 1 1 49 49 SER CA C 49 58.406 58.406 59.689 -1.283 25085
2672 1 5 . 1 1 49 49 SER CB C 49 64.758 64.758 64.531 0.227 25085
2673 1 5 . 1 1 49 49 SER H H 49 8.657 8.657 8.170 0.487 25085
2674 1 5 . 1 1 50 50 GLY N N 50 110.839 110.839 108.819 2.020 25085
2675 1 5 . 1 1 50 50 GLY C C 50 172.398 172.398 173.293 -0.895 25085
2676 1 5 . 1 1 50 50 GLY CA C 50 44.444 44.444 44.811 -0.367 25085
2677 1 5 . 1 1 50 50 GLY H H 50 7.846 7.846 7.994 -0.148 25085
2678 1 5 . 1 1 51 51 LEU N N 51 121.009 121.009 123.264 -2.255 25085
2679 1 5 . 1 1 51 51 LEU HA H 51 4.244 4.244 4.817 -0.573 25085
2680 1 5 . 1 1 51 51 LEU CA C 51 52.593 52.593 51.322 1.271 25085
2681 1 5 . 1 1 51 51 LEU CB C 51 43.381 43.381 44.276 -0.895 25085
2682 1 5 . 1 1 51 51 LEU H H 51 8.647 8.647 7.714 0.933 25085
2683 1 5 . 1 1 52 52 PRO HA H 52 4.349 4.349 4.517 -0.168 25085
2684 1 5 . 1 1 52 52 PRO C C 52 177.247 177.247 177.599 -0.352 25085
2685 1 5 . 1 1 52 52 PRO CA C 52 62.980 62.980 62.984 -0.004 25085
2686 1 5 . 1 1 52 52 PRO CB C 52 32.423 32.423 30.740 1.683 25085
2687 1 5 . 1 1 53 53 ALA N N 53 126.595 126.595 128.249 -1.654 25085
2688 1 5 . 1 1 53 53 ALA HA H 53 3.870 3.870 3.884 -0.014 25085
2689 1 5 . 1 1 53 53 ALA C C 53 180.484 180.484 179.064 1.420 25085
2690 1 5 . 1 1 53 53 ALA CA C 53 55.829 55.829 55.279 0.550 25085
2691 1 5 . 1 1 53 53 ALA CB C 53 18.248 18.248 18.609 -0.361 25085
2692 1 5 . 1 1 53 53 ALA H H 53 8.643 8.643 8.348 0.295 25085
2693 1 5 . 1 1 54 54 LYS N N 54 113.898 113.898 118.820 -4.922 25085
2694 1 5 . 1 1 54 54 LYS HA H 54 4.167 4.167 4.181 -0.014 25085
2695 1 5 . 1 1 54 54 LYS C C 54 176.704 176.704 178.807 -2.103 25085
2696 1 5 . 1 1 54 54 LYS CA C 54 57.893 57.893 58.529 -0.636 25085
2697 1 5 . 1 1 54 54 LYS CB C 54 31.892 31.892 32.046 -0.154 25085
2698 1 5 . 1 1 54 54 LYS H H 54 8.442 8.442 8.098 0.344 25085
2699 1 5 . 1 1 55 55 LEU N N 55 117.932 117.932 119.362 -1.430 25085
2700 1 5 . 1 1 55 55 LEU HA H 55 4.308 4.308 4.274 0.034 25085
2701 1 5 . 1 1 55 55 LEU C C 55 174.589 174.589 177.913 -3.324 25085
2702 1 5 . 1 1 55 55 LEU CA C 55 54.003 54.003 56.761 -2.758 25085
2703 1 5 . 1 1 55 55 LEU CB C 55 41.649 41.649 42.300 -0.651 25085
2704 1 5 . 1 1 55 55 LEU H H 55 7.805 7.805 8.547 -0.742 25085
2705 1 5 . 1 1 56 56 ARG N N 56 116.873 116.873 116.420 0.453 25085
2706 1 5 . 1 1 56 56 ARG HA H 56 4.006 4.006 4.483 -0.477 25085
2707 1 5 . 1 1 56 56 ARG C C 56 175.542 175.542 175.698 -0.156 25085
2708 1 5 . 1 1 56 56 ARG CA C 56 57.428 57.428 55.647 1.782 25085
2709 1 5 . 1 1 56 56 ARG CB C 56 29.651 29.651 30.919 -1.268 25085
2710 1 5 . 1 1 56 56 ARG H H 56 6.971 6.971 8.022 -1.051 25085
2711 1 5 . 1 1 57 57 HIS N N 57 122.622 122.622 117.320 5.302 25085
2712 1 5 . 1 1 57 57 HIS HA H 57 4.596 4.596 4.630 -0.034 25085
2713 1 5 . 1 1 57 57 HIS C C 57 173.855 173.855 173.073 0.782 25085
2714 1 5 . 1 1 57 57 HIS CA C 57 55.780 55.780 56.455 -0.675 25085
2715 1 5 . 1 1 57 57 HIS CB C 57 33.878 33.878 31.166 2.712 25085
2716 1 5 . 1 1 57 57 HIS H H 57 7.281 7.281 7.459 -0.178 25085
2717 1 5 . 1 1 58 58 GLU N N 58 120.479 120.479 119.030 1.449 25085
2718 1 5 . 1 1 58 58 GLU HA H 58 4.052 4.052 4.493 -0.441 25085
2719 1 5 . 1 1 58 58 GLU C C 58 176.762 176.762 175.019 1.743 25085
2720 1 5 . 1 1 58 58 GLU CA C 58 59.634 59.634 56.897 2.737 25085
2721 1 5 . 1 1 58 58 GLU CB C 58 29.931 29.931 31.798 -1.867 25085
2722 1 5 . 1 1 58 58 GLU H H 58 7.626 7.626 8.926 -1.300 25085
2723 1 5 . 1 1 59 59 GLN N N 59 118.110 118.110 119.010 -0.900 25085
2724 1 5 . 1 1 59 59 GLN HA H 59 5.479 5.479 5.129 0.350 25085
2725 1 5 . 1 1 59 59 GLN C C 59 174.322 174.322 174.461 -0.139 25085
2726 1 5 . 1 1 59 59 GLN CA C 59 55.486 55.486 54.791 0.695 25085
2727 1 5 . 1 1 59 59 GLN CB C 59 33.151 33.151 31.261 1.890 25085
2728 1 5 . 1 1 59 59 GLN H H 59 8.560 8.560 8.256 0.304 25085
2729 1 5 . 1 1 60 60 ILE N N 60 122.789 122.789 125.997 -3.208 25085
2730 1 5 . 1 1 60 60 ILE HA H 60 4.531 4.531 4.704 -0.173 25085
2731 1 5 . 1 1 60 60 ILE C C 60 173.352 173.352 174.863 -1.511 25085
2732 1 5 . 1 1 60 60 ILE CA C 60 59.794 59.794 60.455 -0.661 25085
2733 1 5 . 1 1 60 60 ILE CB C 60 43.188 43.188 39.946 3.242 25085
2734 1 5 . 1 1 60 60 ILE H H 60 8.735 8.735 7.997 0.738 25085
2735 1 5 . 1 1 61 61 ILE N N 61 125.871 125.871 124.411 1.460 25085
2736 1 5 . 1 1 61 61 ILE HA H 61 5.002 5.002 5.021 -0.019 25085
2737 1 5 . 1 1 61 61 ILE C C 61 175.195 175.195 174.874 0.321 25085
2738 1 5 . 1 1 61 61 ILE CA C 61 58.419 58.419 59.630 -1.211 25085
2739 1 5 . 1 1 61 61 ILE CB C 61 40.270 40.270 41.193 -0.923 25085
2740 1 5 . 1 1 61 61 ILE H H 61 9.057 9.057 8.619 0.438 25085
2741 1 5 . 1 1 62 62 PHE N N 62 123.742 123.742 122.206 1.536 25085
2742 1 5 . 1 1 62 62 PHE HA H 62 5.810 5.810 5.973 -0.163 25085
2743 1 5 . 1 1 62 62 PHE C C 62 176.135 176.135 174.830 1.305 25085
2744 1 5 . 1 1 62 62 PHE CA C 62 56.960 56.960 56.159 0.801 25085
2745 1 5 . 1 1 62 62 PHE CB C 62 43.352 43.352 43.077 0.275 25085
2746 1 5 . 1 1 62 62 PHE H H 62 8.977 8.977 8.490 0.487 25085
2747 1 5 . 1 1 63 63 HIS N N 63 116.939 116.939 116.639 0.300 25085
2748 1 5 . 1 1 63 63 HIS HA H 63 5.979 5.979 5.293 0.686 25085
2749 1 5 . 1 1 63 63 HIS C C 63 171.108 171.108 173.488 -2.380 25085
2750 1 5 . 1 1 63 63 HIS CA C 63 54.115 54.115 54.560 -0.445 25085
2751 1 5 . 1 1 63 63 HIS CB C 63 36.861 36.861 31.526 5.335 25085
2752 1 5 . 1 1 63 63 HIS H H 63 9.298 9.298 8.811 0.487 25085
2753 1 5 . 1 1 64 64 CYS N N 64 119.251 119.251 121.674 -2.423 25085
2754 1 5 . 1 1 64 64 CYS HA H 64 5.044 5.044 5.055 -0.011 25085
2755 1 5 . 1 1 64 64 CYS C C 64 177.438 177.438 176.453 0.985 25085
2756 1 5 . 1 1 64 64 CYS CA C 64 56.886 56.886 55.971 0.916 25085
2757 1 5 . 1 1 64 64 CYS CB C 64 29.425 29.425 32.006 -2.581 25085
2758 1 5 . 1 1 64 64 CYS H H 64 8.156 8.156 8.459 -0.303 25085
2759 1 5 . 1 1 65 65 GLN N N 65 125.627 125.627 124.704 0.923 25085
2760 1 5 . 1 1 65 65 GLN HA H 65 4.220 4.220 3.905 0.315 25085
2761 1 5 . 1 1 65 65 GLN C C 65 174.440 174.440 175.692 -1.252 25085
2762 1 5 . 1 1 65 65 GLN CA C 65 59.788 59.788 59.830 -0.042 25085
2763 1 5 . 1 1 65 65 GLN CB C 65 29.370 29.370 28.383 0.987 25085
2764 1 5 . 1 1 65 65 GLN H H 65 8.937 8.937 9.018 -0.081 25085
2765 1 5 . 1 1 66 66 ALA N N 66 118.880 118.880 117.028 1.852 25085
2766 1 5 . 1 1 66 66 ALA HA H 66 5.115 5.115 4.891 0.224 25085
2767 1 5 . 1 1 66 66 ALA C C 66 177.625 177.625 177.122 0.503 25085
2768 1 5 . 1 1 66 66 ALA CA C 66 50.744 50.744 50.778 -0.034 25085
2769 1 5 . 1 1 66 66 ALA CB C 66 20.658 20.658 19.352 1.306 25085
2770 1 5 . 1 1 66 66 ALA H H 66 9.024 9.024 7.595 1.429 25085
2771 1 5 . 1 1 67 67 GLY N N 67 112.878 112.878 108.767 4.111 25085
2772 1 5 . 1 1 67 67 GLY C C 67 174.810 174.810 175.761 -0.951 25085
2773 1 5 . 1 1 67 67 GLY CA C 67 45.642 45.642 46.661 -1.019 25085
2774 1 5 . 1 1 67 67 GLY H H 67 8.845 8.845 8.670 0.175 25085
2775 1 5 . 1 1 68 68 LYS N N 68 120.133 120.133 120.966 -0.833 25085
2776 1 5 . 1 1 68 68 LYS HA H 68 4.158 4.158 4.076 0.082 25085
2777 1 5 . 1 1 68 68 LYS C C 68 177.939 177.939 178.358 -0.419 25085
2778 1 5 . 1 1 68 68 LYS CA C 68 58.811 58.811 58.815 -0.003 25085
2779 1 5 . 1 1 68 68 LYS CB C 68 32.796 32.796 32.430 0.366 25085
2780 1 5 . 1 1 68 68 LYS H H 68 7.936 7.936 8.036 -0.100 25085
2781 1 5 . 1 1 69 69 ARG N N 69 125.804 125.804 117.548 8.256 25085
2782 1 5 . 1 1 69 69 ARG HA H 69 4.217 4.217 4.080 0.137 25085
2783 1 5 . 1 1 69 69 ARG C C 69 180.944 180.944 177.805 3.139 25085
2784 1 5 . 1 1 69 69 ARG CA C 69 60.010 60.010 59.102 0.908 25085
2785 1 5 . 1 1 69 69 ARG CB C 69 30.974 30.974 30.215 0.759 25085
2786 1 5 . 1 1 69 69 ARG H H 69 8.981 8.981 7.774 1.207 25085
2787 1 5 . 1 1 70 70 THR N N 70 116.681 116.681 115.568 1.113 25085
2788 1 5 . 1 1 70 70 THR HA H 70 3.607 3.607 3.984 -0.377 25085
2789 1 5 . 1 1 70 70 THR C C 70 176.434 176.434 176.306 0.128 25085
2790 1 5 . 1 1 70 70 THR CA C 70 65.914 65.914 67.593 -1.679 25085
2791 1 5 . 1 1 70 70 THR CB C 70 68.169 68.169 68.642 -0.473 25085
2792 1 5 . 1 1 70 70 THR H H 70 10.382 10.382 7.573 2.809 25085
2793 1 5 . 1 1 71 71 SER N N 71 113.046 113.046 116.088 -3.042 25085
2794 1 5 . 1 1 71 71 SER HA H 71 3.993 3.993 4.197 -0.204 25085
2795 1 5 . 1 1 71 71 SER C C 71 177.594 177.594 175.767 1.827 25085
2796 1 5 . 1 1 71 71 SER CA C 71 62.500 62.500 61.474 1.026 25085
2797 1 5 . 1 1 71 71 SER H H 71 7.346 7.346 7.829 -0.483 25085
2798 1 5 . 1 1 72 72 ASN N N 72 117.540 117.540 119.387 -1.847 25085
2799 1 5 . 1 1 72 72 ASN HA H 72 4.598 4.598 4.619 -0.021 25085
2800 1 5 . 1 1 72 72 ASN C C 72 175.595 175.595 177.626 -2.031 25085
2801 1 5 . 1 1 72 72 ASN CA C 72 55.147 55.147 55.733 -0.586 25085
2802 1 5 . 1 1 72 72 ASN CB C 72 38.821 38.821 38.882 -0.061 25085
2803 1 5 . 1 1 72 72 ASN H H 72 8.078 8.078 7.450 0.628 25085
2804 1 5 . 1 1 73 73 ASN N N 73 114.869 114.869 119.354 -4.485 25085
2805 1 5 . 1 1 73 73 ASN HA H 73 5.159 5.159 4.651 0.508 25085
2806 1 5 . 1 1 73 73 ASN C C 73 174.375 174.375 176.531 -2.156 25085
2807 1 5 . 1 1 73 73 ASN CA C 73 52.976 52.976 54.292 -1.316 25085
2808 1 5 . 1 1 73 73 ASN CB C 73 39.862 39.862 38.533 1.329 25085
2809 1 5 . 1 1 73 73 ASN H H 73 7.290 7.290 8.076 -0.786 25085
2810 1 5 . 1 1 74 74 ALA N N 74 124.647 124.647 121.565 3.082 25085
2811 1 5 . 1 1 74 74 ALA HA H 74 3.721 3.721 3.794 -0.073 25085
2812 1 5 . 1 1 74 74 ALA C C 74 177.908 177.908 178.596 -0.688 25085
2813 1 5 . 1 1 74 74 ALA CA C 74 57.085 57.085 55.127 1.958 25085
2814 1 5 . 1 1 74 74 ALA CB C 74 19.427 19.427 18.478 0.949 25085
2815 1 5 . 1 1 74 74 ALA H H 74 7.105 7.105 8.414 -1.309 25085
2816 1 5 . 1 1 75 75 ASP N N 75 114.917 114.917 116.953 -2.036 25085
2817 1 5 . 1 1 75 75 ASP HA H 75 4.250 4.250 4.556 -0.306 25085
2818 1 5 . 1 1 75 75 ASP C C 75 179.100 179.100 178.290 0.810 25085
2819 1 5 . 1 1 75 75 ASP CA C 75 57.236 57.236 56.933 0.303 25085
2820 1 5 . 1 1 75 75 ASP CB C 75 39.783 39.783 40.497 -0.714 25085
2821 1 5 . 1 1 75 75 ASP H H 75 8.403 8.403 7.743 0.660 25085
2822 1 5 . 1 1 76 76 LYS N N 76 121.888 121.888 120.179 1.709 25085
2823 1 5 . 1 1 76 76 LYS HA H 76 4.053 4.053 4.199 -0.146 25085
2824 1 5 . 1 1 76 76 LYS C C 76 178.832 178.832 178.937 -0.105 25085
2825 1 5 . 1 1 76 76 LYS CA C 76 58.864 58.864 58.110 0.754 25085
2826 1 5 . 1 1 76 76 LYS CB C 76 32.423 32.423 32.494 -0.071 25085
2827 1 5 . 1 1 76 76 LYS H H 76 7.652 7.652 7.453 0.199 25085
2828 1 5 . 1 1 77 77 LEU N N 77 118.644 118.644 120.031 -1.387 25085
2829 1 5 . 1 1 77 77 LEU HA H 77 3.557 3.557 3.803 -0.246 25085
2830 1 5 . 1 1 77 77 LEU C C 77 178.068 178.068 178.285 -0.217 25085
2831 1 5 . 1 1 77 77 LEU CA C 77 57.692 57.692 57.499 0.193 25085
2832 1 5 . 1 1 77 77 LEU CB C 77 40.077 40.077 41.218 -1.141 25085
2833 1 5 . 1 1 77 77 LEU H H 77 8.146 8.146 8.604 -0.458 25085
2834 1 5 . 1 1 78 78 ALA N N 78 119.668 119.668 121.512 -1.844 25085
2835 1 5 . 1 1 78 78 ALA HA H 78 3.990 3.990 3.867 0.123 25085
2836 1 5 . 1 1 78 78 ALA C C 78 179.542 179.542 180.097 -0.555 25085
2837 1 5 . 1 1 78 78 ALA CA C 78 54.937 54.937 54.876 0.061 25085
2838 1 5 . 1 1 78 78 ALA CB C 78 18.080 18.080 17.904 0.176 25085
2839 1 5 . 1 1 78 78 ALA H H 78 8.136 8.136 7.401 0.735 25085
2840 1 5 . 1 1 79 79 ALA N N 79 118.918 118.918 120.468 -1.550 25085
2841 1 5 . 1 1 79 79 ALA HA H 79 4.139 4.139 4.053 0.086 25085
2842 1 5 . 1 1 79 79 ALA C C 79 180.800 180.800 178.958 1.842 25085
2843 1 5 . 1 1 79 79 ALA CA C 79 54.571 54.571 54.543 0.028 25085
2844 1 5 . 1 1 79 79 ALA CB C 79 18.268 18.268 18.299 -0.031 25085
2845 1 5 . 1 1 79 79 ALA H H 79 7.319 7.319 7.610 -0.291 25085
2846 1 5 . 1 1 80 80 ILE N N 80 118.438 118.438 116.257 2.181 25085
2847 1 5 . 1 1 80 80 ILE HA H 80 3.801 3.801 3.976 -0.175 25085
2848 1 5 . 1 1 80 80 ILE C C 80 177.302 177.302 175.217 2.085 25085
2849 1 5 . 1 1 80 80 ILE CA C 80 64.252 64.252 62.090 2.162 25085
2850 1 5 . 1 1 80 80 ILE CB C 80 39.115 39.115 38.318 0.797 25085
2851 1 5 . 1 1 80 80 ILE H H 80 8.227 8.227 7.273 0.954 25085
2852 1 5 . 1 1 81 81 ALA N N 81 117.917 117.917 121.760 -3.843 25085
2853 1 5 . 1 1 81 81 ALA HA H 81 4.466 4.466 4.602 -0.136 25085
2854 1 5 . 1 1 81 81 ALA C C 81 176.153 176.153 176.523 -0.370 25085
2855 1 5 . 1 1 81 81 ALA CA C 81 51.404 51.404 49.913 1.490 25085
2856 1 5 . 1 1 81 81 ALA CB C 81 20.200 20.200 19.501 0.699 25085
2857 1 5 . 1 1 81 81 ALA H H 81 7.913 7.913 7.582 0.331 25085
2858 1 5 . 1 1 82 82 ALA N N 82 124.086 124.086 127.840 -3.754 25085
2859 1 5 . 1 1 82 82 ALA HA H 82 4.457 4.457 4.197 0.260 25085
2860 1 5 . 1 1 82 82 ALA CA C 82 52.276 52.276 51.279 0.998 25085
2861 1 5 . 1 1 82 82 ALA CB C 82 17.243 17.243 17.727 -0.485 25085
2862 1 5 . 1 1 82 82 ALA H H 82 7.223 7.223 8.482 -1.259 25085
2863 1 5 . 1 1 83 83 PRO HA H 83 4.692 4.692 4.182 0.510 25085
2864 1 5 . 1 1 83 83 PRO C C 83 175.169 175.169 175.571 -0.402 25085
2865 1 5 . 1 1 83 83 PRO CA C 83 63.767 63.767 63.884 -0.117 25085
2866 1 5 . 1 1 83 83 PRO CB C 83 32.624 32.624 29.547 3.077 25085
2867 1 5 . 1 1 84 84 ALA N N 84 127.741 127.741 124.853 2.888 25085
2868 1 5 . 1 1 84 84 ALA HA H 84 4.138 4.138 4.773 -0.635 25085
2869 1 5 . 1 1 84 84 ALA C C 84 176.494 176.494 176.296 0.198 25085
2870 1 5 . 1 1 84 84 ALA CA C 84 53.432 53.432 50.448 2.984 25085
2871 1 5 . 1 1 84 84 ALA CB C 84 19.719 19.719 21.480 -1.762 25085
2872 1 5 . 1 1 84 84 ALA H H 84 8.528 8.528 8.484 0.044 25085
2873 1 5 . 1 1 85 85 GLU N N 85 121.634 121.634 119.079 2.555 25085
2874 1 5 . 1 1 85 85 GLU HA H 85 4.228 4.228 4.380 -0.152 25085
2875 1 5 . 1 1 85 85 GLU C C 85 175.094 175.094 175.164 -0.070 25085
2876 1 5 . 1 1 85 85 GLU CA C 85 56.444 56.444 55.145 1.298 25085
2877 1 5 . 1 1 85 85 GLU CB C 85 30.803 30.803 28.672 2.131 25085
2878 1 5 . 1 1 85 85 GLU H H 85 8.166 8.166 8.413 -0.247 25085
2879 1 5 . 1 1 86 86 ILE N N 86 122.543 122.543 122.143 0.400 25085
2880 1 5 . 1 1 86 86 ILE HA H 86 5.269 5.269 4.656 0.613 25085
2881 1 5 . 1 1 86 86 ILE C C 86 174.463 174.463 174.527 -0.064 25085
2882 1 5 . 1 1 86 86 ILE CA C 86 59.329 59.329 59.720 -0.391 25085
2883 1 5 . 1 1 86 86 ILE CB C 86 40.546 40.546 39.985 0.561 25085
2884 1 5 . 1 1 86 86 ILE H H 86 7.925 7.925 7.559 0.366 25085
2885 1 5 . 1 1 87 87 PHE N N 87 122.457 122.457 123.365 -0.908 25085
2886 1 5 . 1 1 87 87 PHE HA H 87 5.428 5.428 5.796 -0.368 25085
2887 1 5 . 1 1 87 87 PHE C C 87 174.450 174.450 175.192 -0.742 25085
2888 1 5 . 1 1 87 87 PHE CA C 87 55.029 55.029 55.630 -0.601 25085
2889 1 5 . 1 1 87 87 PHE CB C 87 43.626 43.626 43.448 0.178 25085
2890 1 5 . 1 1 87 87 PHE H H 87 9.050 9.050 7.884 1.166 25085
2891 1 5 . 1 1 88 88 LEU N N 88 119.959 119.959 119.000 0.959 25085
2892 1 5 . 1 1 88 88 LEU HA H 88 5.358 5.358 4.900 0.458 25085
2893 1 5 . 1 1 88 88 LEU C C 88 176.627 176.627 175.106 1.521 25085
2894 1 5 . 1 1 88 88 LEU CA C 88 52.654 52.654 53.887 -1.233 25085
2895 1 5 . 1 1 88 88 LEU CB C 88 43.094 43.094 46.215 -3.120 25085
2896 1 5 . 1 1 88 88 LEU H H 88 8.824 8.824 8.711 0.113 25085
2897 1 5 . 1 1 89 89 LEU N N 89 124.096 124.096 125.354 -1.258 25085
2898 1 5 . 1 1 89 89 LEU HA H 89 4.432 4.432 4.882 -0.450 25085
2899 1 5 . 1 1 89 89 LEU C C 89 176.693 176.693 175.732 0.961 25085
2900 1 5 . 1 1 89 89 LEU CA C 89 55.385 55.385 54.015 1.370 25085
2901 1 5 . 1 1 89 89 LEU CB C 89 43.537 43.537 43.016 0.521 25085
2902 1 5 . 1 1 89 89 LEU H H 89 8.293 8.293 8.286 0.007 25085
2903 1 5 . 1 1 90 90 GLU N N 90 102.942 102.942 127.667 -24.725 25085
2904 1 5 . 1 1 90 90 GLU HA H 90 3.895 3.895 4.159 -0.264 25085
2905 1 5 . 1 1 90 90 GLU C C 90 175.199 175.199 177.062 -1.863 25085
2906 1 5 . 1 1 90 90 GLU CA C 90 58.586 58.586 58.236 0.350 25085
2907 1 5 . 1 1 90 90 GLU CB C 90 30.831 30.831 30.562 0.269 25085
2908 1 5 . 1 1 90 90 GLU H H 90 9.394 9.394 8.152 1.242 25085
2909 1 5 . 1 1 91 91 ASP N N 91 120.515 120.515 122.841 -2.326 25085
2910 1 5 . 1 1 91 91 ASP HA H 91 4.184 4.184 4.327 -0.143 25085
2911 1 5 . 1 1 91 91 ASP C C 91 176.159 176.159 175.799 0.360 25085
2912 1 5 . 1 1 91 91 ASP CA C 91 55.814 55.814 56.424 -0.610 25085
2913 1 5 . 1 1 91 91 ASP CB C 91 39.033 39.033 40.788 -1.755 25085
2914 1 5 . 1 1 91 91 ASP H H 91 9.210 9.210 8.925 0.285 25085
2915 1 5 . 1 1 92 92 GLY N N 92 104.313 104.313 105.093 -0.780 25085
2916 1 5 . 1 1 92 92 GLY C C 92 172.980 172.980 174.794 -1.814 25085
2917 1 5 . 1 1 92 92 GLY CA C 92 46.946 46.946 44.342 2.604 25085
2918 1 5 . 1 1 92 92 GLY H H 92 7.902 7.902 7.776 0.126 25085
2919 1 5 . 1 1 93 93 ILE N N 93 121.445 121.445 122.017 -0.572 25085
2920 1 5 . 1 1 93 93 ILE HA H 93 3.902 3.902 3.817 0.085 25085
2921 1 5 . 1 1 93 93 ILE C C 93 176.528 176.528 176.236 0.292 25085
2922 1 5 . 1 1 93 93 ILE CA C 93 63.908 63.908 63.997 -0.089 25085
2923 1 5 . 1 1 93 93 ILE CB C 93 38.416 38.416 37.978 0.438 25085
2924 1 5 . 1 1 93 93 ILE H H 93 8.129 8.129 8.560 -0.431 25085
2925 1 5 . 1 1 94 94 ASP N N 94 126.304 126.304 120.507 5.797 25085
2926 1 5 . 1 1 94 94 ASP HA H 94 4.436 4.436 4.396 0.040 25085
2927 1 5 . 1 1 94 94 ASP C C 94 180.174 180.174 179.019 1.155 25085
2928 1 5 . 1 1 94 94 ASP CA C 94 58.351 58.351 57.782 0.569 25085
2929 1 5 . 1 1 94 94 ASP CB C 94 39.223 39.223 39.975 -0.752 25085
2930 1 5 . 1 1 94 94 ASP H H 94 9.161 9.161 8.157 1.004 25085
2931 1 5 . 1 1 95 95 GLY N N 95 110.690 110.690 107.807 2.883 25085
2932 1 5 . 1 1 95 95 GLY C C 95 176.108 176.108 175.597 0.511 25085
2933 1 5 . 1 1 95 95 GLY CA C 95 46.873 46.873 46.534 0.339 25085
2934 1 5 . 1 1 95 95 GLY H H 95 8.080 8.080 8.697 -0.617 25085
2935 1 5 . 1 1 96 96 TRP N N 96 126.965 126.965 124.038 2.927 25085
2936 1 5 . 1 1 96 96 TRP HA H 96 3.795 3.795 4.187 -0.392 25085
2937 1 5 . 1 1 96 96 TRP C C 96 177.058 177.058 177.355 -0.297 25085
2938 1 5 . 1 1 96 96 TRP CA C 96 61.633 61.633 60.170 1.463 25085
2939 1 5 . 1 1 96 96 TRP CB C 96 29.512 29.512 29.372 0.140 25085
2940 1 5 . 1 1 96 96 TRP H H 96 8.007 8.007 7.597 0.410 25085
2941 1 5 . 1 1 97 97 LYS N N 97 116.604 116.604 119.022 -2.418 25085
2942 1 5 . 1 1 97 97 LYS HA H 97 4.090 4.090 4.401 -0.311 25085
2943 1 5 . 1 1 97 97 LYS C C 97 182.010 182.010 179.790 2.220 25085
2944 1 5 . 1 1 97 97 LYS CA C 97 59.776 59.776 59.071 0.705 25085
2945 1 5 . 1 1 97 97 LYS CB C 97 32.208 32.208 32.559 -0.351 25085
2946 1 5 . 1 1 97 97 LYS H H 97 8.696 8.696 8.210 0.486 25085
2947 1 5 . 1 1 98 98 ARG N N 98 122.491 122.491 118.971 3.520 25085
2948 1 5 . 1 1 98 98 ARG HA H 98 4.050 4.050 4.188 -0.138 25085
2949 1 5 . 1 1 98 98 ARG C C 98 177.666 177.666 177.825 -0.159 25085
2950 1 5 . 1 1 98 98 ARG CA C 98 59.509 59.509 57.745 1.764 25085
2951 1 5 . 1 1 98 98 ARG CB C 98 30.471 30.471 29.965 0.506 25085
2952 1 5 . 1 1 98 98 ARG H H 98 8.280 8.280 7.662 0.618 25085
2953 1 5 . 1 1 99 99 ALA N N 99 119.546 119.546 119.029 0.517 25085
2954 1 5 . 1 1 99 99 ALA HA H 99 4.276 4.276 4.118 0.158 25085
2955 1 5 . 1 1 99 99 ALA C C 99 176.800 176.800 177.513 -0.713 25085
2956 1 5 . 1 1 99 99 ALA CA C 99 52.254 52.254 52.631 -0.377 25085
2957 1 5 . 1 1 99 99 ALA CB C 99 18.270 18.270 18.634 -0.364 25085
2958 1 5 . 1 1 99 99 ALA H H 99 7.519 7.519 8.148 -0.629 25085
2959 1 5 . 1 1 100 100 GLY N N 100 106.339 106.339 104.915 1.424 25085
2960 1 5 . 1 1 100 100 GLY C C 100 174.232 174.232 174.085 0.147 25085
2961 1 5 . 1 1 100 100 GLY CA C 100 45.050 45.050 44.867 0.183 25085
2962 1 5 . 1 1 100 100 GLY H H 100 7.926 7.926 7.338 0.588 25085
2963 1 5 . 1 1 101 101 LEU N N 101 122.181 122.181 121.116 1.065 25085
2964 1 5 . 1 1 101 101 LEU HA H 101 4.286 4.286 4.550 -0.264 25085
2965 1 5 . 1 1 101 101 LEU CA C 101 53.183 53.183 51.196 1.987 25085
2966 1 5 . 1 1 101 101 LEU CB C 101 37.320 37.320 41.684 -4.364 25085
2967 1 5 . 1 1 101 101 LEU H H 101 6.976 6.976 7.307 -0.331 25085
2968 1 5 . 1 1 102 102 PRO HA H 102 4.476 4.476 4.411 0.065 25085
2969 1 5 . 1 1 102 102 PRO C C 102 177.424 177.424 176.524 0.900 25085
2970 1 5 . 1 1 102 102 PRO CA C 102 64.014 64.014 63.260 0.754 25085
2971 1 5 . 1 1 102 102 PRO CB C 102 33.200 33.200 32.014 1.186 25085
2972 1 5 . 1 1 103 103 VAL N N 103 110.512 110.512 113.583 -3.071 25085
2973 1 5 . 1 1 103 103 VAL HA H 103 4.643 4.643 4.310 0.333 25085
2974 1 5 . 1 1 103 103 VAL C C 103 174.297 174.297 174.366 -0.069 25085
2975 1 5 . 1 1 103 103 VAL CA C 103 59.693 59.693 59.629 0.064 25085
2976 1 5 . 1 1 103 103 VAL CB C 103 35.980 35.980 34.863 1.117 25085
2977 1 5 . 1 1 103 103 VAL H H 103 8.073 8.073 8.152 -0.079 25085
2978 1 5 . 1 1 104 104 ALA N N 104 125.898 125.898 124.032 1.866 25085
2979 1 5 . 1 1 104 104 ALA HA H 104 4.550 4.550 4.639 -0.089 25085
2980 1 5 . 1 1 104 104 ALA C C 104 176.190 176.190 175.378 0.812 25085
2981 1 5 . 1 1 104 104 ALA CA C 104 50.699 50.699 50.317 0.382 25085
2982 1 5 . 1 1 104 104 ALA CB C 104 19.534 19.534 20.435 -0.901 25085
2983 1 5 . 1 1 104 104 ALA H H 104 8.996 8.996 7.945 1.051 25085
2984 1 5 . 1 1 105 105 VAL N N 105 119.534 119.534 122.459 -2.925 25085
2985 1 5 . 1 1 105 105 VAL HA H 105 4.615 4.615 4.031 0.584 25085
2986 1 5 . 1 1 105 105 VAL C C 105 175.576 175.576 175.440 0.136 25085
2987 1 5 . 1 1 105 105 VAL CA C 105 60.234 60.234 60.674 -0.440 25085
2988 1 5 . 1 1 105 105 VAL CB C 105 34.683 34.683 32.571 2.112 25085
2989 1 5 . 1 1 105 105 VAL H H 105 8.276 8.276 8.312 -0.036 25085
2990 1 5 . 1 1 106 106 ASN N N 106 123.346 123.346 127.400 -4.054 25085
2991 1 5 . 1 1 106 106 ASN HA H 106 4.748 4.748 4.731 0.017 25085
2992 1 5 . 1 1 106 106 ASN C C 106 173.877 173.877 175.260 -1.383 25085
2993 1 5 . 1 1 106 106 ASN CA C 106 53.465 53.465 53.861 -0.396 25085
2994 1 5 . 1 1 106 106 ASN CB C 106 39.424 39.424 38.766 0.658 25085
2995 1 5 . 1 1 106 106 ASN H H 106 8.190 8.190 8.242 -0.052 25085
2996 1 6 . 1 1 2 2 ALA N N 2 125.104 125.104 124.905 0.199 25085
2997 1 6 . 1 1 2 2 ALA HA H 2 4.287 4.287 4.466 -0.179 25085
2998 1 6 . 1 1 2 2 ALA C C 2 176.800 176.800 177.007 -0.207 25085
2999 1 6 . 1 1 2 2 ALA CA C 2 52.429 52.429 51.824 0.605 25085
3000 1 6 . 1 1 2 2 ALA CB C 2 19.407 19.407 18.663 0.744 25085
3001 1 6 . 1 1 2 2 ALA H H 2 8.344 8.344 8.167 0.177 25085
3002 1 6 . 1 1 3 3 LEU N N 3 120.515 120.515 116.125 4.390 25085
3003 1 6 . 1 1 3 3 LEU HA H 3 4.452 4.452 4.474 -0.022 25085
3004 1 6 . 1 1 3 3 LEU C C 3 176.497 176.497 176.275 0.222 25085
3005 1 6 . 1 1 3 3 LEU CA C 3 54.698 54.698 55.468 -0.770 25085
3006 1 6 . 1 1 3 3 LEU CB C 3 43.203 43.203 40.853 2.350 25085
3007 1 6 . 1 1 3 3 LEU H H 3 8.070 8.070 7.561 0.509 25085
3008 1 6 . 1 1 4 4 THR N N 4 117.803 117.803 121.023 -3.220 25085
3009 1 6 . 1 1 4 4 THR HA H 4 4.480 4.480 4.797 -0.317 25085
3010 1 6 . 1 1 4 4 THR C C 4 173.872 173.872 173.240 0.632 25085
3011 1 6 . 1 1 4 4 THR CA C 4 62.247 62.247 61.183 1.064 25085
3012 1 6 . 1 1 4 4 THR CB C 4 70.533 70.533 71.814 -1.281 25085
3013 1 6 . 1 1 4 4 THR H H 4 7.954 7.954 8.297 -0.343 25085
3014 1 6 . 1 1 5 5 THR N N 5 121.501 121.501 115.369 6.132 25085
3015 1 6 . 1 1 5 5 THR HA H 5 5.289 5.289 4.605 0.684 25085
3016 1 6 . 1 1 5 5 THR C C 5 174.162 174.162 173.947 0.215 25085
3017 1 6 . 1 1 5 5 THR CA C 5 62.102 62.102 61.589 0.513 25085
3018 1 6 . 1 1 5 5 THR CB C 5 69.457 69.457 69.972 -0.514 25085
3019 1 6 . 1 1 5 5 THR H H 5 8.640 8.640 8.476 0.164 25085
3020 1 6 . 1 1 6 6 ILE N N 6 122.023 122.023 122.549 -0.526 25085
3021 1 6 . 1 1 6 6 ILE HA H 6 4.988 4.988 4.488 0.500 25085
3022 1 6 . 1 1 6 6 ILE C C 6 173.377 173.377 173.580 -0.203 25085
3023 1 6 . 1 1 6 6 ILE CA C 6 58.611 58.611 59.766 -1.155 25085
3024 1 6 . 1 1 6 6 ILE CB C 6 42.821 42.821 42.929 -0.108 25085
3025 1 6 . 1 1 6 6 ILE H H 6 8.977 8.977 9.328 -0.351 25085
3026 1 6 . 1 1 7 7 SER N N 7 122.659 122.659 118.380 4.279 25085
3027 1 6 . 1 1 7 7 SER HA H 7 4.768 4.768 5.181 -0.413 25085
3028 1 6 . 1 1 7 7 SER CA C 7 56.790 56.790 55.161 1.629 25085
3029 1 6 . 1 1 7 7 SER CB C 7 63.235 63.235 63.734 -0.499 25085
3030 1 6 . 1 1 7 7 SER H H 7 9.242 9.242 8.306 0.936 25085
3031 1 6 . 1 1 8 8 PRO HA H 8 4.207 4.207 4.362 -0.155 25085
3032 1 6 . 1 1 8 8 PRO C C 8 176.787 176.787 178.388 -1.601 25085
3033 1 6 . 1 1 8 8 PRO CA C 8 66.443 66.443 65.345 1.098 25085
3034 1 6 . 1 1 8 8 PRO CB C 8 32.724 32.724 31.845 0.879 25085
3035 1 6 . 1 1 9 9 HIS N N 9 113.700 113.700 113.162 0.538 25085
3036 1 6 . 1 1 9 9 HIS HA H 9 3.990 3.990 4.236 -0.246 25085
3037 1 6 . 1 1 9 9 HIS C C 9 178.123 178.123 176.954 1.169 25085
3038 1 6 . 1 1 9 9 HIS CA C 9 60.827 60.827 58.622 2.205 25085
3039 1 6 . 1 1 9 9 HIS CB C 9 29.552 29.552 29.783 -0.231 25085
3040 1 6 . 1 1 9 9 HIS H H 9 8.172 8.172 8.521 -0.349 25085
3041 1 6 . 1 1 10 10 ASP N N 10 120.665 120.665 120.960 -0.295 25085
3042 1 6 . 1 1 10 10 ASP HA H 10 4.369 4.369 4.890 -0.521 25085
3043 1 6 . 1 1 10 10 ASP C C 10 179.100 179.100 177.750 1.350 25085
3044 1 6 . 1 1 10 10 ASP CA C 10 57.071 57.071 56.692 0.379 25085
3045 1 6 . 1 1 10 10 ASP CB C 10 39.529 39.529 40.365 -0.836 25085
3046 1 6 . 1 1 10 10 ASP H H 10 7.706 7.706 8.744 -1.038 25085
3047 1 6 . 1 1 11 11 ALA N N 11 123.686 123.686 121.897 1.789 25085
3048 1 6 . 1 1 11 11 ALA HA H 11 3.782 3.782 3.842 -0.060 25085
3049 1 6 . 1 1 11 11 ALA C C 11 178.260 178.260 179.179 -0.919 25085
3050 1 6 . 1 1 11 11 ALA CA C 11 55.142 55.142 55.289 -0.147 25085
3051 1 6 . 1 1 11 11 ALA CB C 11 18.293 18.293 18.405 -0.112 25085
3052 1 6 . 1 1 11 11 ALA H H 11 8.896 8.896 7.709 1.187 25085
3053 1 6 . 1 1 12 12 GLN N N 12 117.521 117.521 117.940 -0.419 25085
3054 1 6 . 1 1 12 12 GLN HA H 12 4.000 4.000 4.151 -0.151 25085
3055 1 6 . 1 1 12 12 GLN C C 12 178.499 178.499 178.153 0.346 25085
3056 1 6 . 1 1 12 12 GLN CA C 12 60.102 60.102 58.548 1.554 25085
3057 1 6 . 1 1 12 12 GLN CB C 12 28.743 28.743 27.958 0.785 25085
3058 1 6 . 1 1 12 12 GLN H H 12 8.431 8.431 8.017 0.414 25085
3059 1 6 . 1 1 13 13 GLU N N 13 118.578 118.578 119.448 -0.870 25085
3060 1 6 . 1 1 13 13 GLU HA H 13 4.059 4.059 4.048 0.011 25085
3061 1 6 . 1 1 13 13 GLU C C 13 178.352 178.352 179.050 -0.698 25085
3062 1 6 . 1 1 13 13 GLU CA C 13 59.079 59.079 58.866 0.213 25085
3063 1 6 . 1 1 13 13 GLU CB C 13 29.213 29.213 29.124 0.089 25085
3064 1 6 . 1 1 13 13 GLU H H 13 7.234 7.234 7.684 -0.450 25085
3065 1 6 . 1 1 14 14 LEU N N 14 119.848 119.848 119.065 0.783 25085
3066 1 6 . 1 1 14 14 LEU HA H 14 3.891 3.891 4.107 -0.216 25085
3067 1 6 . 1 1 14 14 LEU C C 14 180.773 180.773 179.292 1.481 25085
3068 1 6 . 1 1 14 14 LEU CA C 14 57.958 57.958 57.255 0.703 25085
3069 1 6 . 1 1 14 14 LEU CB C 14 41.715 41.715 42.002 -0.287 25085
3070 1 6 . 1 1 14 14 LEU H H 14 7.582 7.582 7.721 -0.139 25085
3071 1 6 . 1 1 15 15 ILE N N 15 122.392 122.392 118.655 3.737 25085
3072 1 6 . 1 1 15 15 ILE HA H 15 3.924 3.924 3.660 0.264 25085
3073 1 6 . 1 1 15 15 ILE C C 15 180.109 180.109 177.220 2.889 25085
3074 1 6 . 1 1 15 15 ILE CA C 15 64.663 64.663 64.360 0.303 25085
3075 1 6 . 1 1 15 15 ILE CB C 15 38.900 38.900 37.726 1.174 25085
3076 1 6 . 1 1 15 15 ILE H H 15 8.772 8.772 7.803 0.969 25085
3077 1 6 . 1 1 16 16 ALA N N 16 123.856 123.856 119.972 3.884 25085
3078 1 6 . 1 1 16 16 ALA HA H 16 4.183 4.183 4.260 -0.077 25085
3079 1 6 . 1 1 16 16 ALA C C 16 179.100 179.100 178.527 0.573 25085
3080 1 6 . 1 1 16 16 ALA CA C 16 54.806 54.806 53.750 1.056 25085
3081 1 6 . 1 1 16 16 ALA CB C 16 17.646 17.646 18.739 -1.093 25085
3082 1 6 . 1 1 16 16 ALA H H 16 7.808 7.808 7.383 0.425 25085
3083 1 6 . 1 1 17 17 ARG N N 17 115.329 115.329 119.221 -3.892 25085
3084 1 6 . 1 1 17 17 ARG HA H 17 4.404 4.404 4.321 0.083 25085
3085 1 6 . 1 1 17 17 ARG C C 17 176.446 176.446 177.086 -0.640 25085
3086 1 6 . 1 1 17 17 ARG CA C 17 56.015 56.015 56.983 -0.967 25085
3087 1 6 . 1 1 17 17 ARG CB C 17 30.676 30.676 31.315 -0.639 25085
3088 1 6 . 1 1 17 17 ARG H H 17 7.280 7.280 8.425 -1.145 25085
3089 1 6 . 1 1 18 18 GLY N N 18 107.395 107.395 105.075 2.320 25085
3090 1 6 . 1 1 18 18 GLY C C 18 174.072 174.072 173.336 0.736 25085
3091 1 6 . 1 1 18 18 GLY CA C 18 45.218 45.218 44.579 0.639 25085
3092 1 6 . 1 1 18 18 GLY H H 18 7.795 7.795 8.172 -0.377 25085
3093 1 6 . 1 1 19 19 ALA N N 19 123.197 123.197 122.231 0.966 25085
3094 1 6 . 1 1 19 19 ALA HA H 19 4.217 4.217 4.520 -0.303 25085
3095 1 6 . 1 1 19 19 ALA C C 19 176.261 176.261 176.777 -0.516 25085
3096 1 6 . 1 1 19 19 ALA CA C 19 52.674 52.674 51.658 1.016 25085
3097 1 6 . 1 1 19 19 ALA CB C 19 19.411 19.411 20.315 -0.904 25085
3098 1 6 . 1 1 19 19 ALA H H 19 7.980 7.980 7.410 0.570 25085
3099 1 6 . 1 1 20 20 LYS N N 20 118.629 118.629 119.636 -1.007 25085
3100 1 6 . 1 1 20 20 LYS HA H 20 4.308 4.308 4.540 -0.232 25085
3101 1 6 . 1 1 20 20 LYS C C 20 173.981 173.981 174.793 -0.812 25085
3102 1 6 . 1 1 20 20 LYS CA C 20 53.820 53.820 55.393 -1.573 25085
3103 1 6 . 1 1 20 20 LYS CB C 20 33.571 33.571 34.151 -0.580 25085
3104 1 6 . 1 1 20 20 LYS H H 20 7.589 7.589 8.205 -0.616 25085
3105 1 6 . 1 1 21 21 LEU N N 21 126.686 126.686 126.204 0.482 25085
3106 1 6 . 1 1 21 21 LEU HA H 21 5.154 5.154 4.872 0.282 25085
3107 1 6 . 1 1 21 21 LEU C C 21 174.076 174.076 175.800 -1.724 25085
3108 1 6 . 1 1 21 21 LEU CA C 21 53.262 53.262 54.575 -1.313 25085
3109 1 6 . 1 1 21 21 LEU CB C 21 44.350 44.350 43.172 1.178 25085
3110 1 6 . 1 1 21 21 LEU H H 21 8.812 8.812 8.816 -0.004 25085
3111 1 6 . 1 1 22 22 ILE N N 22 127.566 127.566 122.066 5.500 25085
3112 1 6 . 1 1 22 22 ILE HA H 22 4.678 4.678 4.835 -0.157 25085
3113 1 6 . 1 1 22 22 ILE C C 22 173.136 173.136 173.537 -0.401 25085
3114 1 6 . 1 1 22 22 ILE CA C 22 60.160 60.160 59.603 0.557 25085
3115 1 6 . 1 1 22 22 ILE CB C 22 39.842 39.842 41.699 -1.857 25085
3116 1 6 . 1 1 22 22 ILE H H 22 9.416 9.416 9.033 0.383 25085
3117 1 6 . 1 1 23 23 ASP N N 23 129.217 129.217 122.950 6.267 25085
3118 1 6 . 1 1 23 23 ASP HA H 23 3.806 3.806 4.928 -1.122 25085
3119 1 6 . 1 1 23 23 ASP C C 23 176.042 176.042 175.781 0.261 25085
3120 1 6 . 1 1 23 23 ASP CA C 23 52.005 52.005 51.149 0.856 25085
3121 1 6 . 1 1 23 23 ASP CB C 23 42.984 42.984 43.300 -0.316 25085
3122 1 6 . 1 1 23 23 ASP H H 23 8.619 8.619 8.308 0.311 25085
3123 1 6 . 1 1 24 24 ILE N N 24 115.522 115.522 119.344 -3.822 25085
3124 1 6 . 1 1 24 24 ILE HA H 24 5.255 5.255 4.823 0.432 25085
3125 1 6 . 1 1 24 24 ILE C C 24 178.920 178.920 176.917 2.003 25085
3126 1 6 . 1 1 24 24 ILE CA C 24 60.188 60.188 61.351 -1.163 25085
3127 1 6 . 1 1 24 24 ILE CB C 24 38.015 38.015 39.648 -1.633 25085
3128 1 6 . 1 1 24 24 ILE H H 24 7.877 7.877 7.545 0.332 25085
3129 1 6 . 1 1 25 25 ARG N N 25 124.317 124.317 122.262 2.055 25085
3130 1 6 . 1 1 25 25 ARG HA H 25 4.170 4.170 3.838 0.332 25085
3131 1 6 . 1 1 25 25 ARG C C 25 171.756 171.756 175.264 -3.508 25085
3132 1 6 . 1 1 25 25 ARG CA C 25 56.547 56.547 57.735 -1.188 25085
3133 1 6 . 1 1 25 25 ARG CB C 25 30.897 30.897 29.004 1.893 25085
3134 1 6 . 1 1 25 25 ARG H H 25 8.235 8.235 8.328 -0.093 25085
3135 1 6 . 1 1 26 26 ASP N N 26 112.059 112.059 120.113 -8.054 25085
3136 1 6 . 1 1 26 26 ASP HA H 26 4.609 4.609 4.846 -0.237 25085
3137 1 6 . 1 1 26 26 ASP C C 26 177.934 177.934 176.691 1.243 25085
3138 1 6 . 1 1 26 26 ASP CA C 26 54.398 54.398 52.825 1.573 25085
3139 1 6 . 1 1 26 26 ASP CB C 26 42.029 42.029 42.522 -0.493 25085
3140 1 6 . 1 1 26 26 ASP H H 26 7.730 7.730 8.337 -0.607 25085
3141 1 6 . 1 1 27 27 ALA N N 27 121.435 121.435 127.535 -6.100 25085
3142 1 6 . 1 1 27 27 ALA HA H 27 3.959 3.959 3.897 0.062 25085
3143 1 6 . 1 1 27 27 ALA C C 27 179.388 179.388 178.648 0.740 25085
3144 1 6 . 1 1 27 27 ALA CA C 27 55.829 55.829 55.561 0.268 25085
3145 1 6 . 1 1 27 27 ALA CB C 27 18.572 18.572 18.196 0.376 25085
3146 1 6 . 1 1 27 27 ALA H H 27 8.797 8.797 8.909 -0.113 25085
3147 1 6 . 1 1 28 28 ASP N N 28 114.759 114.759 118.093 -3.334 25085
3148 1 6 . 1 1 28 28 ASP HA H 28 4.314 4.314 4.410 -0.096 25085
3149 1 6 . 1 1 28 28 ASP C C 28 178.738 178.738 178.801 -0.063 25085
3150 1 6 . 1 1 28 28 ASP CA C 28 56.997 56.997 57.246 -0.249 25085
3151 1 6 . 1 1 28 28 ASP CB C 28 39.811 39.811 40.160 -0.349 25085
3152 1 6 . 1 1 28 28 ASP H H 28 8.755 8.755 8.647 0.108 25085
3153 1 6 . 1 1 29 29 GLU N N 29 119.562 119.562 118.398 1.164 25085
3154 1 6 . 1 1 29 29 GLU HA H 29 4.116 4.116 4.321 -0.205 25085
3155 1 6 . 1 1 29 29 GLU C C 29 178.473 178.473 178.743 -0.270 25085
3156 1 6 . 1 1 29 29 GLU CA C 29 58.928 58.928 58.122 0.806 25085
3157 1 6 . 1 1 29 29 GLU CB C 29 29.395 29.395 30.038 -0.643 25085
3158 1 6 . 1 1 29 29 GLU H H 29 7.446 7.446 8.919 -1.473 25085
3159 1 6 . 1 1 30 30 TYR N N 30 120.494 120.494 121.553 -1.059 25085
3160 1 6 . 1 1 30 30 TYR HA H 30 4.092 4.092 4.607 -0.515 25085
3161 1 6 . 1 1 30 30 TYR C C 30 176.988 176.988 178.178 -1.190 25085
3162 1 6 . 1 1 30 30 TYR CA C 30 60.931 60.931 61.150 -0.219 25085
3163 1 6 . 1 1 30 30 TYR CB C 30 39.534 39.534 38.910 0.624 25085
3164 1 6 . 1 1 30 30 TYR H H 30 7.545 7.545 7.417 0.128 25085
3165 1 6 . 1 1 31 31 LEU N N 31 118.227 118.227 119.918 -1.691 25085
3166 1 6 . 1 1 31 31 LEU HA H 31 3.916 3.916 3.914 0.002 25085
3167 1 6 . 1 1 31 31 LEU C C 31 178.824 178.824 178.074 0.750 25085
3168 1 6 . 1 1 31 31 LEU CA C 31 57.444 57.444 58.416 -0.972 25085
3169 1 6 . 1 1 31 31 LEU CB C 31 41.941 41.941 42.256 -0.315 25085
3170 1 6 . 1 1 31 31 LEU H H 31 8.235 8.235 8.931 -0.696 25085
3171 1 6 . 1 1 32 32 ARG N N 32 117.334 117.334 116.337 0.997 25085
3172 1 6 . 1 1 32 32 ARG HA H 32 4.112 4.112 4.096 0.016 25085
3173 1 6 . 1 1 32 32 ARG C C 32 177.008 177.008 176.181 0.827 25085
3174 1 6 . 1 1 32 32 ARG CA C 32 59.366 59.366 58.063 1.303 25085
3175 1 6 . 1 1 32 32 ARG CB C 32 30.938 30.938 30.529 0.409 25085
3176 1 6 . 1 1 32 32 ARG H H 32 7.133 7.133 7.543 -0.410 25085
3177 1 6 . 1 1 33 33 GLU N N 33 117.282 117.282 117.507 -0.225 25085
3178 1 6 . 1 1 33 33 GLU HA H 33 4.893 4.893 4.568 0.325 25085
3179 1 6 . 1 1 33 33 GLU C C 33 173.503 173.503 173.868 -0.365 25085
3180 1 6 . 1 1 33 33 GLU CA C 33 56.291 56.291 56.162 0.129 25085
3181 1 6 . 1 1 33 33 GLU CB C 33 32.248 32.248 32.779 -0.531 25085
3182 1 6 . 1 1 33 33 GLU H H 33 7.521 7.521 7.241 0.280 25085
3183 1 6 . 1 1 34 34 HIS N N 34 117.828 117.828 119.349 -1.521 25085
3184 1 6 . 1 1 34 34 HIS HA H 34 4.627 4.627 4.103 0.524 25085
3185 1 6 . 1 1 34 34 HIS C C 34 171.950 171.950 172.973 -1.023 25085
3186 1 6 . 1 1 34 34 HIS CA C 34 54.304 54.304 53.043 1.261 25085
3187 1 6 . 1 1 34 34 HIS CB C 34 30.712 30.712 33.171 -2.459 25085
3188 1 6 . 1 1 34 34 HIS H H 34 8.354 8.354 9.073 -0.719 25085
3189 1 6 . 1 1 35 35 ILE N N 35 126.965 126.965 118.173 8.792 25085
3190 1 6 . 1 1 35 35 ILE HA H 35 3.973 3.973 4.273 -0.300 25085
3191 1 6 . 1 1 35 35 ILE CA C 35 60.500 60.500 57.738 2.762 25085
3192 1 6 . 1 1 35 35 ILE CB C 35 38.822 38.822 39.423 -0.601 25085
3193 1 6 . 1 1 35 35 ILE H H 35 10.032 10.032 7.472 2.560 25085
3194 1 6 . 1 1 36 36 PRO HA H 36 4.033 4.033 4.578 -0.545 25085
3195 1 6 . 1 1 36 36 PRO C C 36 177.308 177.308 175.973 1.335 25085
3196 1 6 . 1 1 36 36 PRO CA C 36 66.191 66.191 63.509 2.682 25085
3197 1 6 . 1 1 36 36 PRO CB C 36 31.701 31.701 31.428 0.273 25085
3198 1 6 . 1 1 37 37 GLU N N 37 113.735 113.735 117.397 -3.662 25085
3199 1 6 . 1 1 37 37 GLU HA H 37 4.083 4.083 4.554 -0.471 25085
3200 1 6 . 1 1 37 37 GLU C C 37 176.274 176.274 174.634 1.640 25085
3201 1 6 . 1 1 37 37 GLU CA C 37 58.285 58.285 55.927 2.358 25085
3202 1 6 . 1 1 37 37 GLU CB C 37 28.895 28.895 29.823 -0.928 25085
3203 1 6 . 1 1 37 37 GLU H H 37 8.625 8.625 8.328 0.297 25085
3204 1 6 . 1 1 38 38 ALA N N 38 122.325 122.325 120.994 1.331 25085
3205 1 6 . 1 1 38 38 ALA HA H 38 4.484 4.484 4.870 -0.386 25085
3206 1 6 . 1 1 38 38 ALA C C 38 178.043 178.043 175.886 2.157 25085
3207 1 6 . 1 1 38 38 ALA CA C 38 52.385 52.385 51.422 0.963 25085
3208 1 6 . 1 1 38 38 ALA CB C 38 21.151 21.151 21.870 -0.719 25085
3209 1 6 . 1 1 38 38 ALA H H 38 8.160 8.160 7.428 0.732 25085
3210 1 6 . 1 1 39 39 ASP N N 39 123.726 123.726 122.301 1.425 25085
3211 1 6 . 1 1 39 39 ASP HA H 39 4.856 4.856 4.863 -0.007 25085
3212 1 6 . 1 1 39 39 ASP C C 39 174.077 174.077 174.773 -0.696 25085
3213 1 6 . 1 1 39 39 ASP CA C 39 53.498 53.498 53.936 -0.438 25085
3214 1 6 . 1 1 39 39 ASP CB C 39 45.176 45.176 42.727 2.450 25085
3215 1 6 . 1 1 39 39 ASP H H 39 9.095 9.095 8.566 0.529 25085
3216 1 6 . 1 1 40 40 LEU N N 40 123.111 123.111 123.598 -0.487 25085
3217 1 6 . 1 1 40 40 LEU HA H 40 4.339 4.339 4.578 -0.239 25085
3218 1 6 . 1 1 40 40 LEU C C 40 176.159 176.159 175.717 0.442 25085
3219 1 6 . 1 1 40 40 LEU CA C 40 54.766 54.766 53.766 1.000 25085
3220 1 6 . 1 1 40 40 LEU CB C 40 41.988 41.988 44.067 -2.079 25085
3221 1 6 . 1 1 40 40 LEU H H 40 8.199 8.199 8.348 -0.149 25085
3222 1 6 . 1 1 41 41 ALA N N 41 130.678 130.678 129.572 1.106 25085
3223 1 6 . 1 1 41 41 ALA HA H 41 4.430 4.430 4.639 -0.209 25085
3224 1 6 . 1 1 41 41 ALA CA C 41 49.844 49.844 50.606 -0.762 25085
3225 1 6 . 1 1 41 41 ALA CB C 41 18.765 18.765 20.060 -1.295 25085
3226 1 6 . 1 1 41 41 ALA H H 41 8.705 8.705 8.917 -0.212 25085
3227 1 6 . 1 1 42 42 PRO HA H 42 4.133 4.133 4.487 -0.354 25085
3228 1 6 . 1 1 42 42 PRO C C 42 178.946 178.946 177.883 1.063 25085
3229 1 6 . 1 1 42 42 PRO CA C 42 62.119 62.119 62.760 -0.641 25085
3230 1 6 . 1 1 42 42 PRO CB C 42 33.383 33.383 32.210 1.173 25085
3231 1 6 . 1 1 43 43 LEU N N 43 124.604 124.604 120.467 4.137 25085
3232 1 6 . 1 1 43 43 LEU HA H 43 3.881 3.881 4.080 -0.199 25085
3233 1 6 . 1 1 43 43 LEU C C 43 176.869 176.869 178.323 -1.454 25085
3234 1 6 . 1 1 43 43 LEU CA C 43 58.639 58.639 57.827 0.812 25085
3235 1 6 . 1 1 43 43 LEU CB C 43 41.848 41.848 41.384 0.464 25085
3236 1 6 . 1 1 43 43 LEU H H 43 8.330 8.330 8.601 -0.271 25085
3237 1 6 . 1 1 44 44 SER N N 44 110.167 110.167 113.689 -3.522 25085
3238 1 6 . 1 1 44 44 SER HA H 44 4.147 4.147 4.234 -0.087 25085
3239 1 6 . 1 1 44 44 SER C C 44 177.107 177.107 176.016 1.091 25085
3240 1 6 . 1 1 44 44 SER CA C 44 61.043 61.043 60.738 0.305 25085
3241 1 6 . 1 1 44 44 SER CB C 44 61.765 61.765 63.183 -1.418 25085
3242 1 6 . 1 1 44 44 SER H H 44 8.553 8.553 8.316 0.237 25085
3243 1 6 . 1 1 45 45 VAL N N 45 123.549 123.549 119.269 4.280 25085
3244 1 6 . 1 1 45 45 VAL HA H 45 3.825 3.825 4.065 -0.240 25085
3245 1 6 . 1 1 45 45 VAL C C 45 178.328 178.328 176.757 1.571 25085
3246 1 6 . 1 1 45 45 VAL CA C 45 65.576 65.576 63.685 1.891 25085
3247 1 6 . 1 1 45 45 VAL CB C 45 31.889 31.889 30.781 1.108 25085
3248 1 6 . 1 1 45 45 VAL H H 45 7.181 7.181 7.436 -0.255 25085
3249 1 6 . 1 1 46 46 LEU N N 46 120.336 120.336 121.681 -1.345 25085
3250 1 6 . 1 1 46 46 LEU HA H 46 3.826 3.826 4.167 -0.341 25085
3251 1 6 . 1 1 46 46 LEU C C 46 179.996 179.996 178.791 1.205 25085
3252 1 6 . 1 1 46 46 LEU CA C 46 57.602 57.602 58.500 -0.898 25085
3253 1 6 . 1 1 46 46 LEU CB C 46 41.691 41.691 42.168 -0.477 25085
3254 1 6 . 1 1 46 46 LEU H H 46 8.040 8.040 7.668 0.372 25085
3255 1 6 . 1 1 47 47 GLU N N 47 115.713 115.713 117.355 -1.642 25085
3256 1 6 . 1 1 47 47 GLU HA H 47 3.820 3.820 3.946 -0.126 25085
3257 1 6 . 1 1 47 47 GLU C C 47 177.029 177.029 178.087 -1.058 25085
3258 1 6 . 1 1 47 47 GLU CA C 47 59.317 59.317 58.975 0.342 25085
3259 1 6 . 1 1 47 47 GLU CB C 47 30.526 30.526 29.581 0.945 25085
3260 1 6 . 1 1 47 47 GLU H H 47 8.567 8.567 8.022 0.545 25085
3261 1 6 . 1 1 48 48 GLN N N 48 116.740 116.740 116.983 -0.243 25085
3262 1 6 . 1 1 48 48 GLN HA H 48 4.281 4.281 4.243 0.038 25085
3263 1 6 . 1 1 48 48 GLN C C 48 177.605 177.605 176.871 0.734 25085
3264 1 6 . 1 1 48 48 GLN CA C 48 57.827 57.827 57.469 0.357 25085
3265 1 6 . 1 1 48 48 GLN CB C 48 29.985 29.985 29.328 0.657 25085
3266 1 6 . 1 1 48 48 GLN H H 48 7.472 7.472 7.770 -0.298 25085
3267 1 6 . 1 1 49 49 SER N N 49 111.004 111.004 113.988 -2.984 25085
3268 1 6 . 1 1 49 49 SER HA H 49 4.648 4.648 4.518 0.130 25085
3269 1 6 . 1 1 49 49 SER C C 49 174.859 174.859 174.459 0.400 25085
3270 1 6 . 1 1 49 49 SER CA C 49 58.406 58.406 58.715 -0.309 25085
3271 1 6 . 1 1 49 49 SER CB C 49 64.758 64.758 64.499 0.259 25085
3272 1 6 . 1 1 49 49 SER H H 49 8.657 8.657 7.535 1.122 25085
3273 1 6 . 1 1 50 50 GLY N N 50 110.839 110.839 109.634 1.205 25085
3274 1 6 . 1 1 50 50 GLY C C 50 172.398 172.398 173.175 -0.777 25085
3275 1 6 . 1 1 50 50 GLY CA C 50 44.444 44.444 44.784 -0.340 25085
3276 1 6 . 1 1 50 50 GLY H H 50 7.846 7.846 7.841 0.005 25085
3277 1 6 . 1 1 51 51 LEU N N 51 121.009 121.009 125.317 -4.308 25085
3278 1 6 . 1 1 51 51 LEU HA H 51 4.244 4.244 4.745 -0.501 25085
3279 1 6 . 1 1 51 51 LEU CA C 51 52.593 52.593 51.481 1.111 25085
3280 1 6 . 1 1 51 51 LEU CB C 51 43.381 43.381 42.245 1.136 25085
3281 1 6 . 1 1 51 51 LEU H H 51 8.647 8.647 8.060 0.587 25085
3282 1 6 . 1 1 52 52 PRO HA H 52 4.349 4.349 4.221 0.128 25085
3283 1 6 . 1 1 52 52 PRO C C 52 177.247 177.247 178.238 -0.991 25085
3284 1 6 . 1 1 52 52 PRO CA C 52 62.980 62.980 64.716 -1.736 25085
3285 1 6 . 1 1 52 52 PRO CB C 52 32.423 32.423 31.393 1.030 25085
3286 1 6 . 1 1 53 53 ALA N N 53 126.595 126.595 121.881 4.714 25085
3287 1 6 . 1 1 53 53 ALA HA H 53 3.870 3.870 4.088 -0.218 25085
3288 1 6 . 1 1 53 53 ALA C C 53 180.484 180.484 179.684 0.800 25085
3289 1 6 . 1 1 53 53 ALA CA C 53 55.829 55.829 54.865 0.964 25085
3290 1 6 . 1 1 53 53 ALA CB C 53 18.248 18.248 18.092 0.156 25085
3291 1 6 . 1 1 53 53 ALA H H 53 8.643 8.643 8.333 0.310 25085
3292 1 6 . 1 1 54 54 LYS N N 54 113.898 113.898 118.546 -4.648 25085
3293 1 6 . 1 1 54 54 LYS HA H 54 4.167 4.167 4.150 0.017 25085
3294 1 6 . 1 1 54 54 LYS C C 54 176.704 176.704 177.955 -1.251 25085
3295 1 6 . 1 1 54 54 LYS CA C 54 57.893 57.893 58.501 -0.608 25085
3296 1 6 . 1 1 54 54 LYS CB C 54 31.892 31.892 32.347 -0.455 25085
3297 1 6 . 1 1 54 54 LYS H H 54 8.442 8.442 7.658 0.784 25085
3298 1 6 . 1 1 55 55 LEU N N 55 117.932 117.932 118.362 -0.430 25085
3299 1 6 . 1 1 55 55 LEU HA H 55 4.308 4.308 4.459 -0.151 25085
3300 1 6 . 1 1 55 55 LEU C C 55 174.589 174.589 177.638 -3.049 25085
3301 1 6 . 1 1 55 55 LEU CA C 55 54.003 54.003 55.141 -1.138 25085
3302 1 6 . 1 1 55 55 LEU CB C 55 41.649 41.649 42.077 -0.428 25085
3303 1 6 . 1 1 55 55 LEU H H 55 7.805 7.805 8.227 -0.422 25085
3304 1 6 . 1 1 56 56 ARG N N 56 116.873 116.873 118.055 -1.182 25085
3305 1 6 . 1 1 56 56 ARG HA H 56 4.006 4.006 4.125 -0.119 25085
3306 1 6 . 1 1 56 56 ARG C C 56 175.542 175.542 176.171 -0.629 25085
3307 1 6 . 1 1 56 56 ARG CA C 56 57.428 57.428 57.607 -0.179 25085
3308 1 6 . 1 1 56 56 ARG CB C 56 29.651 29.651 29.890 -0.239 25085
3309 1 6 . 1 1 56 56 ARG H H 56 6.971 6.971 8.196 -1.225 25085
3310 1 6 . 1 1 57 57 HIS N N 57 122.622 122.622 115.664 6.958 25085
3311 1 6 . 1 1 57 57 HIS HA H 57 4.596 4.596 4.743 -0.147 25085
3312 1 6 . 1 1 57 57 HIS C C 57 173.855 173.855 174.074 -0.219 25085
3313 1 6 . 1 1 57 57 HIS CA C 57 55.780 55.780 55.146 0.634 25085
3314 1 6 . 1 1 57 57 HIS CB C 57 33.878 33.878 31.794 2.084 25085
3315 1 6 . 1 1 57 57 HIS H H 57 7.281 7.281 7.321 -0.040 25085
3316 1 6 . 1 1 58 58 GLU N N 58 120.479 120.479 118.719 1.760 25085
3317 1 6 . 1 1 58 58 GLU HA H 58 4.052 4.052 4.383 -0.331 25085
3318 1 6 . 1 1 58 58 GLU C C 58 176.762 176.762 174.546 2.216 25085
3319 1 6 . 1 1 58 58 GLU CA C 58 59.634 59.634 57.293 2.341 25085
3320 1 6 . 1 1 58 58 GLU CB C 58 29.931 29.931 31.433 -1.502 25085
3321 1 6 . 1 1 58 58 GLU H H 58 7.626 7.626 8.300 -0.674 25085
3322 1 6 . 1 1 59 59 GLN N N 59 118.110 118.110 119.241 -1.131 25085
3323 1 6 . 1 1 59 59 GLN HA H 59 5.479 5.479 5.329 0.150 25085
3324 1 6 . 1 1 59 59 GLN C C 59 174.322 174.322 175.063 -0.741 25085
3325 1 6 . 1 1 59 59 GLN CA C 59 55.486 55.486 54.939 0.547 25085
3326 1 6 . 1 1 59 59 GLN CB C 59 33.151 33.151 31.413 1.738 25085
3327 1 6 . 1 1 59 59 GLN H H 59 8.560 8.560 7.791 0.769 25085
3328 1 6 . 1 1 60 60 ILE N N 60 122.789 122.789 122.766 0.023 25085
3329 1 6 . 1 1 60 60 ILE HA H 60 4.531 4.531 4.779 -0.248 25085
3330 1 6 . 1 1 60 60 ILE C C 60 173.352 173.352 174.490 -1.138 25085
3331 1 6 . 1 1 60 60 ILE CA C 60 59.794 59.794 60.398 -0.604 25085
3332 1 6 . 1 1 60 60 ILE CB C 60 43.188 43.188 42.286 0.902 25085
3333 1 6 . 1 1 60 60 ILE H H 60 8.735 8.735 8.114 0.621 25085
3334 1 6 . 1 1 61 61 ILE N N 61 125.871 125.871 120.906 4.965 25085
3335 1 6 . 1 1 61 61 ILE HA H 61 5.002 5.002 5.071 -0.069 25085
3336 1 6 . 1 1 61 61 ILE C C 61 175.195 175.195 174.491 0.704 25085
3337 1 6 . 1 1 61 61 ILE CA C 61 58.419 58.419 59.821 -1.402 25085
3338 1 6 . 1 1 61 61 ILE CB C 61 40.270 40.270 41.719 -1.449 25085
3339 1 6 . 1 1 61 61 ILE H H 61 9.057 9.057 9.218 -0.161 25085
3340 1 6 . 1 1 62 62 PHE N N 62 123.742 123.742 124.959 -1.217 25085
3341 1 6 . 1 1 62 62 PHE HA H 62 5.810 5.810 5.788 0.022 25085
3342 1 6 . 1 1 62 62 PHE C C 62 176.135 176.135 174.873 1.262 25085
3343 1 6 . 1 1 62 62 PHE CA C 62 56.960 56.960 56.098 0.862 25085
3344 1 6 . 1 1 62 62 PHE CB C 62 43.352 43.352 43.124 0.228 25085
3345 1 6 . 1 1 62 62 PHE H H 62 8.977 8.977 8.350 0.627 25085
3346 1 6 . 1 1 63 63 HIS N N 63 116.939 116.939 118.591 -1.652 25085
3347 1 6 . 1 1 63 63 HIS HA H 63 5.979 5.979 5.166 0.813 25085
3348 1 6 . 1 1 63 63 HIS C C 63 171.108 171.108 174.048 -2.940 25085
3349 1 6 . 1 1 63 63 HIS CA C 63 54.115 54.115 54.219 -0.104 25085
3350 1 6 . 1 1 63 63 HIS CB C 63 36.861 36.861 32.112 4.749 25085
3351 1 6 . 1 1 63 63 HIS H H 63 9.298 9.298 8.614 0.684 25085
3352 1 6 . 1 1 64 64 CYS N N 64 119.251 119.251 121.335 -2.084 25085
3353 1 6 . 1 1 64 64 CYS HA H 64 5.044 5.044 5.049 -0.005 25085
3354 1 6 . 1 1 64 64 CYS C C 64 177.438 177.438 175.728 1.710 25085
3355 1 6 . 1 1 64 64 CYS CA C 64 56.886 56.886 57.068 -0.182 25085
3356 1 6 . 1 1 64 64 CYS CB C 64 29.425 29.425 31.056 -1.631 25085
3357 1 6 . 1 1 64 64 CYS H H 64 8.156 8.156 8.701 -0.545 25085
3358 1 6 . 1 1 65 65 GLN N N 65 125.627 125.627 124.339 1.288 25085
3359 1 6 . 1 1 65 65 GLN HA H 65 4.220 4.220 3.870 0.350 25085
3360 1 6 . 1 1 65 65 GLN C C 65 174.440 174.440 176.902 -2.462 25085
3361 1 6 . 1 1 65 65 GLN CA C 65 59.788 59.788 59.865 -0.078 25085
3362 1 6 . 1 1 65 65 GLN CB C 65 29.370 29.370 28.785 0.586 25085
3363 1 6 . 1 1 65 65 GLN H H 65 8.937 8.937 8.943 -0.006 25085
3364 1 6 . 1 1 66 66 ALA N N 66 118.880 118.880 118.341 0.539 25085
3365 1 6 . 1 1 66 66 ALA HA H 66 5.115 5.115 4.729 0.386 25085
3366 1 6 . 1 1 66 66 ALA C C 66 177.625 177.625 177.835 -0.210 25085
3367 1 6 . 1 1 66 66 ALA CA C 66 50.744 50.744 53.372 -2.628 25085
3368 1 6 . 1 1 66 66 ALA CB C 66 20.658 20.658 19.852 0.806 25085
3369 1 6 . 1 1 66 66 ALA H H 66 9.024 9.024 8.228 0.796 25085
3370 1 6 . 1 1 67 67 GLY N N 67 112.878 112.878 104.341 8.537 25085
3371 1 6 . 1 1 67 67 GLY C C 67 174.810 174.810 175.459 -0.649 25085
3372 1 6 . 1 1 67 67 GLY CA C 67 45.642 45.642 45.499 0.143 25085
3373 1 6 . 1 1 67 67 GLY H H 67 8.845 8.845 8.097 0.748 25085
3374 1 6 . 1 1 68 68 LYS N N 68 120.133 120.133 121.740 -1.607 25085
3375 1 6 . 1 1 68 68 LYS HA H 68 4.158 4.158 4.081 0.077 25085
3376 1 6 . 1 1 68 68 LYS C C 68 177.939 177.939 178.543 -0.604 25085
3377 1 6 . 1 1 68 68 LYS CA C 68 58.811 58.811 58.396 0.415 25085
3378 1 6 . 1 1 68 68 LYS CB C 68 32.796 32.796 32.242 0.554 25085
3379 1 6 . 1 1 68 68 LYS H H 68 7.936 7.936 8.333 -0.397 25085
3380 1 6 . 1 1 69 69 ARG N N 69 125.804 125.804 118.498 7.306 25085
3381 1 6 . 1 1 69 69 ARG HA H 69 4.217 4.217 4.126 0.091 25085
3382 1 6 . 1 1 69 69 ARG C C 69 180.944 180.944 178.119 2.825 25085
3383 1 6 . 1 1 69 69 ARG CA C 69 60.010 60.010 60.617 -0.607 25085
3384 1 6 . 1 1 69 69 ARG CB C 69 30.974 30.974 29.610 1.364 25085
3385 1 6 . 1 1 69 69 ARG H H 69 8.981 8.981 8.429 0.552 25085
3386 1 6 . 1 1 70 70 THR N N 70 116.681 116.681 115.123 1.558 25085
3387 1 6 . 1 1 70 70 THR HA H 70 3.607 3.607 3.924 -0.317 25085
3388 1 6 . 1 1 70 70 THR C C 70 176.434 176.434 176.510 -0.076 25085
3389 1 6 . 1 1 70 70 THR CA C 70 65.914 65.914 66.477 -0.563 25085
3390 1 6 . 1 1 70 70 THR CB C 70 68.169 68.169 68.530 -0.361 25085
3391 1 6 . 1 1 70 70 THR H H 70 10.382 10.382 8.229 2.153 25085
3392 1 6 . 1 1 71 71 SER N N 71 113.046 113.046 114.923 -1.877 25085
3393 1 6 . 1 1 71 71 SER HA H 71 3.993 3.993 4.189 -0.196 25085
3394 1 6 . 1 1 71 71 SER C C 71 177.594 177.594 175.861 1.733 25085
3395 1 6 . 1 1 71 71 SER CA C 71 62.500 62.500 61.235 1.265 25085
3396 1 6 . 1 1 71 71 SER H H 71 7.346 7.346 7.939 -0.593 25085
3397 1 6 . 1 1 72 72 ASN N N 72 117.540 117.540 118.536 -0.996 25085
3398 1 6 . 1 1 72 72 ASN HA H 72 4.598 4.598 4.656 -0.058 25085
3399 1 6 . 1 1 72 72 ASN C C 72 175.595 175.595 177.097 -1.502 25085
3400 1 6 . 1 1 72 72 ASN CA C 72 55.147 55.147 55.888 -0.741 25085
3401 1 6 . 1 1 72 72 ASN CB C 72 38.821 38.821 38.908 -0.088 25085
3402 1 6 . 1 1 72 72 ASN H H 72 8.078 8.078 7.796 0.282 25085
3403 1 6 . 1 1 73 73 ASN N N 73 114.869 114.869 118.593 -3.724 25085
3404 1 6 . 1 1 73 73 ASN HA H 73 5.159 5.159 4.546 0.613 25085
3405 1 6 . 1 1 73 73 ASN C C 73 174.375 174.375 176.168 -1.793 25085
3406 1 6 . 1 1 73 73 ASN CA C 73 52.976 52.976 54.365 -1.389 25085
3407 1 6 . 1 1 73 73 ASN CB C 73 39.862 39.862 38.806 1.056 25085
3408 1 6 . 1 1 73 73 ASN H H 73 7.290 7.290 8.773 -1.483 25085
3409 1 6 . 1 1 74 74 ALA N N 74 124.647 124.647 122.864 1.783 25085
3410 1 6 . 1 1 74 74 ALA HA H 74 3.721 3.721 3.910 -0.189 25085
3411 1 6 . 1 1 74 74 ALA C C 74 177.908 177.908 179.064 -1.156 25085
3412 1 6 . 1 1 74 74 ALA CA C 74 57.085 57.085 55.345 1.740 25085
3413 1 6 . 1 1 74 74 ALA CB C 74 19.427 19.427 18.220 1.208 25085
3414 1 6 . 1 1 74 74 ALA H H 74 7.105 7.105 8.726 -1.621 25085
3415 1 6 . 1 1 75 75 ASP N N 75 114.917 114.917 117.184 -2.267 25085
3416 1 6 . 1 1 75 75 ASP HA H 75 4.250 4.250 4.453 -0.203 25085
3417 1 6 . 1 1 75 75 ASP C C 75 179.100 179.100 178.615 0.485 25085
3418 1 6 . 1 1 75 75 ASP CA C 75 57.236 57.236 56.970 0.266 25085
3419 1 6 . 1 1 75 75 ASP CB C 75 39.783 39.783 40.402 -0.619 25085
3420 1 6 . 1 1 75 75 ASP H H 75 8.403 8.403 7.896 0.507 25085
3421 1 6 . 1 1 76 76 LYS N N 76 121.888 121.888 119.665 2.223 25085
3422 1 6 . 1 1 76 76 LYS HA H 76 4.053 4.053 4.148 -0.095 25085
3423 1 6 . 1 1 76 76 LYS C C 76 178.832 178.832 178.988 -0.156 25085
3424 1 6 . 1 1 76 76 LYS CA C 76 58.864 58.864 57.862 1.002 25085
3425 1 6 . 1 1 76 76 LYS CB C 76 32.423 32.423 32.298 0.125 25085
3426 1 6 . 1 1 76 76 LYS H H 76 7.652 7.652 7.901 -0.249 25085
3427 1 6 . 1 1 77 77 LEU N N 77 118.644 118.644 120.591 -1.947 25085
3428 1 6 . 1 1 77 77 LEU HA H 77 3.557 3.557 3.947 -0.390 25085
3429 1 6 . 1 1 77 77 LEU C C 77 178.068 178.068 178.439 -0.371 25085
3430 1 6 . 1 1 77 77 LEU CA C 77 57.692 57.692 57.943 -0.251 25085
3431 1 6 . 1 1 77 77 LEU CB C 77 40.077 40.077 41.404 -1.327 25085
3432 1 6 . 1 1 77 77 LEU H H 77 8.146 8.146 8.164 -0.018 25085
3433 1 6 . 1 1 78 78 ALA N N 78 119.668 119.668 120.444 -0.776 25085
3434 1 6 . 1 1 78 78 ALA HA H 78 3.990 3.990 3.939 0.051 25085
3435 1 6 . 1 1 78 78 ALA C C 78 179.542 179.542 179.328 0.214 25085
3436 1 6 . 1 1 78 78 ALA CA C 78 54.937 54.937 54.685 0.251 25085
3437 1 6 . 1 1 78 78 ALA CB C 78 18.080 18.080 18.013 0.067 25085
3438 1 6 . 1 1 78 78 ALA H H 78 8.136 8.136 8.030 0.106 25085
3439 1 6 . 1 1 79 79 ALA N N 79 118.918 118.918 120.377 -1.459 25085
3440 1 6 . 1 1 79 79 ALA HA H 79 4.139 4.139 4.121 0.018 25085
3441 1 6 . 1 1 79 79 ALA C C 79 180.800 180.800 179.235 1.565 25085
3442 1 6 . 1 1 79 79 ALA CA C 79 54.571 54.571 54.435 0.136 25085
3443 1 6 . 1 1 79 79 ALA CB C 79 18.268 18.268 18.541 -0.273 25085
3444 1 6 . 1 1 79 79 ALA H H 79 7.319 7.319 7.472 -0.153 25085
3445 1 6 . 1 1 80 80 ILE N N 80 118.438 118.438 118.312 0.126 25085
3446 1 6 . 1 1 80 80 ILE HA H 80 3.801 3.801 3.874 -0.073 25085
3447 1 6 . 1 1 80 80 ILE C C 80 177.302 177.302 177.697 -0.395 25085
3448 1 6 . 1 1 80 80 ILE CA C 80 64.252 64.252 63.462 0.791 25085
3449 1 6 . 1 1 80 80 ILE CB C 80 39.115 39.115 38.171 0.944 25085
3450 1 6 . 1 1 80 80 ILE H H 80 8.227 8.227 7.534 0.693 25085
3451 1 6 . 1 1 81 81 ALA N N 81 117.917 117.917 121.703 -3.786 25085
3452 1 6 . 1 1 81 81 ALA HA H 81 4.466 4.466 4.024 0.442 25085
3453 1 6 . 1 1 81 81 ALA C C 81 176.153 176.153 177.332 -1.179 25085
3454 1 6 . 1 1 81 81 ALA CA C 81 51.404 51.404 53.791 -2.388 25085
3455 1 6 . 1 1 81 81 ALA CB C 81 20.200 20.200 18.998 1.202 25085
3456 1 6 . 1 1 81 81 ALA H H 81 7.913 7.913 8.295 -0.382 25085
3457 1 6 . 1 1 82 82 ALA N N 82 124.086 124.086 119.091 4.995 25085
3458 1 6 . 1 1 82 82 ALA HA H 82 4.457 4.457 4.080 0.377 25085
3459 1 6 . 1 1 82 82 ALA CA C 82 52.276 52.276 51.840 0.436 25085
3460 1 6 . 1 1 82 82 ALA CB C 82 17.243 17.243 16.794 0.449 25085
3461 1 6 . 1 1 82 82 ALA H H 82 7.223 7.223 7.302 -0.079 25085
3462 1 6 . 1 1 83 83 PRO HA H 83 4.692 4.692 4.399 0.293 25085
3463 1 6 . 1 1 83 83 PRO C C 83 175.169 175.169 175.422 -0.253 25085
3464 1 6 . 1 1 83 83 PRO CA C 83 63.767 63.767 64.239 -0.472 25085
3465 1 6 . 1 1 83 83 PRO CB C 83 32.624 32.624 29.657 2.967 25085
3466 1 6 . 1 1 84 84 ALA N N 84 127.741 127.741 123.257 4.484 25085
3467 1 6 . 1 1 84 84 ALA HA H 84 4.138 4.138 4.594 -0.456 25085
3468 1 6 . 1 1 84 84 ALA C C 84 176.494 176.494 175.298 1.196 25085
3469 1 6 . 1 1 84 84 ALA CA C 84 53.432 53.432 50.422 3.010 25085
3470 1 6 . 1 1 84 84 ALA CB C 84 19.719 19.719 22.270 -2.551 25085
3471 1 6 . 1 1 84 84 ALA H H 84 8.528 8.528 8.652 -0.124 25085
3472 1 6 . 1 1 85 85 GLU N N 85 121.634 121.634 118.623 3.011 25085
3473 1 6 . 1 1 85 85 GLU HA H 85 4.228 4.228 4.648 -0.420 25085
3474 1 6 . 1 1 85 85 GLU C C 85 175.094 175.094 174.837 0.257 25085
3475 1 6 . 1 1 85 85 GLU CA C 85 56.444 56.444 54.991 1.453 25085
3476 1 6 . 1 1 85 85 GLU CB C 85 30.803 30.803 30.544 0.259 25085
3477 1 6 . 1 1 85 85 GLU H H 85 8.166 8.166 8.454 -0.288 25085
3478 1 6 . 1 1 86 86 ILE N N 86 122.543 122.543 123.130 -0.587 25085
3479 1 6 . 1 1 86 86 ILE HA H 86 5.269 5.269 5.074 0.195 25085
3480 1 6 . 1 1 86 86 ILE C C 86 174.463 174.463 174.586 -0.123 25085
3481 1 6 . 1 1 86 86 ILE CA C 86 59.329 59.329 60.156 -0.827 25085
3482 1 6 . 1 1 86 86 ILE CB C 86 40.546 40.546 41.309 -0.763 25085
3483 1 6 . 1 1 86 86 ILE H H 86 7.925 7.925 8.294 -0.369 25085
3484 1 6 . 1 1 87 87 PHE N N 87 122.457 122.457 122.686 -0.229 25085
3485 1 6 . 1 1 87 87 PHE HA H 87 5.428 5.428 5.796 -0.368 25085
3486 1 6 . 1 1 87 87 PHE C C 87 174.450 174.450 174.884 -0.434 25085
3487 1 6 . 1 1 87 87 PHE CA C 87 55.029 55.029 55.973 -0.944 25085
3488 1 6 . 1 1 87 87 PHE CB C 87 43.626 43.626 43.751 -0.125 25085
3489 1 6 . 1 1 87 87 PHE H H 87 9.050 9.050 8.504 0.546 25085
3490 1 6 . 1 1 88 88 LEU N N 88 119.959 119.959 118.316 1.643 25085
3491 1 6 . 1 1 88 88 LEU HA H 88 5.358 5.358 5.123 0.235 25085
3492 1 6 . 1 1 88 88 LEU C C 88 176.627 176.627 175.196 1.431 25085
3493 1 6 . 1 1 88 88 LEU CA C 88 52.654 52.654 53.549 -0.895 25085
3494 1 6 . 1 1 88 88 LEU CB C 88 43.094 43.094 46.050 -2.957 25085
3495 1 6 . 1 1 88 88 LEU H H 88 8.824 8.824 8.688 0.136 25085
3496 1 6 . 1 1 89 89 LEU N N 89 124.096 124.096 124.268 -0.172 25085
3497 1 6 . 1 1 89 89 LEU HA H 89 4.432 4.432 4.867 -0.435 25085
3498 1 6 . 1 1 89 89 LEU C C 89 176.693 176.693 175.912 0.781 25085
3499 1 6 . 1 1 89 89 LEU CA C 89 55.385 55.385 54.262 1.123 25085
3500 1 6 . 1 1 89 89 LEU CB C 89 43.537 43.537 43.249 0.288 25085
3501 1 6 . 1 1 89 89 LEU H H 89 8.293 8.293 8.249 0.044 25085
3502 1 6 . 1 1 90 90 GLU N N 90 102.942 102.942 127.683 -24.741 25085
3503 1 6 . 1 1 90 90 GLU HA H 90 3.895 3.895 4.149 -0.254 25085
3504 1 6 . 1 1 90 90 GLU C C 90 175.199 175.199 176.755 -1.556 25085
3505 1 6 . 1 1 90 90 GLU CA C 90 58.586 58.586 58.724 -0.139 25085
3506 1 6 . 1 1 90 90 GLU CB C 90 30.831 30.831 30.439 0.391 25085
3507 1 6 . 1 1 90 90 GLU H H 90 9.394 9.394 8.716 0.678 25085
3508 1 6 . 1 1 91 91 ASP N N 91 120.515 120.515 118.460 2.055 25085
3509 1 6 . 1 1 91 91 ASP HA H 91 4.184 4.184 4.350 -0.166 25085
3510 1 6 . 1 1 91 91 ASP C C 91 176.159 176.159 176.147 0.012 25085
3511 1 6 . 1 1 91 91 ASP CA C 91 55.814 55.814 56.449 -0.635 25085
3512 1 6 . 1 1 91 91 ASP CB C 91 39.033 39.033 40.160 -1.127 25085
3513 1 6 . 1 1 91 91 ASP H H 91 9.210 9.210 8.995 0.215 25085
3514 1 6 . 1 1 92 92 GLY N N 92 104.313 104.313 106.564 -2.251 25085
3515 1 6 . 1 1 92 92 GLY C C 92 172.980 172.980 174.889 -1.909 25085
3516 1 6 . 1 1 92 92 GLY CA C 92 46.946 46.946 44.546 2.400 25085
3517 1 6 . 1 1 92 92 GLY H H 92 7.902 7.902 7.776 0.126 25085
3518 1 6 . 1 1 93 93 ILE N N 93 121.445 121.445 122.335 -0.890 25085
3519 1 6 . 1 1 93 93 ILE HA H 93 3.902 3.902 3.835 0.067 25085
3520 1 6 . 1 1 93 93 ILE C C 93 176.528 176.528 176.625 -0.097 25085
3521 1 6 . 1 1 93 93 ILE CA C 93 63.908 63.908 64.035 -0.127 25085
3522 1 6 . 1 1 93 93 ILE CB C 93 38.416 38.416 38.169 0.247 25085
3523 1 6 . 1 1 93 93 ILE H H 93 8.129 8.129 8.471 -0.342 25085
3524 1 6 . 1 1 94 94 ASP N N 94 126.304 126.304 120.604 5.700 25085
3525 1 6 . 1 1 94 94 ASP HA H 94 4.436 4.436 4.305 0.131 25085
3526 1 6 . 1 1 94 94 ASP C C 94 180.174 180.174 178.417 1.757 25085
3527 1 6 . 1 1 94 94 ASP CA C 94 58.351 58.351 58.248 0.103 25085
3528 1 6 . 1 1 94 94 ASP CB C 94 39.223 39.223 40.272 -1.048 25085
3529 1 6 . 1 1 94 94 ASP H H 94 9.161 9.161 8.106 1.055 25085
3530 1 6 . 1 1 95 95 GLY N N 95 110.690 110.690 107.015 3.675 25085
3531 1 6 . 1 1 95 95 GLY C C 95 176.108 176.108 176.255 -0.147 25085
3532 1 6 . 1 1 95 95 GLY CA C 95 46.873 46.873 46.772 0.101 25085
3533 1 6 . 1 1 95 95 GLY H H 95 8.080 8.080 8.118 -0.038 25085
3534 1 6 . 1 1 96 96 TRP N N 96 126.965 126.965 123.099 3.866 25085
3535 1 6 . 1 1 96 96 TRP HA H 96 3.795 3.795 4.446 -0.651 25085
3536 1 6 . 1 1 96 96 TRP C C 96 177.058 177.058 176.337 0.721 25085
3537 1 6 . 1 1 96 96 TRP CA C 96 61.633 61.633 59.612 2.021 25085
3538 1 6 . 1 1 96 96 TRP CB C 96 29.512 29.512 29.681 -0.169 25085
3539 1 6 . 1 1 96 96 TRP H H 96 8.007 8.007 7.558 0.449 25085
3540 1 6 . 1 1 97 97 LYS N N 97 116.604 116.604 120.965 -4.361 25085
3541 1 6 . 1 1 97 97 LYS HA H 97 4.090 4.090 4.165 -0.075 25085
3542 1 6 . 1 1 97 97 LYS C C 97 182.010 182.010 179.358 2.652 25085
3543 1 6 . 1 1 97 97 LYS CA C 97 59.776 59.776 59.206 0.570 25085
3544 1 6 . 1 1 97 97 LYS CB C 97 32.208 32.208 32.560 -0.352 25085
3545 1 6 . 1 1 97 97 LYS H H 97 8.696 8.696 8.400 0.296 25085
3546 1 6 . 1 1 98 98 ARG N N 98 122.491 122.491 118.350 4.141 25085
3547 1 6 . 1 1 98 98 ARG HA H 98 4.050 4.050 4.116 -0.066 25085
3548 1 6 . 1 1 98 98 ARG C C 98 177.666 177.666 178.009 -0.343 25085
3549 1 6 . 1 1 98 98 ARG CA C 98 59.509 59.509 57.966 1.543 25085
3550 1 6 . 1 1 98 98 ARG CB C 98 30.471 30.471 30.559 -0.088 25085
3551 1 6 . 1 1 98 98 ARG H H 98 8.280 8.280 8.394 -0.114 25085
3552 1 6 . 1 1 99 99 ALA N N 99 119.546 119.546 118.569 0.977 25085
3553 1 6 . 1 1 99 99 ALA HA H 99 4.276 4.276 4.177 0.099 25085
3554 1 6 . 1 1 99 99 ALA C C 99 176.800 176.800 177.476 -0.676 25085
3555 1 6 . 1 1 99 99 ALA CA C 99 52.254 52.254 51.793 0.461 25085
3556 1 6 . 1 1 99 99 ALA CB C 99 18.270 18.270 18.377 -0.107 25085
3557 1 6 . 1 1 99 99 ALA H H 99 7.519 7.519 7.422 0.097 25085
3558 1 6 . 1 1 100 100 GLY N N 100 106.339 106.339 107.691 -1.352 25085
3559 1 6 . 1 1 100 100 GLY C C 100 174.232 174.232 174.094 0.138 25085
3560 1 6 . 1 1 100 100 GLY CA C 100 45.050 45.050 45.808 -0.758 25085
3561 1 6 . 1 1 100 100 GLY H H 100 7.926 7.926 7.316 0.610 25085
3562 1 6 . 1 1 101 101 LEU N N 101 122.181 122.181 122.345 -0.164 25085
3563 1 6 . 1 1 101 101 LEU HA H 101 4.286 4.286 4.363 -0.077 25085
3564 1 6 . 1 1 101 101 LEU CA C 101 53.183 53.183 50.812 2.371 25085
3565 1 6 . 1 1 101 101 LEU CB C 101 37.320 37.320 42.738 -5.418 25085
3566 1 6 . 1 1 101 101 LEU H H 101 6.976 6.976 7.290 -0.314 25085
3567 1 6 . 1 1 102 102 PRO HA H 102 4.476 4.476 4.313 0.163 25085
3568 1 6 . 1 1 102 102 PRO C C 102 177.424 177.424 175.732 1.692 25085
3569 1 6 . 1 1 102 102 PRO CA C 102 64.014 64.014 64.206 -0.192 25085
3570 1 6 . 1 1 102 102 PRO CB C 102 33.200 33.200 32.048 1.152 25085
3571 1 6 . 1 1 103 103 VAL N N 103 110.512 110.512 119.897 -9.385 25085
3572 1 6 . 1 1 103 103 VAL HA H 103 4.643 4.643 4.305 0.338 25085
3573 1 6 . 1 1 103 103 VAL C C 103 174.297 174.297 174.065 0.232 25085
3574 1 6 . 1 1 103 103 VAL CA C 103 59.693 59.693 60.096 -0.403 25085
3575 1 6 . 1 1 103 103 VAL CB C 103 35.980 35.980 36.128 -0.148 25085
3576 1 6 . 1 1 103 103 VAL H H 103 8.073 8.073 8.153 -0.080 25085
3577 1 6 . 1 1 104 104 ALA N N 104 125.898 125.898 129.477 -3.579 25085
3578 1 6 . 1 1 104 104 ALA HA H 104 4.550 4.550 4.632 -0.082 25085
3579 1 6 . 1 1 104 104 ALA C C 104 176.190 176.190 174.625 1.565 25085
3580 1 6 . 1 1 104 104 ALA CA C 104 50.699 50.699 51.077 -0.378 25085
3581 1 6 . 1 1 104 104 ALA CB C 104 19.534 19.534 22.051 -2.517 25085
3582 1 6 . 1 1 104 104 ALA H H 104 8.996 8.996 8.752 0.244 25085
3583 1 6 . 1 1 105 105 VAL N N 105 119.534 119.534 122.182 -2.648 25085
3584 1 6 . 1 1 105 105 VAL HA H 105 4.615 4.615 4.135 0.480 25085
3585 1 6 . 1 1 105 105 VAL C C 105 175.576 175.576 175.525 0.051 25085
3586 1 6 . 1 1 105 105 VAL CA C 105 60.234 60.234 60.640 -0.406 25085
3587 1 6 . 1 1 105 105 VAL CB C 105 34.683 34.683 32.813 1.869 25085
3588 1 6 . 1 1 105 105 VAL H H 105 8.276 8.276 8.302 -0.026 25085
3589 1 6 . 1 1 106 106 ASN N N 106 123.346 123.346 126.632 -3.286 25085
3590 1 6 . 1 1 106 106 ASN HA H 106 4.748 4.748 4.777 -0.029 25085
3591 1 6 . 1 1 106 106 ASN C C 106 173.877 173.877 174.166 -0.289 25085
3592 1 6 . 1 1 106 106 ASN CA C 106 53.465 53.465 53.385 0.080 25085
3593 1 6 . 1 1 106 106 ASN CB C 106 39.424 39.424 39.138 0.286 25085
3594 1 6 . 1 1 106 106 ASN H H 106 8.190 8.190 8.418 -0.228 25085
3595 1 7 . 1 1 2 2 ALA N N 2 125.104 125.104 125.921 -0.817 25085
3596 1 7 . 1 1 2 2 ALA HA H 2 4.287 4.287 4.513 -0.226 25085
3597 1 7 . 1 1 2 2 ALA C C 2 176.800 176.800 177.271 -0.471 25085
3598 1 7 . 1 1 2 2 ALA CA C 2 52.429 52.429 51.848 0.581 25085
3599 1 7 . 1 1 2 2 ALA CB C 2 19.407 19.407 18.896 0.511 25085
3600 1 7 . 1 1 2 2 ALA H H 2 8.344 8.344 8.173 0.171 25085
3601 1 7 . 1 1 3 3 LEU N N 3 120.515 120.515 118.960 1.555 25085
3602 1 7 . 1 1 3 3 LEU HA H 3 4.452 4.452 4.408 0.044 25085
3603 1 7 . 1 1 3 3 LEU C C 3 176.497 176.497 176.441 0.056 25085
3604 1 7 . 1 1 3 3 LEU CA C 3 54.698 54.698 55.283 -0.585 25085
3605 1 7 . 1 1 3 3 LEU CB C 3 43.203 43.203 41.133 2.070 25085
3606 1 7 . 1 1 3 3 LEU H H 3 8.070 8.070 7.605 0.465 25085
3607 1 7 . 1 1 4 4 THR N N 4 117.803 117.803 121.087 -3.284 25085
3608 1 7 . 1 1 4 4 THR HA H 4 4.480 4.480 4.780 -0.300 25085
3609 1 7 . 1 1 4 4 THR C C 4 173.872 173.872 173.986 -0.114 25085
3610 1 7 . 1 1 4 4 THR CA C 4 62.247 62.247 60.988 1.259 25085
3611 1 7 . 1 1 4 4 THR CB C 4 70.533 70.533 71.685 -1.152 25085
3612 1 7 . 1 1 4 4 THR H H 4 7.954 7.954 8.610 -0.656 25085
3613 1 7 . 1 1 5 5 THR N N 5 121.501 121.501 114.367 7.134 25085
3614 1 7 . 1 1 5 5 THR HA H 5 5.289 5.289 4.571 0.718 25085
3615 1 7 . 1 1 5 5 THR C C 5 174.162 174.162 173.587 0.575 25085
3616 1 7 . 1 1 5 5 THR CA C 5 62.102 62.102 61.602 0.499 25085
3617 1 7 . 1 1 5 5 THR CB C 5 69.457 69.457 69.684 -0.228 25085
3618 1 7 . 1 1 5 5 THR H H 5 8.640 8.640 8.425 0.215 25085
3619 1 7 . 1 1 6 6 ILE N N 6 122.023 122.023 122.833 -0.810 25085
3620 1 7 . 1 1 6 6 ILE HA H 6 4.988 4.988 4.513 0.475 25085
3621 1 7 . 1 1 6 6 ILE C C 6 173.377 173.377 173.990 -0.613 25085
3622 1 7 . 1 1 6 6 ILE CA C 6 58.611 58.611 59.818 -1.207 25085
3623 1 7 . 1 1 6 6 ILE CB C 6 42.821 42.821 42.407 0.414 25085
3624 1 7 . 1 1 6 6 ILE H H 6 8.977 8.977 9.342 -0.365 25085
3625 1 7 . 1 1 7 7 SER N N 7 122.659 122.659 118.861 3.798 25085
3626 1 7 . 1 1 7 7 SER HA H 7 4.768 4.768 5.110 -0.342 25085
3627 1 7 . 1 1 7 7 SER CA C 7 56.790 56.790 54.916 1.873 25085
3628 1 7 . 1 1 7 7 SER CB C 7 63.235 63.235 64.463 -1.228 25085
3629 1 7 . 1 1 7 7 SER H H 7 9.242 9.242 8.698 0.544 25085
3630 1 7 . 1 1 8 8 PRO HA H 8 4.207 4.207 4.323 -0.116 25085
3631 1 7 . 1 1 8 8 PRO C C 8 176.787 176.787 178.240 -1.453 25085
3632 1 7 . 1 1 8 8 PRO CA C 8 66.443 66.443 65.397 1.046 25085
3633 1 7 . 1 1 8 8 PRO CB C 8 32.724 32.724 31.872 0.852 25085
3634 1 7 . 1 1 9 9 HIS N N 9 113.700 113.700 115.002 -1.302 25085
3635 1 7 . 1 1 9 9 HIS HA H 9 3.990 3.990 4.346 -0.356 25085
3636 1 7 . 1 1 9 9 HIS C C 9 178.123 178.123 177.034 1.089 25085
3637 1 7 . 1 1 9 9 HIS CA C 9 60.827 60.827 58.897 1.930 25085
3638 1 7 . 1 1 9 9 HIS CB C 9 29.552 29.552 29.872 -0.320 25085
3639 1 7 . 1 1 9 9 HIS H H 9 8.172 8.172 8.259 -0.087 25085
3640 1 7 . 1 1 10 10 ASP N N 10 120.665 120.665 120.102 0.563 25085
3641 1 7 . 1 1 10 10 ASP HA H 10 4.369 4.369 4.530 -0.161 25085
3642 1 7 . 1 1 10 10 ASP C C 10 179.100 179.100 177.920 1.180 25085
3643 1 7 . 1 1 10 10 ASP CA C 10 57.071 57.071 57.236 -0.165 25085
3644 1 7 . 1 1 10 10 ASP CB C 10 39.529 39.529 41.208 -1.679 25085
3645 1 7 . 1 1 10 10 ASP H H 10 7.706 7.706 8.671 -0.965 25085
3646 1 7 . 1 1 11 11 ALA N N 11 123.686 123.686 122.415 1.271 25085
3647 1 7 . 1 1 11 11 ALA HA H 11 3.782 3.782 3.849 -0.067 25085
3648 1 7 . 1 1 11 11 ALA C C 11 178.260 178.260 179.079 -0.819 25085
3649 1 7 . 1 1 11 11 ALA CA C 11 55.142 55.142 55.393 -0.251 25085
3650 1 7 . 1 1 11 11 ALA CB C 11 18.293 18.293 18.189 0.104 25085
3651 1 7 . 1 1 11 11 ALA H H 11 8.896 8.896 7.558 1.338 25085
3652 1 7 . 1 1 12 12 GLN N N 12 117.521 117.521 117.977 -0.456 25085
3653 1 7 . 1 1 12 12 GLN HA H 12 4.000 4.000 4.046 -0.046 25085
3654 1 7 . 1 1 12 12 GLN C C 12 178.499 178.499 178.304 0.195 25085
3655 1 7 . 1 1 12 12 GLN CA C 12 60.102 60.102 59.466 0.636 25085
3656 1 7 . 1 1 12 12 GLN CB C 12 28.743 28.743 28.502 0.241 25085
3657 1 7 . 1 1 12 12 GLN H H 12 8.431 8.431 7.907 0.524 25085
3658 1 7 . 1 1 13 13 GLU N N 13 118.578 118.578 117.642 0.936 25085
3659 1 7 . 1 1 13 13 GLU HA H 13 4.059 4.059 4.018 0.041 25085
3660 1 7 . 1 1 13 13 GLU C C 13 178.352 178.352 178.808 -0.456 25085
3661 1 7 . 1 1 13 13 GLU CA C 13 59.079 59.079 58.775 0.304 25085
3662 1 7 . 1 1 13 13 GLU CB C 13 29.213 29.213 28.993 0.220 25085
3663 1 7 . 1 1 13 13 GLU H H 13 7.234 7.234 7.747 -0.513 25085
3664 1 7 . 1 1 14 14 LEU N N 14 119.848 119.848 119.308 0.540 25085
3665 1 7 . 1 1 14 14 LEU HA H 14 3.891 3.891 4.119 -0.228 25085
3666 1 7 . 1 1 14 14 LEU C C 14 180.773 180.773 178.904 1.869 25085
3667 1 7 . 1 1 14 14 LEU CA C 14 57.958 57.958 57.071 0.887 25085
3668 1 7 . 1 1 14 14 LEU CB C 14 41.715 41.715 41.995 -0.280 25085
3669 1 7 . 1 1 14 14 LEU H H 14 7.582 7.582 7.587 -0.005 25085
3670 1 7 . 1 1 15 15 ILE N N 15 122.392 122.392 118.587 3.805 25085
3671 1 7 . 1 1 15 15 ILE HA H 15 3.924 3.924 3.651 0.273 25085
3672 1 7 . 1 1 15 15 ILE C C 15 180.109 180.109 177.814 2.295 25085
3673 1 7 . 1 1 15 15 ILE CA C 15 64.663 64.663 64.440 0.223 25085
3674 1 7 . 1 1 15 15 ILE CB C 15 38.900 38.900 37.708 1.192 25085
3675 1 7 . 1 1 15 15 ILE H H 15 8.772 8.772 8.218 0.554 25085
3676 1 7 . 1 1 16 16 ALA N N 16 123.856 123.856 119.651 4.205 25085
3677 1 7 . 1 1 16 16 ALA HA H 16 4.183 4.183 4.187 -0.004 25085
3678 1 7 . 1 1 16 16 ALA C C 16 179.100 179.100 178.549 0.551 25085
3679 1 7 . 1 1 16 16 ALA CA C 16 54.806 54.806 53.820 0.986 25085
3680 1 7 . 1 1 16 16 ALA CB C 16 17.646 17.646 18.667 -1.021 25085
3681 1 7 . 1 1 16 16 ALA H H 16 7.808 7.808 7.431 0.377 25085
3682 1 7 . 1 1 17 17 ARG N N 17 115.329 115.329 117.789 -2.460 25085
3683 1 7 . 1 1 17 17 ARG HA H 17 4.404 4.404 4.354 0.050 25085
3684 1 7 . 1 1 17 17 ARG C C 17 176.446 176.446 177.117 -0.671 25085
3685 1 7 . 1 1 17 17 ARG CA C 17 56.015 56.015 56.823 -0.808 25085
3686 1 7 . 1 1 17 17 ARG CB C 17 30.676 30.676 31.367 -0.691 25085
3687 1 7 . 1 1 17 17 ARG H H 17 7.280 7.280 8.466 -1.186 25085
3688 1 7 . 1 1 18 18 GLY N N 18 107.395 107.395 105.862 1.533 25085
3689 1 7 . 1 1 18 18 GLY C C 18 174.072 174.072 173.814 0.258 25085
3690 1 7 . 1 1 18 18 GLY CA C 18 45.218 45.218 44.541 0.677 25085
3691 1 7 . 1 1 18 18 GLY H H 18 7.795 7.795 8.309 -0.514 25085
3692 1 7 . 1 1 19 19 ALA N N 19 123.197 123.197 122.152 1.045 25085
3693 1 7 . 1 1 19 19 ALA HA H 19 4.217 4.217 4.384 -0.167 25085
3694 1 7 . 1 1 19 19 ALA C C 19 176.261 176.261 177.184 -0.923 25085
3695 1 7 . 1 1 19 19 ALA CA C 19 52.674 52.674 52.251 0.423 25085
3696 1 7 . 1 1 19 19 ALA CB C 19 19.411 19.411 20.131 -0.721 25085
3697 1 7 . 1 1 19 19 ALA H H 19 7.980 7.980 7.487 0.493 25085
3698 1 7 . 1 1 20 20 LYS N N 20 118.629 118.629 119.794 -1.165 25085
3699 1 7 . 1 1 20 20 LYS HA H 20 4.308 4.308 4.460 -0.152 25085
3700 1 7 . 1 1 20 20 LYS C C 20 173.981 173.981 174.686 -0.705 25085
3701 1 7 . 1 1 20 20 LYS CA C 20 53.820 53.820 54.978 -1.158 25085
3702 1 7 . 1 1 20 20 LYS CB C 20 33.571 33.571 33.419 0.152 25085
3703 1 7 . 1 1 20 20 LYS H H 20 7.589 7.589 8.183 -0.594 25085
3704 1 7 . 1 1 21 21 LEU N N 21 126.686 126.686 125.953 0.733 25085
3705 1 7 . 1 1 21 21 LEU HA H 21 5.154 5.154 5.041 0.113 25085
3706 1 7 . 1 1 21 21 LEU C C 21 174.076 174.076 176.082 -2.006 25085
3707 1 7 . 1 1 21 21 LEU CA C 21 53.262 53.262 54.991 -1.729 25085
3708 1 7 . 1 1 21 21 LEU CB C 21 44.350 44.350 42.926 1.424 25085
3709 1 7 . 1 1 21 21 LEU H H 21 8.812 8.812 8.736 0.076 25085
3710 1 7 . 1 1 22 22 ILE N N 22 127.566 127.566 122.060 5.506 25085
3711 1 7 . 1 1 22 22 ILE HA H 22 4.678 4.678 4.946 -0.268 25085
3712 1 7 . 1 1 22 22 ILE C C 22 173.136 173.136 173.761 -0.625 25085
3713 1 7 . 1 1 22 22 ILE CA C 22 60.160 60.160 59.245 0.915 25085
3714 1 7 . 1 1 22 22 ILE CB C 22 39.842 39.842 41.490 -1.648 25085
3715 1 7 . 1 1 22 22 ILE H H 22 9.416 9.416 8.969 0.447 25085
3716 1 7 . 1 1 23 23 ASP N N 23 129.217 129.217 124.023 5.194 25085
3717 1 7 . 1 1 23 23 ASP HA H 23 3.806 3.806 5.010 -1.204 25085
3718 1 7 . 1 1 23 23 ASP C C 23 176.042 176.042 175.236 0.806 25085
3719 1 7 . 1 1 23 23 ASP CA C 23 52.005 52.005 52.328 -0.323 25085
3720 1 7 . 1 1 23 23 ASP CB C 23 42.984 42.984 43.615 -0.631 25085
3721 1 7 . 1 1 23 23 ASP H H 23 8.619 8.619 8.673 -0.054 25085
3722 1 7 . 1 1 24 24 ILE N N 24 115.522 115.522 119.105 -3.583 25085
3723 1 7 . 1 1 24 24 ILE HA H 24 5.255 5.255 4.850 0.405 25085
3724 1 7 . 1 1 24 24 ILE C C 24 178.920 178.920 173.419 5.501 25085
3725 1 7 . 1 1 24 24 ILE CA C 24 60.188 60.188 59.489 0.699 25085
3726 1 7 . 1 1 24 24 ILE CB C 24 38.015 38.015 38.120 -0.104 25085
3727 1 7 . 1 1 24 24 ILE H H 24 7.877 7.877 7.843 0.034 25085
3728 1 7 . 1 1 25 25 ARG N N 25 124.317 124.317 123.031 1.286 25085
3729 1 7 . 1 1 25 25 ARG HA H 25 4.170 4.170 4.494 -0.324 25085
3730 1 7 . 1 1 25 25 ARG C C 25 171.756 171.756 174.243 -2.487 25085
3731 1 7 . 1 1 25 25 ARG CA C 25 56.547 56.547 55.184 1.363 25085
3732 1 7 . 1 1 25 25 ARG CB C 25 30.897 30.897 30.698 0.199 25085
3733 1 7 . 1 1 25 25 ARG H H 25 8.235 8.235 7.712 0.523 25085
3734 1 7 . 1 1 26 26 ASP N N 26 112.059 112.059 121.217 -9.158 25085
3735 1 7 . 1 1 26 26 ASP HA H 26 4.609 4.609 4.937 -0.328 25085
3736 1 7 . 1 1 26 26 ASP C C 26 177.934 177.934 177.005 0.929 25085
3737 1 7 . 1 1 26 26 ASP CA C 26 54.398 54.398 53.245 1.153 25085
3738 1 7 . 1 1 26 26 ASP CB C 26 42.029 42.029 40.593 1.436 25085
3739 1 7 . 1 1 26 26 ASP H H 26 7.730 7.730 8.624 -0.894 25085
3740 1 7 . 1 1 27 27 ALA N N 27 121.435 121.435 128.054 -6.619 25085
3741 1 7 . 1 1 27 27 ALA HA H 27 3.959 3.959 3.942 0.017 25085
3742 1 7 . 1 1 27 27 ALA C C 27 179.388 179.388 178.817 0.571 25085
3743 1 7 . 1 1 27 27 ALA CA C 27 55.829 55.829 55.400 0.429 25085
3744 1 7 . 1 1 27 27 ALA CB C 27 18.572 18.572 18.258 0.314 25085
3745 1 7 . 1 1 27 27 ALA H H 27 8.797 8.797 8.927 -0.130 25085
3746 1 7 . 1 1 28 28 ASP N N 28 114.759 114.759 118.000 -3.241 25085
3747 1 7 . 1 1 28 28 ASP HA H 28 4.314 4.314 4.416 -0.102 25085
3748 1 7 . 1 1 28 28 ASP C C 28 178.738 178.738 178.951 -0.213 25085
3749 1 7 . 1 1 28 28 ASP CA C 28 56.997 56.997 57.135 -0.138 25085
3750 1 7 . 1 1 28 28 ASP CB C 28 39.811 39.811 40.465 -0.654 25085
3751 1 7 . 1 1 28 28 ASP H H 28 8.755 8.755 8.644 0.111 25085
3752 1 7 . 1 1 29 29 GLU N N 29 119.562 119.562 118.656 0.906 25085
3753 1 7 . 1 1 29 29 GLU HA H 29 4.116 4.116 4.207 -0.091 25085
3754 1 7 . 1 1 29 29 GLU C C 29 178.473 178.473 178.663 -0.190 25085
3755 1 7 . 1 1 29 29 GLU CA C 29 58.928 58.928 58.588 0.340 25085
3756 1 7 . 1 1 29 29 GLU CB C 29 29.395 29.395 30.267 -0.872 25085
3757 1 7 . 1 1 29 29 GLU H H 29 7.446 7.446 8.797 -1.351 25085
3758 1 7 . 1 1 30 30 TYR N N 30 120.494 120.494 119.911 0.583 25085
3759 1 7 . 1 1 30 30 TYR HA H 30 4.092 4.092 4.587 -0.495 25085
3760 1 7 . 1 1 30 30 TYR C C 30 176.988 176.988 177.435 -0.447 25085
3761 1 7 . 1 1 30 30 TYR CA C 30 60.931 60.931 60.383 0.548 25085
3762 1 7 . 1 1 30 30 TYR CB C 30 39.534 39.534 39.106 0.428 25085
3763 1 7 . 1 1 30 30 TYR H H 30 7.545 7.545 7.532 0.013 25085
3764 1 7 . 1 1 31 31 LEU N N 31 118.227 118.227 119.808 -1.581 25085
3765 1 7 . 1 1 31 31 LEU HA H 31 3.916 3.916 3.888 0.028 25085
3766 1 7 . 1 1 31 31 LEU C C 31 178.824 178.824 178.341 0.483 25085
3767 1 7 . 1 1 31 31 LEU CA C 31 57.444 57.444 58.096 -0.652 25085
3768 1 7 . 1 1 31 31 LEU CB C 31 41.941 41.941 42.214 -0.273 25085
3769 1 7 . 1 1 31 31 LEU H H 31 8.235 8.235 8.908 -0.673 25085
3770 1 7 . 1 1 32 32 ARG N N 32 117.334 117.334 116.826 0.508 25085
3771 1 7 . 1 1 32 32 ARG HA H 32 4.112 4.112 4.086 0.026 25085
3772 1 7 . 1 1 32 32 ARG C C 32 177.008 177.008 175.827 1.181 25085
3773 1 7 . 1 1 32 32 ARG CA C 32 59.366 59.366 58.269 1.097 25085
3774 1 7 . 1 1 32 32 ARG CB C 32 30.938 30.938 30.749 0.189 25085
3775 1 7 . 1 1 32 32 ARG H H 32 7.133 7.133 7.558 -0.425 25085
3776 1 7 . 1 1 33 33 GLU N N 33 117.282 117.282 116.904 0.378 25085
3777 1 7 . 1 1 33 33 GLU HA H 33 4.893 4.893 4.494 0.399 25085
3778 1 7 . 1 1 33 33 GLU C C 33 173.503 173.503 173.843 -0.340 25085
3779 1 7 . 1 1 33 33 GLU CA C 33 56.291 56.291 56.029 0.263 25085
3780 1 7 . 1 1 33 33 GLU CB C 33 32.248 32.248 32.477 -0.229 25085
3781 1 7 . 1 1 33 33 GLU H H 33 7.521 7.521 7.219 0.302 25085
3782 1 7 . 1 1 34 34 HIS N N 34 117.828 117.828 120.048 -2.220 25085
3783 1 7 . 1 1 34 34 HIS HA H 34 4.627 4.627 3.934 0.693 25085
3784 1 7 . 1 1 34 34 HIS C C 34 171.950 171.950 173.094 -1.144 25085
3785 1 7 . 1 1 34 34 HIS CA C 34 54.304 54.304 53.200 1.104 25085
3786 1 7 . 1 1 34 34 HIS CB C 34 30.712 30.712 32.567 -1.855 25085
3787 1 7 . 1 1 34 34 HIS H H 34 8.354 8.354 8.897 -0.543 25085
3788 1 7 . 1 1 35 35 ILE N N 35 126.965 126.965 119.330 7.635 25085
3789 1 7 . 1 1 35 35 ILE HA H 35 3.973 3.973 4.227 -0.254 25085
3790 1 7 . 1 1 35 35 ILE CA C 35 60.500 60.500 58.009 2.491 25085
3791 1 7 . 1 1 35 35 ILE CB C 35 38.822 38.822 38.665 0.157 25085
3792 1 7 . 1 1 35 35 ILE H H 35 10.032 10.032 8.524 1.508 25085
3793 1 7 . 1 1 36 36 PRO HA H 36 4.033 4.033 4.550 -0.517 25085
3794 1 7 . 1 1 36 36 PRO C C 36 177.308 177.308 176.268 1.040 25085
3795 1 7 . 1 1 36 36 PRO CA C 36 66.191 66.191 63.427 2.764 25085
3796 1 7 . 1 1 36 36 PRO CB C 36 31.701 31.701 31.403 0.298 25085
3797 1 7 . 1 1 37 37 GLU N N 37 113.735 113.735 117.575 -3.840 25085
3798 1 7 . 1 1 37 37 GLU HA H 37 4.083 4.083 4.513 -0.430 25085
3799 1 7 . 1 1 37 37 GLU C C 37 176.274 176.274 174.706 1.568 25085
3800 1 7 . 1 1 37 37 GLU CA C 37 58.285 58.285 55.916 2.369 25085
3801 1 7 . 1 1 37 37 GLU CB C 37 28.895 28.895 29.972 -1.077 25085
3802 1 7 . 1 1 37 37 GLU H H 37 8.625 8.625 8.346 0.279 25085
3803 1 7 . 1 1 38 38 ALA N N 38 122.325 122.325 121.006 1.319 25085
3804 1 7 . 1 1 38 38 ALA HA H 38 4.484 4.484 4.622 -0.138 25085
3805 1 7 . 1 1 38 38 ALA C C 38 178.043 178.043 175.239 2.804 25085
3806 1 7 . 1 1 38 38 ALA CA C 38 52.385 52.385 51.141 1.244 25085
3807 1 7 . 1 1 38 38 ALA CB C 38 21.151 21.151 21.685 -0.534 25085
3808 1 7 . 1 1 38 38 ALA H H 38 8.160 8.160 7.352 0.808 25085
3809 1 7 . 1 1 39 39 ASP N N 39 123.726 123.726 120.615 3.111 25085
3810 1 7 . 1 1 39 39 ASP HA H 39 4.856 4.856 4.793 0.063 25085
3811 1 7 . 1 1 39 39 ASP C C 39 174.077 174.077 175.122 -1.045 25085
3812 1 7 . 1 1 39 39 ASP CA C 39 53.498 53.498 53.788 -0.290 25085
3813 1 7 . 1 1 39 39 ASP CB C 39 45.176 45.176 43.600 1.576 25085
3814 1 7 . 1 1 39 39 ASP H H 39 9.095 9.095 8.833 0.262 25085
3815 1 7 . 1 1 40 40 LEU N N 40 123.111 123.111 125.027 -1.916 25085
3816 1 7 . 1 1 40 40 LEU HA H 40 4.339 4.339 4.347 -0.008 25085
3817 1 7 . 1 1 40 40 LEU C C 40 176.159 176.159 175.335 0.824 25085
3818 1 7 . 1 1 40 40 LEU CA C 40 54.766 54.766 54.407 0.359 25085
3819 1 7 . 1 1 40 40 LEU CB C 40 41.988 41.988 43.154 -1.166 25085
3820 1 7 . 1 1 40 40 LEU H H 40 8.199 8.199 8.368 -0.169 25085
3821 1 7 . 1 1 41 41 ALA N N 41 130.678 130.678 130.291 0.387 25085
3822 1 7 . 1 1 41 41 ALA HA H 41 4.430 4.430 4.728 -0.298 25085
3823 1 7 . 1 1 41 41 ALA CA C 41 49.844 49.844 49.543 0.301 25085
3824 1 7 . 1 1 41 41 ALA CB C 41 18.765 18.765 19.752 -0.987 25085
3825 1 7 . 1 1 41 41 ALA H H 41 8.705 8.705 8.300 0.405 25085
3826 1 7 . 1 1 42 42 PRO HA H 42 4.133 4.133 4.437 -0.304 25085
3827 1 7 . 1 1 42 42 PRO C C 42 178.946 178.946 177.920 1.026 25085
3828 1 7 . 1 1 42 42 PRO CA C 42 62.119 62.119 63.003 -0.884 25085
3829 1 7 . 1 1 42 42 PRO CB C 42 33.383 33.383 31.821 1.562 25085
3830 1 7 . 1 1 43 43 LEU N N 43 124.604 124.604 124.431 0.173 25085
3831 1 7 . 1 1 43 43 LEU HA H 43 3.881 3.881 3.876 0.005 25085
3832 1 7 . 1 1 43 43 LEU C C 43 176.869 176.869 178.032 -1.163 25085
3833 1 7 . 1 1 43 43 LEU CA C 43 58.639 58.639 58.090 0.549 25085
3834 1 7 . 1 1 43 43 LEU CB C 43 41.848 41.848 41.456 0.392 25085
3835 1 7 . 1 1 43 43 LEU H H 43 8.330 8.330 8.559 -0.229 25085
3836 1 7 . 1 1 44 44 SER N N 44 110.167 110.167 113.171 -3.004 25085
3837 1 7 . 1 1 44 44 SER HA H 44 4.147 4.147 4.137 0.010 25085
3838 1 7 . 1 1 44 44 SER C C 44 177.107 177.107 176.378 0.729 25085
3839 1 7 . 1 1 44 44 SER CA C 44 61.043 61.043 60.846 0.197 25085
3840 1 7 . 1 1 44 44 SER CB C 44 61.765 61.765 62.886 -1.121 25085
3841 1 7 . 1 1 44 44 SER H H 44 8.553 8.553 7.962 0.591 25085
3842 1 7 . 1 1 45 45 VAL N N 45 123.549 123.549 123.096 0.453 25085
3843 1 7 . 1 1 45 45 VAL HA H 45 3.825 3.825 3.833 -0.008 25085
3844 1 7 . 1 1 45 45 VAL C C 45 178.328 178.328 177.130 1.198 25085
3845 1 7 . 1 1 45 45 VAL CA C 45 65.576 65.576 66.156 -0.580 25085
3846 1 7 . 1 1 45 45 VAL CB C 45 31.889 31.889 32.109 -0.220 25085
3847 1 7 . 1 1 45 45 VAL H H 45 7.181 7.181 8.582 -1.401 25085
3848 1 7 . 1 1 46 46 LEU N N 46 120.336 120.336 119.673 0.663 25085
3849 1 7 . 1 1 46 46 LEU HA H 46 3.826 3.826 4.110 -0.284 25085
3850 1 7 . 1 1 46 46 LEU C C 46 179.996 179.996 177.996 2.000 25085
3851 1 7 . 1 1 46 46 LEU CA C 46 57.602 57.602 57.517 0.085 25085
3852 1 7 . 1 1 46 46 LEU CB C 46 41.691 41.691 41.946 -0.254 25085
3853 1 7 . 1 1 46 46 LEU H H 46 8.040 8.040 7.659 0.381 25085
3854 1 7 . 1 1 47 47 GLU N N 47 115.713 115.713 118.088 -2.375 25085
3855 1 7 . 1 1 47 47 GLU HA H 47 3.820 3.820 4.072 -0.252 25085
3856 1 7 . 1 1 47 47 GLU C C 47 177.029 177.029 178.119 -1.090 25085
3857 1 7 . 1 1 47 47 GLU CA C 47 59.317 59.317 58.828 0.489 25085
3858 1 7 . 1 1 47 47 GLU CB C 47 30.526 30.526 29.882 0.644 25085
3859 1 7 . 1 1 47 47 GLU H H 47 8.567 8.567 7.667 0.900 25085
3860 1 7 . 1 1 48 48 GLN N N 48 116.740 116.740 116.931 -0.191 25085
3861 1 7 . 1 1 48 48 GLN HA H 48 4.281 4.281 4.325 -0.044 25085
3862 1 7 . 1 1 48 48 GLN C C 48 177.605 177.605 178.013 -0.408 25085
3863 1 7 . 1 1 48 48 GLN CA C 48 57.827 57.827 56.925 0.902 25085
3864 1 7 . 1 1 48 48 GLN CB C 48 29.985 29.985 29.363 0.622 25085
3865 1 7 . 1 1 48 48 GLN H H 48 7.472 7.472 7.703 -0.231 25085
3866 1 7 . 1 1 49 49 SER N N 49 111.004 111.004 115.386 -4.382 25085
3867 1 7 . 1 1 49 49 SER HA H 49 4.648 4.648 4.299 0.349 25085
3868 1 7 . 1 1 49 49 SER C C 49 174.859 174.859 174.999 -0.140 25085
3869 1 7 . 1 1 49 49 SER CA C 49 58.406 58.406 60.044 -1.638 25085
3870 1 7 . 1 1 49 49 SER CB C 49 64.758 64.758 64.287 0.471 25085
3871 1 7 . 1 1 49 49 SER H H 49 8.657 8.657 8.215 0.442 25085
3872 1 7 . 1 1 50 50 GLY N N 50 110.839 110.839 109.674 1.165 25085
3873 1 7 . 1 1 50 50 GLY C C 50 172.398 172.398 173.093 -0.695 25085
3874 1 7 . 1 1 50 50 GLY CA C 50 44.444 44.444 44.968 -0.524 25085
3875 1 7 . 1 1 50 50 GLY H H 50 7.846 7.846 7.923 -0.077 25085
3876 1 7 . 1 1 51 51 LEU N N 51 121.009 121.009 124.109 -3.100 25085
3877 1 7 . 1 1 51 51 LEU HA H 51 4.244 4.244 4.827 -0.583 25085
3878 1 7 . 1 1 51 51 LEU CA C 51 52.593 52.593 51.576 1.017 25085
3879 1 7 . 1 1 51 51 LEU CB C 51 43.381 43.381 43.762 -0.381 25085
3880 1 7 . 1 1 51 51 LEU H H 51 8.647 8.647 7.861 0.786 25085
3881 1 7 . 1 1 52 52 PRO HA H 52 4.349 4.349 4.392 -0.043 25085
3882 1 7 . 1 1 52 52 PRO C C 52 177.247 177.247 177.208 0.039 25085
3883 1 7 . 1 1 52 52 PRO CA C 52 62.980 62.980 63.495 -0.515 25085
3884 1 7 . 1 1 52 52 PRO CB C 52 32.423 32.423 30.092 2.331 25085
3885 1 7 . 1 1 53 53 ALA N N 53 126.595 126.595 121.862 4.733 25085
3886 1 7 . 1 1 53 53 ALA HA H 53 3.870 3.870 4.019 -0.149 25085
3887 1 7 . 1 1 53 53 ALA C C 53 180.484 180.484 179.419 1.065 25085
3888 1 7 . 1 1 53 53 ALA CA C 53 55.829 55.829 54.861 0.968 25085
3889 1 7 . 1 1 53 53 ALA CB C 53 18.248 18.248 18.396 -0.148 25085
3890 1 7 . 1 1 53 53 ALA H H 53 8.643 8.643 8.526 0.117 25085
3891 1 7 . 1 1 54 54 LYS N N 54 113.898 113.898 119.199 -5.301 25085
3892 1 7 . 1 1 54 54 LYS HA H 54 4.167 4.167 4.102 0.065 25085
3893 1 7 . 1 1 54 54 LYS C C 54 176.704 176.704 178.613 -1.909 25085
3894 1 7 . 1 1 54 54 LYS CA C 54 57.893 57.893 58.702 -0.809 25085
3895 1 7 . 1 1 54 54 LYS CB C 54 31.892 31.892 32.362 -0.470 25085
3896 1 7 . 1 1 54 54 LYS H H 54 8.442 8.442 7.828 0.614 25085
3897 1 7 . 1 1 55 55 LEU N N 55 117.932 117.932 118.849 -0.917 25085
3898 1 7 . 1 1 55 55 LEU HA H 55 4.308 4.308 4.307 0.001 25085
3899 1 7 . 1 1 55 55 LEU C C 55 174.589 174.589 178.031 -3.442 25085
3900 1 7 . 1 1 55 55 LEU CA C 55 54.003 54.003 56.492 -2.489 25085
3901 1 7 . 1 1 55 55 LEU CB C 55 41.649 41.649 41.917 -0.268 25085
3902 1 7 . 1 1 55 55 LEU H H 55 7.805 7.805 8.600 -0.795 25085
3903 1 7 . 1 1 56 56 ARG N N 56 116.873 116.873 117.035 -0.162 25085
3904 1 7 . 1 1 56 56 ARG HA H 56 4.006 4.006 4.324 -0.318 25085
3905 1 7 . 1 1 56 56 ARG C C 56 175.542 175.542 176.196 -0.654 25085
3906 1 7 . 1 1 56 56 ARG CA C 56 57.428 57.428 56.601 0.827 25085
3907 1 7 . 1 1 56 56 ARG CB C 56 29.651 29.651 30.351 -0.700 25085
3908 1 7 . 1 1 56 56 ARG H H 56 6.971 6.971 7.658 -0.687 25085
3909 1 7 . 1 1 57 57 HIS N N 57 122.622 122.622 118.192 4.430 25085
3910 1 7 . 1 1 57 57 HIS HA H 57 4.596 4.596 4.683 -0.087 25085
3911 1 7 . 1 1 57 57 HIS C C 57 173.855 173.855 173.497 0.358 25085
3912 1 7 . 1 1 57 57 HIS CA C 57 55.780 55.780 55.717 0.063 25085
3913 1 7 . 1 1 57 57 HIS CB C 57 33.878 33.878 31.593 2.285 25085
3914 1 7 . 1 1 57 57 HIS H H 57 7.281 7.281 7.539 -0.258 25085
3915 1 7 . 1 1 58 58 GLU N N 58 120.479 120.479 118.211 2.268 25085
3916 1 7 . 1 1 58 58 GLU HA H 58 4.052 4.052 4.375 -0.323 25085
3917 1 7 . 1 1 58 58 GLU C C 58 176.762 176.762 174.758 2.004 25085
3918 1 7 . 1 1 58 58 GLU CA C 58 59.634 59.634 57.109 2.525 25085
3919 1 7 . 1 1 58 58 GLU CB C 58 29.931 29.931 31.358 -1.427 25085
3920 1 7 . 1 1 58 58 GLU H H 58 7.626 7.626 8.488 -0.862 25085
3921 1 7 . 1 1 59 59 GLN N N 59 118.110 118.110 119.061 -0.951 25085
3922 1 7 . 1 1 59 59 GLN HA H 59 5.479 5.479 5.119 0.360 25085
3923 1 7 . 1 1 59 59 GLN C C 59 174.322 174.322 174.955 -0.633 25085
3924 1 7 . 1 1 59 59 GLN CA C 59 55.486 55.486 55.013 0.473 25085
3925 1 7 . 1 1 59 59 GLN CB C 59 33.151 33.151 31.549 1.602 25085
3926 1 7 . 1 1 59 59 GLN H H 59 8.560 8.560 7.987 0.573 25085
3927 1 7 . 1 1 60 60 ILE N N 60 122.789 122.789 121.754 1.035 25085
3928 1 7 . 1 1 60 60 ILE HA H 60 4.531 4.531 4.788 -0.257 25085
3929 1 7 . 1 1 60 60 ILE C C 60 173.352 173.352 174.468 -1.116 25085
3930 1 7 . 1 1 60 60 ILE CA C 60 59.794 59.794 59.880 -0.086 25085
3931 1 7 . 1 1 60 60 ILE CB C 60 43.188 43.188 42.190 0.998 25085
3932 1 7 . 1 1 60 60 ILE H H 60 8.735 8.735 8.001 0.734 25085
3933 1 7 . 1 1 61 61 ILE N N 61 125.871 125.871 120.242 5.629 25085
3934 1 7 . 1 1 61 61 ILE HA H 61 5.002 5.002 5.125 -0.123 25085
3935 1 7 . 1 1 61 61 ILE C C 61 175.195 175.195 174.296 0.899 25085
3936 1 7 . 1 1 61 61 ILE CA C 61 58.419 58.419 60.201 -1.782 25085
3937 1 7 . 1 1 61 61 ILE CB C 61 40.270 40.270 41.354 -1.084 25085
3938 1 7 . 1 1 61 61 ILE H H 61 9.057 9.057 8.756 0.301 25085
3939 1 7 . 1 1 62 62 PHE N N 62 123.742 123.742 125.519 -1.777 25085
3940 1 7 . 1 1 62 62 PHE HA H 62 5.810 5.810 5.175 0.635 25085
3941 1 7 . 1 1 62 62 PHE C C 62 176.135 176.135 174.912 1.223 25085
3942 1 7 . 1 1 62 62 PHE CA C 62 56.960 56.960 55.660 1.300 25085
3943 1 7 . 1 1 62 62 PHE CB C 62 43.352 43.352 42.368 0.984 25085
3944 1 7 . 1 1 62 62 PHE H H 62 8.977 8.977 8.413 0.564 25085
3945 1 7 . 1 1 63 63 HIS N N 63 116.939 116.939 117.796 -0.857 25085
3946 1 7 . 1 1 63 63 HIS HA H 63 5.979 5.979 5.063 0.916 25085
3947 1 7 . 1 1 63 63 HIS C C 63 171.108 171.108 173.936 -2.828 25085
3948 1 7 . 1 1 63 63 HIS CA C 63 54.115 54.115 54.395 -0.280 25085
3949 1 7 . 1 1 63 63 HIS CB C 63 36.861 36.861 32.541 4.320 25085
3950 1 7 . 1 1 63 63 HIS H H 63 9.298 9.298 7.849 1.449 25085
3951 1 7 . 1 1 64 64 CYS N N 64 119.251 119.251 122.326 -3.075 25085
3952 1 7 . 1 1 64 64 CYS HA H 64 5.044 5.044 4.918 0.126 25085
3953 1 7 . 1 1 64 64 CYS C C 64 177.438 177.438 175.872 1.566 25085
3954 1 7 . 1 1 64 64 CYS CA C 64 56.886 56.886 55.715 1.171 25085
3955 1 7 . 1 1 64 64 CYS CB C 64 29.425 29.425 31.552 -2.127 25085
3956 1 7 . 1 1 64 64 CYS H H 64 8.156 8.156 8.901 -0.745 25085
3957 1 7 . 1 1 65 65 GLN N N 65 125.627 125.627 125.339 0.288 25085
3958 1 7 . 1 1 65 65 GLN HA H 65 4.220 4.220 4.021 0.199 25085
3959 1 7 . 1 1 65 65 GLN C C 65 174.440 174.440 175.243 -0.803 25085
3960 1 7 . 1 1 65 65 GLN CA C 65 59.788 59.788 59.151 0.637 25085
3961 1 7 . 1 1 65 65 GLN CB C 65 29.370 29.370 28.128 1.242 25085
3962 1 7 . 1 1 65 65 GLN H H 65 8.937 8.937 9.040 -0.103 25085
3963 1 7 . 1 1 66 66 ALA N N 66 118.880 118.880 115.658 3.222 25085
3964 1 7 . 1 1 66 66 ALA HA H 66 5.115 5.115 4.924 0.191 25085
3965 1 7 . 1 1 66 66 ALA C C 66 177.625 177.625 176.123 1.502 25085
3966 1 7 . 1 1 66 66 ALA CA C 66 50.744 50.744 51.935 -1.192 25085
3967 1 7 . 1 1 66 66 ALA CB C 66 20.658 20.658 21.726 -1.068 25085
3968 1 7 . 1 1 66 66 ALA H H 66 9.024 9.024 7.531 1.493 25085
3969 1 7 . 1 1 67 67 GLY N N 67 112.878 112.878 104.282 8.596 25085
3970 1 7 . 1 1 67 67 GLY C C 67 174.810 174.810 175.439 -0.629 25085
3971 1 7 . 1 1 67 67 GLY CA C 67 45.642 45.642 45.538 0.104 25085
3972 1 7 . 1 1 67 67 GLY H H 67 8.845 8.845 7.819 1.026 25085
3973 1 7 . 1 1 68 68 LYS N N 68 120.133 120.133 121.775 -1.642 25085
3974 1 7 . 1 1 68 68 LYS HA H 68 4.158 4.158 4.518 -0.360 25085
3975 1 7 . 1 1 68 68 LYS C C 68 177.939 177.939 178.635 -0.696 25085
3976 1 7 . 1 1 68 68 LYS CA C 68 58.811 58.811 57.287 1.524 25085
3977 1 7 . 1 1 68 68 LYS CB C 68 32.796 32.796 32.806 -0.010 25085
3978 1 7 . 1 1 68 68 LYS H H 68 7.936 7.936 8.114 -0.178 25085
3979 1 7 . 1 1 69 69 ARG N N 69 125.804 125.804 120.132 5.672 25085
3980 1 7 . 1 1 69 69 ARG HA H 69 4.217 4.217 4.143 0.074 25085
3981 1 7 . 1 1 69 69 ARG C C 69 180.944 180.944 178.254 2.690 25085
3982 1 7 . 1 1 69 69 ARG CA C 69 60.010 60.010 59.968 0.042 25085
3983 1 7 . 1 1 69 69 ARG CB C 69 30.974 30.974 29.701 1.273 25085
3984 1 7 . 1 1 69 69 ARG H H 69 8.981 8.981 7.833 1.148 25085
3985 1 7 . 1 1 70 70 THR N N 70 116.681 116.681 113.827 2.854 25085
3986 1 7 . 1 1 70 70 THR HA H 70 3.607 3.607 4.081 -0.474 25085
3987 1 7 . 1 1 70 70 THR C C 70 176.434 176.434 176.011 0.423 25085
3988 1 7 . 1 1 70 70 THR CA C 70 65.914 65.914 66.715 -0.801 25085
3989 1 7 . 1 1 70 70 THR CB C 70 68.169 68.169 68.330 -0.161 25085
3990 1 7 . 1 1 70 70 THR H H 70 10.382 10.382 8.190 2.192 25085
3991 1 7 . 1 1 71 71 SER N N 71 113.046 113.046 117.236 -4.190 25085
3992 1 7 . 1 1 71 71 SER HA H 71 3.993 3.993 4.149 -0.156 25085
3993 1 7 . 1 1 71 71 SER C C 71 177.594 177.594 176.540 1.054 25085
3994 1 7 . 1 1 71 71 SER CA C 71 62.500 62.500 61.438 1.062 25085
3995 1 7 . 1 1 71 71 SER H H 71 7.346 7.346 7.821 -0.475 25085
3996 1 7 . 1 1 72 72 ASN N N 72 117.540 117.540 118.749 -1.209 25085
3997 1 7 . 1 1 72 72 ASN HA H 72 4.598 4.598 4.677 -0.079 25085
3998 1 7 . 1 1 72 72 ASN C C 72 175.595 175.595 176.374 -0.779 25085
3999 1 7 . 1 1 72 72 ASN CA C 72 55.147 55.147 55.210 -0.063 25085
4000 1 7 . 1 1 72 72 ASN CB C 72 38.821 38.821 38.977 -0.156 25085
4001 1 7 . 1 1 72 72 ASN H H 72 8.078 8.078 7.974 0.104 25085
4002 1 7 . 1 1 73 73 ASN N N 73 114.869 114.869 116.888 -2.019 25085
4003 1 7 . 1 1 73 73 ASN HA H 73 5.159 5.159 4.682 0.477 25085
4004 1 7 . 1 1 73 73 ASN C C 73 174.375 174.375 176.104 -1.729 25085
4005 1 7 . 1 1 73 73 ASN CA C 73 52.976 52.976 53.633 -0.657 25085
4006 1 7 . 1 1 73 73 ASN CB C 73 39.862 39.862 39.174 0.688 25085
4007 1 7 . 1 1 73 73 ASN H H 73 7.290 7.290 7.751 -0.461 25085
4008 1 7 . 1 1 74 74 ALA N N 74 124.647 124.647 123.104 1.543 25085
4009 1 7 . 1 1 74 74 ALA HA H 74 3.721 3.721 3.675 0.046 25085
4010 1 7 . 1 1 74 74 ALA C C 74 177.908 177.908 178.700 -0.792 25085
4011 1 7 . 1 1 74 74 ALA CA C 74 57.085 57.085 55.344 1.741 25085
4012 1 7 . 1 1 74 74 ALA CB C 74 19.427 19.427 18.043 1.385 25085
4013 1 7 . 1 1 74 74 ALA H H 74 7.105 7.105 8.600 -1.495 25085
4014 1 7 . 1 1 75 75 ASP N N 75 114.917 114.917 116.686 -1.769 25085
4015 1 7 . 1 1 75 75 ASP HA H 75 4.250 4.250 4.336 -0.086 25085
4016 1 7 . 1 1 75 75 ASP C C 75 179.100 179.100 178.314 0.786 25085
4017 1 7 . 1 1 75 75 ASP CA C 75 57.236 57.236 56.917 0.319 25085
4018 1 7 . 1 1 75 75 ASP CB C 75 39.783 39.783 40.644 -0.861 25085
4019 1 7 . 1 1 75 75 ASP H H 75 8.403 8.403 8.547 -0.144 25085
4020 1 7 . 1 1 76 76 LYS N N 76 121.888 121.888 118.821 3.067 25085
4021 1 7 . 1 1 76 76 LYS HA H 76 4.053 4.053 4.104 -0.051 25085
4022 1 7 . 1 1 76 76 LYS C C 76 178.832 178.832 179.060 -0.228 25085
4023 1 7 . 1 1 76 76 LYS CA C 76 58.864 58.864 58.257 0.607 25085
4024 1 7 . 1 1 76 76 LYS CB C 76 32.423 32.423 32.421 0.002 25085
4025 1 7 . 1 1 76 76 LYS H H 76 7.652 7.652 7.569 0.083 25085
4026 1 7 . 1 1 77 77 LEU N N 77 118.644 118.644 120.297 -1.653 25085
4027 1 7 . 1 1 77 77 LEU HA H 77 3.557 3.557 3.987 -0.430 25085
4028 1 7 . 1 1 77 77 LEU C C 77 178.068 178.068 178.552 -0.484 25085
4029 1 7 . 1 1 77 77 LEU CA C 77 57.692 57.692 57.512 0.180 25085
4030 1 7 . 1 1 77 77 LEU CB C 77 40.077 40.077 41.149 -1.072 25085
4031 1 7 . 1 1 77 77 LEU H H 77 8.146 8.146 7.597 0.549 25085
4032 1 7 . 1 1 78 78 ALA N N 78 119.668 119.668 120.950 -1.282 25085
4033 1 7 . 1 1 78 78 ALA HA H 78 3.990 3.990 3.801 0.189 25085
4034 1 7 . 1 1 78 78 ALA C C 78 179.542 179.542 179.043 0.499 25085
4035 1 7 . 1 1 78 78 ALA CA C 78 54.937 54.937 54.960 -0.023 25085
4036 1 7 . 1 1 78 78 ALA CB C 78 18.080 18.080 17.879 0.201 25085
4037 1 7 . 1 1 78 78 ALA H H 78 8.136 8.136 8.475 -0.339 25085
4038 1 7 . 1 1 79 79 ALA N N 79 118.918 118.918 120.382 -1.464 25085
4039 1 7 . 1 1 79 79 ALA HA H 79 4.139 4.139 4.100 0.039 25085
4040 1 7 . 1 1 79 79 ALA C C 79 180.800 180.800 179.297 1.503 25085
4041 1 7 . 1 1 79 79 ALA CA C 79 54.571 54.571 54.502 0.069 25085
4042 1 7 . 1 1 79 79 ALA CB C 79 18.268 18.268 18.462 -0.194 25085
4043 1 7 . 1 1 79 79 ALA H H 79 7.319 7.319 7.527 -0.208 25085
4044 1 7 . 1 1 80 80 ILE N N 80 118.438 118.438 117.572 0.866 25085
4045 1 7 . 1 1 80 80 ILE HA H 80 3.801 3.801 3.822 -0.021 25085
4046 1 7 . 1 1 80 80 ILE C C 80 177.302 177.302 176.845 0.457 25085
4047 1 7 . 1 1 80 80 ILE CA C 80 64.252 64.252 63.081 1.171 25085
4048 1 7 . 1 1 80 80 ILE CB C 80 39.115 39.115 38.038 1.077 25085
4049 1 7 . 1 1 80 80 ILE H H 80 8.227 8.227 7.859 0.368 25085
4050 1 7 . 1 1 81 81 ALA N N 81 117.917 117.917 120.764 -2.847 25085
4051 1 7 . 1 1 81 81 ALA HA H 81 4.466 4.466 4.045 0.421 25085
4052 1 7 . 1 1 81 81 ALA C C 81 176.153 176.153 177.696 -1.543 25085
4053 1 7 . 1 1 81 81 ALA CA C 81 51.404 51.404 53.901 -2.497 25085
4054 1 7 . 1 1 81 81 ALA CB C 81 20.200 20.200 19.518 0.682 25085
4055 1 7 . 1 1 81 81 ALA H H 81 7.913 7.913 8.029 -0.116 25085
4056 1 7 . 1 1 82 82 ALA N N 82 124.086 124.086 119.233 4.853 25085
4057 1 7 . 1 1 82 82 ALA HA H 82 4.457 4.457 4.103 0.354 25085
4058 1 7 . 1 1 82 82 ALA CA C 82 52.276 52.276 51.720 0.556 25085
4059 1 7 . 1 1 82 82 ALA CB C 82 17.243 17.243 16.687 0.556 25085
4060 1 7 . 1 1 82 82 ALA H H 82 7.223 7.223 7.385 -0.162 25085
4061 1 7 . 1 1 83 83 PRO HA H 83 4.692 4.692 4.325 0.367 25085
4062 1 7 . 1 1 83 83 PRO C C 83 175.169 175.169 175.482 -0.313 25085
4063 1 7 . 1 1 83 83 PRO CA C 83 63.767 63.767 64.153 -0.387 25085
4064 1 7 . 1 1 83 83 PRO CB C 83 32.624 32.624 29.627 2.997 25085
4065 1 7 . 1 1 84 84 ALA N N 84 127.741 127.741 124.048 3.693 25085
4066 1 7 . 1 1 84 84 ALA HA H 84 4.138 4.138 4.568 -0.430 25085
4067 1 7 . 1 1 84 84 ALA C C 84 176.494 176.494 175.790 0.704 25085
4068 1 7 . 1 1 84 84 ALA CA C 84 53.432 53.432 50.734 2.698 25085
4069 1 7 . 1 1 84 84 ALA CB C 84 19.719 19.719 21.463 -1.744 25085
4070 1 7 . 1 1 84 84 ALA H H 84 8.528 8.528 8.403 0.125 25085
4071 1 7 . 1 1 85 85 GLU N N 85 121.634 121.634 119.669 1.965 25085
4072 1 7 . 1 1 85 85 GLU HA H 85 4.228 4.228 4.537 -0.309 25085
4073 1 7 . 1 1 85 85 GLU C C 85 175.094 175.094 174.128 0.966 25085
4074 1 7 . 1 1 85 85 GLU CA C 85 56.444 56.444 55.252 1.192 25085
4075 1 7 . 1 1 85 85 GLU CB C 85 30.803 30.803 31.803 -1.000 25085
4076 1 7 . 1 1 85 85 GLU H H 85 8.166 8.166 8.223 -0.057 25085
4077 1 7 . 1 1 86 86 ILE N N 86 122.543 122.543 122.611 -0.068 25085
4078 1 7 . 1 1 86 86 ILE HA H 86 5.269 5.269 4.479 0.790 25085
4079 1 7 . 1 1 86 86 ILE C C 86 174.463 174.463 174.287 0.176 25085
4080 1 7 . 1 1 86 86 ILE CA C 86 59.329 59.329 60.131 -0.802 25085
4081 1 7 . 1 1 86 86 ILE CB C 86 40.546 40.546 39.901 0.645 25085
4082 1 7 . 1 1 86 86 ILE H H 86 7.925 7.925 8.406 -0.481 25085
4083 1 7 . 1 1 87 87 PHE N N 87 122.457 122.457 124.449 -1.992 25085
4084 1 7 . 1 1 87 87 PHE HA H 87 5.428 5.428 5.856 -0.428 25085
4085 1 7 . 1 1 87 87 PHE C C 87 174.450 174.450 175.540 -1.090 25085
4086 1 7 . 1 1 87 87 PHE CA C 87 55.029 55.029 55.261 -0.232 25085
4087 1 7 . 1 1 87 87 PHE CB C 87 43.626 43.626 42.774 0.852 25085
4088 1 7 . 1 1 87 87 PHE H H 87 9.050 9.050 8.633 0.417 25085
4089 1 7 . 1 1 88 88 LEU N N 88 119.959 119.959 118.896 1.063 25085
4090 1 7 . 1 1 88 88 LEU HA H 88 5.358 5.358 5.146 0.212 25085
4091 1 7 . 1 1 88 88 LEU C C 88 176.627 176.627 175.412 1.215 25085
4092 1 7 . 1 1 88 88 LEU CA C 88 52.654 52.654 53.581 -0.927 25085
4093 1 7 . 1 1 88 88 LEU CB C 88 43.094 43.094 45.606 -2.512 25085
4094 1 7 . 1 1 88 88 LEU H H 88 8.824 8.824 8.806 0.018 25085
4095 1 7 . 1 1 89 89 LEU N N 89 124.096 124.096 124.058 0.038 25085
4096 1 7 . 1 1 89 89 LEU HA H 89 4.432 4.432 4.823 -0.391 25085
4097 1 7 . 1 1 89 89 LEU C C 89 176.693 176.693 176.425 0.268 25085
4098 1 7 . 1 1 89 89 LEU CA C 89 55.385 55.385 54.398 0.987 25085
4099 1 7 . 1 1 89 89 LEU CB C 89 43.537 43.537 43.183 0.354 25085
4100 1 7 . 1 1 89 89 LEU H H 89 8.293 8.293 8.463 -0.170 25085
4101 1 7 . 1 1 90 90 GLU N N 90 102.942 102.942 129.018 -26.076 25085
4102 1 7 . 1 1 90 90 GLU HA H 90 3.895 3.895 4.120 -0.225 25085
4103 1 7 . 1 1 90 90 GLU C C 90 175.199 175.199 176.659 -1.460 25085
4104 1 7 . 1 1 90 90 GLU CA C 90 58.586 58.586 58.469 0.117 25085
4105 1 7 . 1 1 90 90 GLU CB C 90 30.831 30.831 30.735 0.096 25085
4106 1 7 . 1 1 90 90 GLU H H 90 9.394 9.394 9.138 0.256 25085
4107 1 7 . 1 1 91 91 ASP N N 91 120.515 120.515 121.516 -1.001 25085
4108 1 7 . 1 1 91 91 ASP HA H 91 4.184 4.184 4.364 -0.180 25085
4109 1 7 . 1 1 91 91 ASP C C 91 176.159 176.159 176.410 -0.251 25085
4110 1 7 . 1 1 91 91 ASP CA C 91 55.814 55.814 55.958 -0.144 25085
4111 1 7 . 1 1 91 91 ASP CB C 91 39.033 39.033 40.794 -1.761 25085
4112 1 7 . 1 1 91 91 ASP H H 91 9.210 9.210 8.817 0.393 25085
4113 1 7 . 1 1 92 92 GLY N N 92 104.313 104.313 106.436 -2.123 25085
4114 1 7 . 1 1 92 92 GLY C C 92 172.980 172.980 175.360 -2.380 25085
4115 1 7 . 1 1 92 92 GLY CA C 92 46.946 46.946 45.069 1.877 25085
4116 1 7 . 1 1 92 92 GLY H H 92 7.902 7.902 7.681 0.221 25085
4117 1 7 . 1 1 93 93 ILE N N 93 121.445 121.445 122.233 -0.788 25085
4118 1 7 . 1 1 93 93 ILE HA H 93 3.902 3.902 3.814 0.088 25085
4119 1 7 . 1 1 93 93 ILE C C 93 176.528 176.528 176.669 -0.141 25085
4120 1 7 . 1 1 93 93 ILE CA C 93 63.908 63.908 64.564 -0.656 25085
4121 1 7 . 1 1 93 93 ILE CB C 93 38.416 38.416 38.087 0.329 25085
4122 1 7 . 1 1 93 93 ILE H H 93 8.129 8.129 8.181 -0.052 25085
4123 1 7 . 1 1 94 94 ASP N N 94 126.304 126.304 120.122 6.182 25085
4124 1 7 . 1 1 94 94 ASP HA H 94 4.436 4.436 4.402 0.034 25085
4125 1 7 . 1 1 94 94 ASP C C 94 180.174 180.174 178.557 1.617 25085
4126 1 7 . 1 1 94 94 ASP CA C 94 58.351 58.351 57.289 1.062 25085
4127 1 7 . 1 1 94 94 ASP CB C 94 39.223 39.223 40.411 -1.188 25085
4128 1 7 . 1 1 94 94 ASP H H 94 9.161 9.161 8.162 0.999 25085
4129 1 7 . 1 1 95 95 GLY N N 95 110.690 110.690 107.985 2.705 25085
4130 1 7 . 1 1 95 95 GLY C C 95 176.108 176.108 175.712 0.396 25085
4131 1 7 . 1 1 95 95 GLY CA C 95 46.873 46.873 46.596 0.277 25085
4132 1 7 . 1 1 95 95 GLY H H 95 8.080 8.080 8.553 -0.473 25085
4133 1 7 . 1 1 96 96 TRP N N 96 126.965 126.965 124.201 2.764 25085
4134 1 7 . 1 1 96 96 TRP HA H 96 3.795 3.795 4.225 -0.430 25085
4135 1 7 . 1 1 96 96 TRP C C 96 177.058 177.058 177.523 -0.465 25085
4136 1 7 . 1 1 96 96 TRP CA C 96 61.633 61.633 60.165 1.468 25085
4137 1 7 . 1 1 96 96 TRP CB C 96 29.512 29.512 29.398 0.113 25085
4138 1 7 . 1 1 96 96 TRP H H 96 8.007 8.007 7.617 0.390 25085
4139 1 7 . 1 1 97 97 LYS N N 97 116.604 116.604 119.077 -2.473 25085
4140 1 7 . 1 1 97 97 LYS HA H 97 4.090 4.090 4.045 0.045 25085
4141 1 7 . 1 1 97 97 LYS C C 97 182.010 182.010 179.650 2.360 25085
4142 1 7 . 1 1 97 97 LYS CA C 97 59.776 59.776 59.457 0.319 25085
4143 1 7 . 1 1 97 97 LYS CB C 97 32.208 32.208 32.314 -0.106 25085
4144 1 7 . 1 1 97 97 LYS H H 97 8.696 8.696 8.275 0.421 25085
4145 1 7 . 1 1 98 98 ARG N N 98 122.491 122.491 119.085 3.406 25085
4146 1 7 . 1 1 98 98 ARG HA H 98 4.050 4.050 4.198 -0.148 25085
4147 1 7 . 1 1 98 98 ARG C C 98 177.666 177.666 177.353 0.313 25085
4148 1 7 . 1 1 98 98 ARG CA C 98 59.509 59.509 57.328 2.180 25085
4149 1 7 . 1 1 98 98 ARG CB C 98 30.471 30.471 30.123 0.348 25085
4150 1 7 . 1 1 98 98 ARG H H 98 8.280 8.280 7.527 0.753 25085
4151 1 7 . 1 1 99 99 ALA N N 99 119.546 119.546 118.979 0.567 25085
4152 1 7 . 1 1 99 99 ALA HA H 99 4.276 4.276 4.124 0.152 25085
4153 1 7 . 1 1 99 99 ALA C C 99 176.800 176.800 177.537 -0.737 25085
4154 1 7 . 1 1 99 99 ALA CA C 99 52.254 52.254 52.585 -0.331 25085
4155 1 7 . 1 1 99 99 ALA CB C 99 18.270 18.270 18.519 -0.249 25085
4156 1 7 . 1 1 99 99 ALA H H 99 7.519 7.519 7.986 -0.467 25085
4157 1 7 . 1 1 100 100 GLY N N 100 106.339 106.339 105.162 1.177 25085
4158 1 7 . 1 1 100 100 GLY C C 100 174.232 174.232 174.135 0.097 25085
4159 1 7 . 1 1 100 100 GLY CA C 100 45.050 45.050 44.858 0.192 25085
4160 1 7 . 1 1 100 100 GLY H H 100 7.926 7.926 7.484 0.442 25085
4161 1 7 . 1 1 101 101 LEU N N 101 122.181 122.181 120.145 2.036 25085
4162 1 7 . 1 1 101 101 LEU HA H 101 4.286 4.286 4.643 -0.357 25085
4163 1 7 . 1 1 101 101 LEU CA C 101 53.183 53.183 50.748 2.435 25085
4164 1 7 . 1 1 101 101 LEU CB C 101 37.320 37.320 43.069 -5.749 25085
4165 1 7 . 1 1 101 101 LEU H H 101 6.976 6.976 7.096 -0.120 25085
4166 1 7 . 1 1 102 102 PRO HA H 102 4.476 4.476 4.592 -0.116 25085
4167 1 7 . 1 1 102 102 PRO C C 102 177.424 177.424 176.494 0.930 25085
4168 1 7 . 1 1 102 102 PRO CA C 102 64.014 64.014 62.799 1.215 25085
4169 1 7 . 1 1 102 102 PRO CB C 102 33.200 33.200 32.036 1.164 25085
4170 1 7 . 1 1 103 103 VAL N N 103 110.512 110.512 115.830 -5.318 25085
4171 1 7 . 1 1 103 103 VAL HA H 103 4.643 4.643 4.359 0.284 25085
4172 1 7 . 1 1 103 103 VAL C C 103 174.297 174.297 174.718 -0.421 25085
4173 1 7 . 1 1 103 103 VAL CA C 103 59.693 59.693 60.131 -0.438 25085
4174 1 7 . 1 1 103 103 VAL CB C 103 35.980 35.980 34.290 1.690 25085
4175 1 7 . 1 1 103 103 VAL H H 103 8.073 8.073 8.075 -0.002 25085
4176 1 7 . 1 1 104 104 ALA N N 104 125.898 125.898 123.675 2.223 25085
4177 1 7 . 1 1 104 104 ALA HA H 104 4.550 4.550 4.703 -0.153 25085
4178 1 7 . 1 1 104 104 ALA C C 104 176.190 176.190 175.009 1.181 25085
4179 1 7 . 1 1 104 104 ALA CA C 104 50.699 50.699 50.585 0.114 25085
4180 1 7 . 1 1 104 104 ALA CB C 104 19.534 19.534 20.636 -1.102 25085
4181 1 7 . 1 1 104 104 ALA H H 104 8.996 8.996 8.290 0.706 25085
4182 1 7 . 1 1 105 105 VAL N N 105 119.534 119.534 124.188 -4.654 25085
4183 1 7 . 1 1 105 105 VAL HA H 105 4.615 4.615 4.145 0.470 25085
4184 1 7 . 1 1 105 105 VAL C C 105 175.576 175.576 175.717 -0.141 25085
4185 1 7 . 1 1 105 105 VAL CA C 105 60.234 60.234 61.232 -0.998 25085
4186 1 7 . 1 1 105 105 VAL CB C 105 34.683 34.683 33.434 1.249 25085
4187 1 7 . 1 1 105 105 VAL H H 105 8.276 8.276 8.323 -0.047 25085
4188 1 7 . 1 1 106 106 ASN N N 106 123.346 123.346 127.045 -3.699 25085
4189 1 7 . 1 1 106 106 ASN HA H 106 4.748 4.748 4.657 0.091 25085
4190 1 7 . 1 1 106 106 ASN C C 106 173.877 173.877 174.163 -0.286 25085
4191 1 7 . 1 1 106 106 ASN CA C 106 53.465 53.465 54.147 -0.681 25085
4192 1 7 . 1 1 106 106 ASN CB C 106 39.424 39.424 38.638 0.786 25085
4193 1 7 . 1 1 106 106 ASN H H 106 8.190 8.190 8.328 -0.138 25085
4194 1 8 . 1 1 2 2 ALA N N 2 125.104 125.104 125.291 -0.187 25085
4195 1 8 . 1 1 2 2 ALA HA H 2 4.287 4.287 4.616 -0.329 25085
4196 1 8 . 1 1 2 2 ALA C C 2 176.800 176.800 176.944 -0.144 25085
4197 1 8 . 1 1 2 2 ALA CA C 2 52.429 52.429 52.042 0.387 25085
4198 1 8 . 1 1 2 2 ALA CB C 2 19.407 19.407 19.165 0.242 25085
4199 1 8 . 1 1 2 2 ALA H H 2 8.344 8.344 8.514 -0.170 25085
4200 1 8 . 1 1 3 3 LEU N N 3 120.515 120.515 118.360 2.155 25085
4201 1 8 . 1 1 3 3 LEU HA H 3 4.452 4.452 4.359 0.093 25085
4202 1 8 . 1 1 3 3 LEU C C 3 176.497 176.497 176.687 -0.190 25085
4203 1 8 . 1 1 3 3 LEU CA C 3 54.698 54.698 55.057 -0.359 25085
4204 1 8 . 1 1 3 3 LEU CB C 3 43.203 43.203 39.861 3.342 25085
4205 1 8 . 1 1 3 3 LEU H H 3 8.070 8.070 7.660 0.410 25085
4206 1 8 . 1 1 4 4 THR N N 4 117.803 117.803 120.355 -2.552 25085
4207 1 8 . 1 1 4 4 THR HA H 4 4.480 4.480 4.663 -0.183 25085
4208 1 8 . 1 1 4 4 THR C C 4 173.872 173.872 174.586 -0.714 25085
4209 1 8 . 1 1 4 4 THR CA C 4 62.247 62.247 61.812 0.435 25085
4210 1 8 . 1 1 4 4 THR CB C 4 70.533 70.533 70.653 -0.119 25085
4211 1 8 . 1 1 4 4 THR H H 4 7.954 7.954 7.884 0.070 25085
4212 1 8 . 1 1 5 5 THR N N 5 121.501 121.501 114.375 7.126 25085
4213 1 8 . 1 1 5 5 THR HA H 5 5.289 5.289 4.484 0.805 25085
4214 1 8 . 1 1 5 5 THR C C 5 174.162 174.162 173.774 0.388 25085
4215 1 8 . 1 1 5 5 THR CA C 5 62.102 62.102 61.816 0.287 25085
4216 1 8 . 1 1 5 5 THR CB C 5 69.457 69.457 69.947 -0.490 25085
4217 1 8 . 1 1 5 5 THR H H 5 8.640 8.640 8.349 0.291 25085
4218 1 8 . 1 1 6 6 ILE N N 6 122.023 122.023 122.256 -0.233 25085
4219 1 8 . 1 1 6 6 ILE HA H 6 4.988 4.988 4.504 0.484 25085
4220 1 8 . 1 1 6 6 ILE C C 6 173.377 173.377 173.804 -0.427 25085
4221 1 8 . 1 1 6 6 ILE CA C 6 58.611 58.611 59.844 -1.233 25085
4222 1 8 . 1 1 6 6 ILE CB C 6 42.821 42.821 42.652 0.169 25085
4223 1 8 . 1 1 6 6 ILE H H 6 8.977 8.977 9.144 -0.167 25085
4224 1 8 . 1 1 7 7 SER N N 7 122.659 122.659 118.691 3.968 25085
4225 1 8 . 1 1 7 7 SER HA H 7 4.768 4.768 5.123 -0.355 25085
4226 1 8 . 1 1 7 7 SER CA C 7 56.790 56.790 56.139 0.651 25085
4227 1 8 . 1 1 7 7 SER CB C 7 63.235 63.235 64.103 -0.868 25085
4228 1 8 . 1 1 7 7 SER H H 7 9.242 9.242 8.426 0.816 25085
4229 1 8 . 1 1 8 8 PRO HA H 8 4.207 4.207 4.280 -0.073 25085
4230 1 8 . 1 1 8 8 PRO C C 8 176.787 176.787 178.549 -1.762 25085
4231 1 8 . 1 1 8 8 PRO CA C 8 66.443 66.443 65.391 1.052 25085
4232 1 8 . 1 1 8 8 PRO CB C 8 32.724 32.724 31.844 0.880 25085
4233 1 8 . 1 1 9 9 HIS N N 9 113.700 113.700 115.025 -1.325 25085
4234 1 8 . 1 1 9 9 HIS HA H 9 3.990 3.990 4.204 -0.214 25085
4235 1 8 . 1 1 9 9 HIS C C 9 178.123 178.123 177.189 0.934 25085
4236 1 8 . 1 1 9 9 HIS CA C 9 60.827 60.827 59.862 0.965 25085
4237 1 8 . 1 1 9 9 HIS CB C 9 29.552 29.552 29.997 -0.445 25085
4238 1 8 . 1 1 9 9 HIS H H 9 8.172 8.172 8.290 -0.118 25085
4239 1 8 . 1 1 10 10 ASP N N 10 120.665 120.665 119.822 0.843 25085
4240 1 8 . 1 1 10 10 ASP HA H 10 4.369 4.369 4.425 -0.056 25085
4241 1 8 . 1 1 10 10 ASP C C 10 179.100 179.100 177.926 1.174 25085
4242 1 8 . 1 1 10 10 ASP CA C 10 57.071 57.071 57.039 0.032 25085
4243 1 8 . 1 1 10 10 ASP CB C 10 39.529 39.529 40.904 -1.375 25085
4244 1 8 . 1 1 10 10 ASP H H 10 7.706 7.706 8.520 -0.814 25085
4245 1 8 . 1 1 11 11 ALA N N 11 123.686 123.686 122.428 1.258 25085
4246 1 8 . 1 1 11 11 ALA HA H 11 3.782 3.782 3.918 -0.136 25085
4247 1 8 . 1 1 11 11 ALA C C 11 178.260 178.260 179.774 -1.514 25085
4248 1 8 . 1 1 11 11 ALA CA C 11 55.142 55.142 55.269 -0.127 25085
4249 1 8 . 1 1 11 11 ALA CB C 11 18.293 18.293 18.064 0.229 25085
4250 1 8 . 1 1 11 11 ALA H H 11 8.896 8.896 7.592 1.304 25085
4251 1 8 . 1 1 12 12 GLN N N 12 117.521 117.521 117.734 -0.213 25085
4252 1 8 . 1 1 12 12 GLN HA H 12 4.000 4.000 4.025 -0.025 25085
4253 1 8 . 1 1 12 12 GLN C C 12 178.499 178.499 178.461 0.038 25085
4254 1 8 . 1 1 12 12 GLN CA C 12 60.102 60.102 58.787 1.315 25085
4255 1 8 . 1 1 12 12 GLN CB C 12 28.743 28.743 28.033 0.710 25085
4256 1 8 . 1 1 12 12 GLN H H 12 8.431 8.431 7.911 0.520 25085
4257 1 8 . 1 1 13 13 GLU N N 13 118.578 118.578 119.132 -0.554 25085
4258 1 8 . 1 1 13 13 GLU HA H 13 4.059 4.059 4.037 0.022 25085
4259 1 8 . 1 1 13 13 GLU C C 13 178.352 178.352 178.942 -0.590 25085
4260 1 8 . 1 1 13 13 GLU CA C 13 59.079 59.079 58.890 0.189 25085
4261 1 8 . 1 1 13 13 GLU CB C 13 29.213 29.213 29.479 -0.266 25085
4262 1 8 . 1 1 13 13 GLU H H 13 7.234 7.234 7.821 -0.587 25085
4263 1 8 . 1 1 14 14 LEU N N 14 119.848 119.848 119.065 0.783 25085
4264 1 8 . 1 1 14 14 LEU HA H 14 3.891 3.891 4.124 -0.233 25085
4265 1 8 . 1 1 14 14 LEU C C 14 180.773 180.773 179.412 1.361 25085
4266 1 8 . 1 1 14 14 LEU CA C 14 57.958 57.958 57.417 0.541 25085
4267 1 8 . 1 1 14 14 LEU CB C 14 41.715 41.715 42.143 -0.428 25085
4268 1 8 . 1 1 14 14 LEU H H 14 7.582 7.582 7.849 -0.267 25085
4269 1 8 . 1 1 15 15 ILE N N 15 122.392 122.392 118.408 3.984 25085
4270 1 8 . 1 1 15 15 ILE HA H 15 3.924 3.924 3.600 0.324 25085
4271 1 8 . 1 1 15 15 ILE C C 15 180.109 180.109 177.341 2.768 25085
4272 1 8 . 1 1 15 15 ILE CA C 15 64.663 64.663 64.389 0.274 25085
4273 1 8 . 1 1 15 15 ILE CB C 15 38.900 38.900 37.730 1.170 25085
4274 1 8 . 1 1 15 15 ILE H H 15 8.772 8.772 8.453 0.319 25085
4275 1 8 . 1 1 16 16 ALA N N 16 123.856 123.856 119.783 4.073 25085
4276 1 8 . 1 1 16 16 ALA HA H 16 4.183 4.183 4.237 -0.054 25085
4277 1 8 . 1 1 16 16 ALA C C 16 179.100 179.100 178.328 0.772 25085
4278 1 8 . 1 1 16 16 ALA CA C 16 54.806 54.806 53.811 0.995 25085
4279 1 8 . 1 1 16 16 ALA CB C 16 17.646 17.646 18.779 -1.133 25085
4280 1 8 . 1 1 16 16 ALA H H 16 7.808 7.808 7.322 0.486 25085
4281 1 8 . 1 1 17 17 ARG N N 17 115.329 115.329 117.949 -2.620 25085
4282 1 8 . 1 1 17 17 ARG HA H 17 4.404 4.404 4.423 -0.019 25085
4283 1 8 . 1 1 17 17 ARG C C 17 176.446 176.446 177.072 -0.626 25085
4284 1 8 . 1 1 17 17 ARG CA C 17 56.015 56.015 56.997 -0.982 25085
4285 1 8 . 1 1 17 17 ARG CB C 17 30.676 30.676 32.070 -1.394 25085
4286 1 8 . 1 1 17 17 ARG H H 17 7.280 7.280 8.446 -1.166 25085
4287 1 8 . 1 1 18 18 GLY N N 18 107.395 107.395 105.507 1.888 25085
4288 1 8 . 1 1 18 18 GLY C C 18 174.072 174.072 173.110 0.962 25085
4289 1 8 . 1 1 18 18 GLY CA C 18 45.218 45.218 44.689 0.529 25085
4290 1 8 . 1 1 18 18 GLY H H 18 7.795 7.795 8.310 -0.515 25085
4291 1 8 . 1 1 19 19 ALA N N 19 123.197 123.197 122.279 0.918 25085
4292 1 8 . 1 1 19 19 ALA HA H 19 4.217 4.217 4.200 0.017 25085
4293 1 8 . 1 1 19 19 ALA C C 19 176.261 176.261 176.680 -0.419 25085
4294 1 8 . 1 1 19 19 ALA CA C 19 52.674 52.674 52.085 0.589 25085
4295 1 8 . 1 1 19 19 ALA CB C 19 19.411 19.411 19.872 -0.461 25085
4296 1 8 . 1 1 19 19 ALA H H 19 7.980 7.980 7.489 0.491 25085
4297 1 8 . 1 1 20 20 LYS N N 20 118.629 118.629 119.464 -0.835 25085
4298 1 8 . 1 1 20 20 LYS HA H 20 4.308 4.308 4.364 -0.056 25085
4299 1 8 . 1 1 20 20 LYS C C 20 173.981 173.981 174.775 -0.794 25085
4300 1 8 . 1 1 20 20 LYS CA C 20 53.820 53.820 54.976 -1.156 25085
4301 1 8 . 1 1 20 20 LYS CB C 20 33.571 33.571 33.214 0.357 25085
4302 1 8 . 1 1 20 20 LYS H H 20 7.589 7.589 8.033 -0.444 25085
4303 1 8 . 1 1 21 21 LEU N N 21 126.686 126.686 126.655 0.031 25085
4304 1 8 . 1 1 21 21 LEU HA H 21 5.154 5.154 4.761 0.393 25085
4305 1 8 . 1 1 21 21 LEU C C 21 174.076 174.076 175.763 -1.687 25085
4306 1 8 . 1 1 21 21 LEU CA C 21 53.262 53.262 55.038 -1.776 25085
4307 1 8 . 1 1 21 21 LEU CB C 21 44.350 44.350 42.838 1.512 25085
4308 1 8 . 1 1 21 21 LEU H H 21 8.812 8.812 8.773 0.039 25085
4309 1 8 . 1 1 22 22 ILE N N 22 127.566 127.566 121.428 6.138 25085
4310 1 8 . 1 1 22 22 ILE HA H 22 4.678 4.678 4.654 0.024 25085
4311 1 8 . 1 1 22 22 ILE C C 22 173.136 173.136 174.092 -0.956 25085
4312 1 8 . 1 1 22 22 ILE CA C 22 60.160 60.160 59.584 0.576 25085
4313 1 8 . 1 1 22 22 ILE CB C 22 39.842 39.842 41.781 -1.939 25085
4314 1 8 . 1 1 22 22 ILE H H 22 9.416 9.416 8.756 0.660 25085
4315 1 8 . 1 1 23 23 ASP N N 23 129.217 129.217 124.070 5.147 25085
4316 1 8 . 1 1 23 23 ASP HA H 23 3.806 3.806 5.349 -1.543 25085
4317 1 8 . 1 1 23 23 ASP C C 23 176.042 176.042 175.043 0.999 25085
4318 1 8 . 1 1 23 23 ASP CA C 23 52.005 52.005 53.537 -1.532 25085
4319 1 8 . 1 1 23 23 ASP CB C 23 42.984 42.984 43.785 -0.801 25085
4320 1 8 . 1 1 23 23 ASP H H 23 8.619 8.619 8.496 0.123 25085
4321 1 8 . 1 1 24 24 ILE N N 24 115.522 115.522 118.395 -2.873 25085
4322 1 8 . 1 1 24 24 ILE HA H 24 5.255 5.255 4.834 0.421 25085
4323 1 8 . 1 1 24 24 ILE C C 24 178.920 178.920 173.686 5.234 25085
4324 1 8 . 1 1 24 24 ILE CA C 24 60.188 60.188 59.697 0.491 25085
4325 1 8 . 1 1 24 24 ILE CB C 24 38.015 38.015 38.026 -0.011 25085
4326 1 8 . 1 1 24 24 ILE H H 24 7.877 7.877 7.936 -0.059 25085
4327 1 8 . 1 1 25 25 ARG N N 25 124.317 124.317 124.403 -0.086 25085
4328 1 8 . 1 1 25 25 ARG HA H 25 4.170 4.170 4.478 -0.308 25085
4329 1 8 . 1 1 25 25 ARG C C 25 171.756 171.756 173.794 -2.038 25085
4330 1 8 . 1 1 25 25 ARG CA C 25 56.547 56.547 54.816 1.731 25085
4331 1 8 . 1 1 25 25 ARG CB C 25 30.897 30.897 31.089 -0.192 25085
4332 1 8 . 1 1 25 25 ARG H H 25 8.235 8.235 7.571 0.664 25085
4333 1 8 . 1 1 26 26 ASP N N 26 112.059 112.059 119.824 -7.765 25085
4334 1 8 . 1 1 26 26 ASP HA H 26 4.609 4.609 4.880 -0.271 25085
4335 1 8 . 1 1 26 26 ASP C C 26 177.934 177.934 177.176 0.758 25085
4336 1 8 . 1 1 26 26 ASP CA C 26 54.398 54.398 52.390 2.008 25085
4337 1 8 . 1 1 26 26 ASP CB C 26 42.029 42.029 41.270 0.758 25085
4338 1 8 . 1 1 26 26 ASP H H 26 7.730 7.730 8.483 -0.753 25085
4339 1 8 . 1 1 27 27 ALA N N 27 121.435 121.435 130.742 -9.307 25085
4340 1 8 . 1 1 27 27 ALA HA H 27 3.959 3.959 3.894 0.065 25085
4341 1 8 . 1 1 27 27 ALA C C 27 179.388 179.388 178.921 0.467 25085
4342 1 8 . 1 1 27 27 ALA CA C 27 55.829 55.829 55.518 0.311 25085
4343 1 8 . 1 1 27 27 ALA CB C 27 18.572 18.572 18.786 -0.214 25085
4344 1 8 . 1 1 27 27 ALA H H 27 8.797 8.797 8.810 -0.013 25085
4345 1 8 . 1 1 28 28 ASP N N 28 114.759 114.759 118.435 -3.676 25085
4346 1 8 . 1 1 28 28 ASP HA H 28 4.314 4.314 4.273 0.041 25085
4347 1 8 . 1 1 28 28 ASP C C 28 178.738 178.738 178.915 -0.177 25085
4348 1 8 . 1 1 28 28 ASP CA C 28 56.997 56.997 58.089 -1.092 25085
4349 1 8 . 1 1 28 28 ASP CB C 28 39.811 39.811 40.635 -0.823 25085
4350 1 8 . 1 1 28 28 ASP H H 28 8.755 8.755 8.072 0.683 25085
4351 1 8 . 1 1 29 29 GLU N N 29 119.562 119.562 118.538 1.024 25085
4352 1 8 . 1 1 29 29 GLU HA H 29 4.116 4.116 4.215 -0.099 25085
4353 1 8 . 1 1 29 29 GLU C C 29 178.473 178.473 178.940 -0.467 25085
4354 1 8 . 1 1 29 29 GLU CA C 29 58.928 58.928 58.708 0.220 25085
4355 1 8 . 1 1 29 29 GLU CB C 29 29.395 29.395 30.024 -0.629 25085
4356 1 8 . 1 1 29 29 GLU H H 29 7.446 7.446 8.822 -1.376 25085
4357 1 8 . 1 1 30 30 TYR N N 30 120.494 120.494 121.181 -0.687 25085
4358 1 8 . 1 1 30 30 TYR HA H 30 4.092 4.092 4.468 -0.376 25085
4359 1 8 . 1 1 30 30 TYR C C 30 176.988 176.988 177.932 -0.944 25085
4360 1 8 . 1 1 30 30 TYR CA C 30 60.931 60.931 60.696 0.235 25085
4361 1 8 . 1 1 30 30 TYR CB C 30 39.534 39.534 38.614 0.920 25085
4362 1 8 . 1 1 30 30 TYR H H 30 7.545 7.545 7.510 0.035 25085
4363 1 8 . 1 1 31 31 LEU N N 31 118.227 118.227 119.947 -1.720 25085
4364 1 8 . 1 1 31 31 LEU HA H 31 3.916 3.916 3.892 0.024 25085
4365 1 8 . 1 1 31 31 LEU C C 31 178.824 178.824 178.062 0.762 25085
4366 1 8 . 1 1 31 31 LEU CA C 31 57.444 57.444 58.132 -0.688 25085
4367 1 8 . 1 1 31 31 LEU CB C 31 41.941 41.941 42.162 -0.221 25085
4368 1 8 . 1 1 31 31 LEU H H 31 8.235 8.235 8.741 -0.506 25085
4369 1 8 . 1 1 32 32 ARG N N 32 117.334 117.334 116.857 0.477 25085
4370 1 8 . 1 1 32 32 ARG HA H 32 4.112 4.112 4.092 0.020 25085
4371 1 8 . 1 1 32 32 ARG C C 32 177.008 177.008 176.398 0.610 25085
4372 1 8 . 1 1 32 32 ARG CA C 32 59.366 59.366 58.431 0.935 25085
4373 1 8 . 1 1 32 32 ARG CB C 32 30.938 30.938 30.583 0.355 25085
4374 1 8 . 1 1 32 32 ARG H H 32 7.133 7.133 7.575 -0.442 25085
4375 1 8 . 1 1 33 33 GLU N N 33 117.282 117.282 118.183 -0.901 25085
4376 1 8 . 1 1 33 33 GLU HA H 33 4.893 4.893 4.579 0.314 25085
4377 1 8 . 1 1 33 33 GLU C C 33 173.503 173.503 173.596 -0.093 25085
4378 1 8 . 1 1 33 33 GLU CA C 33 56.291 56.291 56.005 0.286 25085
4379 1 8 . 1 1 33 33 GLU CB C 33 32.248 32.248 33.117 -0.869 25085
4380 1 8 . 1 1 33 33 GLU H H 33 7.521 7.521 7.386 0.135 25085
4381 1 8 . 1 1 34 34 HIS N N 34 117.828 117.828 118.949 -1.121 25085
4382 1 8 . 1 1 34 34 HIS HA H 34 4.627 4.627 3.831 0.796 25085
4383 1 8 . 1 1 34 34 HIS C C 34 171.950 171.950 173.065 -1.115 25085
4384 1 8 . 1 1 34 34 HIS CA C 34 54.304 54.304 53.400 0.904 25085
4385 1 8 . 1 1 34 34 HIS CB C 34 30.712 30.712 32.515 -1.803 25085
4386 1 8 . 1 1 34 34 HIS H H 34 8.354 8.354 8.896 -0.542 25085
4387 1 8 . 1 1 35 35 ILE N N 35 126.965 126.965 119.797 7.168 25085
4388 1 8 . 1 1 35 35 ILE HA H 35 3.973 3.973 4.152 -0.179 25085
4389 1 8 . 1 1 35 35 ILE CA C 35 60.500 60.500 56.683 3.817 25085
4390 1 8 . 1 1 35 35 ILE CB C 35 38.822 38.822 37.107 1.715 25085
4391 1 8 . 1 1 35 35 ILE H H 35 10.032 10.032 8.067 1.965 25085
4392 1 8 . 1 1 36 36 PRO HA H 36 4.033 4.033 4.557 -0.524 25085
4393 1 8 . 1 1 36 36 PRO C C 36 177.308 177.308 176.108 1.200 25085
4394 1 8 . 1 1 36 36 PRO CA C 36 66.191 66.191 63.425 2.766 25085
4395 1 8 . 1 1 36 36 PRO CB C 36 31.701 31.701 31.432 0.269 25085
4396 1 8 . 1 1 37 37 GLU N N 37 113.735 113.735 117.391 -3.656 25085
4397 1 8 . 1 1 37 37 GLU HA H 37 4.083 4.083 4.547 -0.464 25085
4398 1 8 . 1 1 37 37 GLU C C 37 176.274 176.274 174.713 1.561 25085
4399 1 8 . 1 1 37 37 GLU CA C 37 58.285 58.285 55.884 2.401 25085
4400 1 8 . 1 1 37 37 GLU CB C 37 28.895 28.895 29.832 -0.937 25085
4401 1 8 . 1 1 37 37 GLU H H 37 8.625 8.625 8.247 0.378 25085
4402 1 8 . 1 1 38 38 ALA N N 38 122.325 122.325 121.140 1.185 25085
4403 1 8 . 1 1 38 38 ALA HA H 38 4.484 4.484 4.744 -0.260 25085
4404 1 8 . 1 1 38 38 ALA C C 38 178.043 178.043 175.497 2.546 25085
4405 1 8 . 1 1 38 38 ALA CA C 38 52.385 52.385 51.069 1.316 25085
4406 1 8 . 1 1 38 38 ALA CB C 38 21.151 21.151 21.842 -0.691 25085
4407 1 8 . 1 1 38 38 ALA H H 38 8.160 8.160 7.422 0.738 25085
4408 1 8 . 1 1 39 39 ASP N N 39 123.726 123.726 120.207 3.519 25085
4409 1 8 . 1 1 39 39 ASP HA H 39 4.856 4.856 4.812 0.044 25085
4410 1 8 . 1 1 39 39 ASP C C 39 174.077 174.077 175.045 -0.968 25085
4411 1 8 . 1 1 39 39 ASP CA C 39 53.498 53.498 54.428 -0.930 25085
4412 1 8 . 1 1 39 39 ASP CB C 39 45.176 45.176 42.593 2.583 25085
4413 1 8 . 1 1 39 39 ASP H H 39 9.095 9.095 8.766 0.329 25085
4414 1 8 . 1 1 40 40 LEU N N 40 123.111 123.111 122.885 0.226 25085
4415 1 8 . 1 1 40 40 LEU HA H 40 4.339 4.339 4.394 -0.055 25085
4416 1 8 . 1 1 40 40 LEU C C 40 176.159 176.159 175.471 0.688 25085
4417 1 8 . 1 1 40 40 LEU CA C 40 54.766 54.766 54.032 0.734 25085
4418 1 8 . 1 1 40 40 LEU CB C 40 41.988 41.988 42.934 -0.946 25085
4419 1 8 . 1 1 40 40 LEU H H 40 8.199 8.199 8.309 -0.110 25085
4420 1 8 . 1 1 41 41 ALA N N 41 130.678 130.678 130.469 0.209 25085
4421 1 8 . 1 1 41 41 ALA HA H 41 4.430 4.430 4.766 -0.336 25085
4422 1 8 . 1 1 41 41 ALA CA C 41 49.844 49.844 49.691 0.152 25085
4423 1 8 . 1 1 41 41 ALA CB C 41 18.765 18.765 19.837 -1.072 25085
4424 1 8 . 1 1 41 41 ALA H H 41 8.705 8.705 8.399 0.306 25085
4425 1 8 . 1 1 42 42 PRO HA H 42 4.133 4.133 4.421 -0.288 25085
4426 1 8 . 1 1 42 42 PRO C C 42 178.946 178.946 178.060 0.886 25085
4427 1 8 . 1 1 42 42 PRO CA C 42 62.119 62.119 62.855 -0.736 25085
4428 1 8 . 1 1 42 42 PRO CB C 42 33.383 33.383 31.788 1.595 25085
4429 1 8 . 1 1 43 43 LEU N N 43 124.604 124.604 123.497 1.107 25085
4430 1 8 . 1 1 43 43 LEU HA H 43 3.881 3.881 3.964 -0.083 25085
4431 1 8 . 1 1 43 43 LEU C C 43 176.869 176.869 178.017 -1.148 25085
4432 1 8 . 1 1 43 43 LEU CA C 43 58.639 58.639 57.735 0.904 25085
4433 1 8 . 1 1 43 43 LEU CB C 43 41.848 41.848 41.737 0.111 25085
4434 1 8 . 1 1 43 43 LEU H H 43 8.330 8.330 8.508 -0.178 25085
4435 1 8 . 1 1 44 44 SER N N 44 110.167 110.167 112.747 -2.580 25085
4436 1 8 . 1 1 44 44 SER HA H 44 4.147 4.147 4.248 -0.101 25085
4437 1 8 . 1 1 44 44 SER C C 44 177.107 177.107 176.226 0.881 25085
4438 1 8 . 1 1 44 44 SER CA C 44 61.043 61.043 61.346 -0.303 25085
4439 1 8 . 1 1 44 44 SER CB C 44 61.765 61.765 62.975 -1.210 25085
4440 1 8 . 1 1 44 44 SER H H 44 8.553 8.553 8.007 0.546 25085
4441 1 8 . 1 1 45 45 VAL N N 45 123.549 123.549 122.608 0.941 25085
4442 1 8 . 1 1 45 45 VAL HA H 45 3.825 3.825 3.949 -0.124 25085
4443 1 8 . 1 1 45 45 VAL C C 45 178.328 178.328 176.827 1.501 25085
4444 1 8 . 1 1 45 45 VAL CA C 45 65.576 65.576 64.696 0.880 25085
4445 1 8 . 1 1 45 45 VAL CB C 45 31.889 31.889 31.660 0.229 25085
4446 1 8 . 1 1 45 45 VAL H H 45 7.181 7.181 8.349 -1.168 25085
4447 1 8 . 1 1 46 46 LEU N N 46 120.336 120.336 120.544 -0.208 25085
4448 1 8 . 1 1 46 46 LEU HA H 46 3.826 3.826 4.093 -0.267 25085
4449 1 8 . 1 1 46 46 LEU C C 46 179.996 179.996 177.755 2.241 25085
4450 1 8 . 1 1 46 46 LEU CA C 46 57.602 57.602 57.614 -0.012 25085
4451 1 8 . 1 1 46 46 LEU CB C 46 41.691 41.691 42.071 -0.379 25085
4452 1 8 . 1 1 46 46 LEU H H 46 8.040 8.040 8.096 -0.056 25085
4453 1 8 . 1 1 47 47 GLU N N 47 115.713 115.713 117.174 -1.461 25085
4454 1 8 . 1 1 47 47 GLU HA H 47 3.820 3.820 4.080 -0.260 25085
4455 1 8 . 1 1 47 47 GLU C C 47 177.029 177.029 177.853 -0.824 25085
4456 1 8 . 1 1 47 47 GLU CA C 47 59.317 59.317 58.490 0.827 25085
4457 1 8 . 1 1 47 47 GLU CB C 47 30.526 30.526 30.025 0.501 25085
4458 1 8 . 1 1 47 47 GLU H H 47 8.567 8.567 7.780 0.787 25085
4459 1 8 . 1 1 48 48 GLN N N 48 116.740 116.740 116.733 0.007 25085
4460 1 8 . 1 1 48 48 GLN HA H 48 4.281 4.281 4.248 0.033 25085
4461 1 8 . 1 1 48 48 GLN C C 48 177.605 177.605 177.842 -0.237 25085
4462 1 8 . 1 1 48 48 GLN CA C 48 57.827 57.827 57.408 0.419 25085
4463 1 8 . 1 1 48 48 GLN CB C 48 29.985 29.985 28.881 1.103 25085
4464 1 8 . 1 1 48 48 GLN H H 48 7.472 7.472 7.620 -0.148 25085
4465 1 8 . 1 1 49 49 SER N N 49 111.004 111.004 117.220 -6.216 25085
4466 1 8 . 1 1 49 49 SER HA H 49 4.648 4.648 4.282 0.366 25085
4467 1 8 . 1 1 49 49 SER C C 49 174.859 174.859 175.115 -0.256 25085
4468 1 8 . 1 1 49 49 SER CA C 49 58.406 58.406 59.877 -1.471 25085
4469 1 8 . 1 1 49 49 SER CB C 49 64.758 64.758 64.238 0.520 25085
4470 1 8 . 1 1 49 49 SER H H 49 8.657 8.657 8.096 0.561 25085
4471 1 8 . 1 1 50 50 GLY N N 50 110.839 110.839 109.649 1.190 25085
4472 1 8 . 1 1 50 50 GLY C C 50 172.398 172.398 173.055 -0.657 25085
4473 1 8 . 1 1 50 50 GLY CA C 50 44.444 44.444 44.975 -0.531 25085
4474 1 8 . 1 1 50 50 GLY H H 50 7.846 7.846 7.802 0.044 25085
4475 1 8 . 1 1 51 51 LEU N N 51 121.009 121.009 124.923 -3.914 25085
4476 1 8 . 1 1 51 51 LEU HA H 51 4.244 4.244 4.876 -0.632 25085
4477 1 8 . 1 1 51 51 LEU CA C 51 52.593 52.593 51.460 1.133 25085
4478 1 8 . 1 1 51 51 LEU CB C 51 43.381 43.381 43.920 -0.539 25085
4479 1 8 . 1 1 51 51 LEU H H 51 8.647 8.647 7.984 0.663 25085
4480 1 8 . 1 1 52 52 PRO HA H 52 4.349 4.349 4.505 -0.156 25085
4481 1 8 . 1 1 52 52 PRO C C 52 177.247 177.247 177.564 -0.317 25085
4482 1 8 . 1 1 52 52 PRO CA C 52 62.980 62.980 63.087 -0.107 25085
4483 1 8 . 1 1 52 52 PRO CB C 52 32.423 32.423 29.788 2.635 25085
4484 1 8 . 1 1 53 53 ALA N N 53 126.595 126.595 124.949 1.646 25085
4485 1 8 . 1 1 53 53 ALA HA H 53 3.870 3.870 3.988 -0.118 25085
4486 1 8 . 1 1 53 53 ALA C C 53 180.484 180.484 179.301 1.183 25085
4487 1 8 . 1 1 53 53 ALA CA C 53 55.829 55.829 54.950 0.879 25085
4488 1 8 . 1 1 53 53 ALA CB C 53 18.248 18.248 18.532 -0.284 25085
4489 1 8 . 1 1 53 53 ALA H H 53 8.643 8.643 9.116 -0.473 25085
4490 1 8 . 1 1 54 54 LYS N N 54 113.898 113.898 118.862 -4.964 25085
4491 1 8 . 1 1 54 54 LYS HA H 54 4.167 4.167 4.066 0.101 25085
4492 1 8 . 1 1 54 54 LYS C C 54 176.704 176.704 178.503 -1.799 25085
4493 1 8 . 1 1 54 54 LYS CA C 54 57.893 57.893 58.861 -0.968 25085
4494 1 8 . 1 1 54 54 LYS CB C 54 31.892 31.892 32.183 -0.291 25085
4495 1 8 . 1 1 54 54 LYS H H 54 8.442 8.442 8.259 0.183 25085
4496 1 8 . 1 1 55 55 LEU N N 55 117.932 117.932 118.721 -0.789 25085
4497 1 8 . 1 1 55 55 LEU HA H 55 4.308 4.308 4.304 0.004 25085
4498 1 8 . 1 1 55 55 LEU C C 55 174.589 174.589 178.079 -3.490 25085
4499 1 8 . 1 1 55 55 LEU CA C 55 54.003 54.003 56.737 -2.734 25085
4500 1 8 . 1 1 55 55 LEU CB C 55 41.649 41.649 42.255 -0.606 25085
4501 1 8 . 1 1 55 55 LEU H H 55 7.805 7.805 8.381 -0.576 25085
4502 1 8 . 1 1 56 56 ARG N N 56 116.873 116.873 116.949 -0.076 25085
4503 1 8 . 1 1 56 56 ARG HA H 56 4.006 4.006 4.443 -0.437 25085
4504 1 8 . 1 1 56 56 ARG C C 56 175.542 175.542 175.768 -0.226 25085
4505 1 8 . 1 1 56 56 ARG CA C 56 57.428 57.428 56.105 1.323 25085
4506 1 8 . 1 1 56 56 ARG CB C 56 29.651 29.651 30.529 -0.878 25085
4507 1 8 . 1 1 56 56 ARG H H 56 6.971 6.971 7.853 -0.882 25085
4508 1 8 . 1 1 57 57 HIS N N 57 122.622 122.622 116.939 5.683 25085
4509 1 8 . 1 1 57 57 HIS HA H 57 4.596 4.596 4.562 0.034 25085
4510 1 8 . 1 1 57 57 HIS C C 57 173.855 173.855 172.837 1.018 25085
4511 1 8 . 1 1 57 57 HIS CA C 57 55.780 55.780 56.015 -0.235 25085
4512 1 8 . 1 1 57 57 HIS CB C 57 33.878 33.878 30.874 3.004 25085
4513 1 8 . 1 1 57 57 HIS H H 57 7.281 7.281 7.516 -0.235 25085
4514 1 8 . 1 1 58 58 GLU N N 58 120.479 120.479 118.213 2.266 25085
4515 1 8 . 1 1 58 58 GLU HA H 58 4.052 4.052 4.445 -0.393 25085
4516 1 8 . 1 1 58 58 GLU C C 58 176.762 176.762 175.159 1.603 25085
4517 1 8 . 1 1 58 58 GLU CA C 58 59.634 59.634 56.611 3.023 25085
4518 1 8 . 1 1 58 58 GLU CB C 58 29.931 29.931 32.213 -2.282 25085
4519 1 8 . 1 1 58 58 GLU H H 58 7.626 7.626 8.196 -0.570 25085
4520 1 8 . 1 1 59 59 GLN N N 59 118.110 118.110 119.316 -1.206 25085
4521 1 8 . 1 1 59 59 GLN HA H 59 5.479 5.479 5.451 0.028 25085
4522 1 8 . 1 1 59 59 GLN C C 59 174.322 174.322 175.608 -1.286 25085
4523 1 8 . 1 1 59 59 GLN CA C 59 55.486 55.486 54.712 0.774 25085
4524 1 8 . 1 1 59 59 GLN CB C 59 33.151 33.151 31.980 1.171 25085
4525 1 8 . 1 1 59 59 GLN H H 59 8.560 8.560 8.333 0.227 25085
4526 1 8 . 1 1 60 60 ILE N N 60 122.789 122.789 122.014 0.775 25085
4527 1 8 . 1 1 60 60 ILE HA H 60 4.531 4.531 4.841 -0.310 25085
4528 1 8 . 1 1 60 60 ILE C C 60 173.352 173.352 174.245 -0.893 25085
4529 1 8 . 1 1 60 60 ILE CA C 60 59.794 59.794 59.678 0.116 25085
4530 1 8 . 1 1 60 60 ILE CB C 60 43.188 43.188 42.010 1.178 25085
4531 1 8 . 1 1 60 60 ILE H H 60 8.735 8.735 8.168 0.567 25085
4532 1 8 . 1 1 61 61 ILE N N 61 125.871 125.871 120.182 5.689 25085
4533 1 8 . 1 1 61 61 ILE HA H 61 5.002 5.002 4.835 0.167 25085
4534 1 8 . 1 1 61 61 ILE C C 61 175.195 175.195 174.267 0.928 25085
4535 1 8 . 1 1 61 61 ILE CA C 61 58.419 58.419 59.638 -1.219 25085
4536 1 8 . 1 1 61 61 ILE CB C 61 40.270 40.270 40.904 -0.634 25085
4537 1 8 . 1 1 61 61 ILE H H 61 9.057 9.057 8.769 0.288 25085
4538 1 8 . 1 1 62 62 PHE N N 62 123.742 123.742 125.377 -1.635 25085
4539 1 8 . 1 1 62 62 PHE HA H 62 5.810 5.810 5.549 0.261 25085
4540 1 8 . 1 1 62 62 PHE C C 62 176.135 176.135 174.963 1.172 25085
4541 1 8 . 1 1 62 62 PHE CA C 62 56.960 56.960 55.854 1.106 25085
4542 1 8 . 1 1 62 62 PHE CB C 62 43.352 43.352 42.100 1.252 25085
4543 1 8 . 1 1 62 62 PHE H H 62 8.977 8.977 8.232 0.745 25085
4544 1 8 . 1 1 63 63 HIS N N 63 116.939 116.939 116.449 0.490 25085
4545 1 8 . 1 1 63 63 HIS HA H 63 5.979 5.979 5.166 0.813 25085
4546 1 8 . 1 1 63 63 HIS C C 63 171.108 171.108 173.514 -2.406 25085
4547 1 8 . 1 1 63 63 HIS CA C 63 54.115 54.115 53.879 0.236 25085
4548 1 8 . 1 1 63 63 HIS CB C 63 36.861 36.861 30.921 5.940 25085
4549 1 8 . 1 1 63 63 HIS H H 63 9.298 9.298 8.679 0.619 25085
4550 1 8 . 1 1 64 64 CYS N N 64 119.251 119.251 122.014 -2.763 25085
4551 1 8 . 1 1 64 64 CYS HA H 64 5.044 5.044 4.877 0.167 25085
4552 1 8 . 1 1 64 64 CYS C C 64 177.438 177.438 175.637 1.801 25085
4553 1 8 . 1 1 64 64 CYS CA C 64 56.886 56.886 57.505 -0.619 25085
4554 1 8 . 1 1 64 64 CYS CB C 64 29.425 29.425 31.640 -2.215 25085
4555 1 8 . 1 1 64 64 CYS H H 64 8.156 8.156 8.439 -0.283 25085
4556 1 8 . 1 1 65 65 GLN N N 65 125.627 125.627 123.463 2.164 25085
4557 1 8 . 1 1 65 65 GLN HA H 65 4.220 4.220 3.846 0.374 25085
4558 1 8 . 1 1 65 65 GLN C C 65 174.440 174.440 176.653 -2.213 25085
4559 1 8 . 1 1 65 65 GLN CA C 65 59.788 59.788 59.426 0.362 25085
4560 1 8 . 1 1 65 65 GLN CB C 65 29.370 29.370 28.313 1.057 25085
4561 1 8 . 1 1 65 65 GLN H H 65 8.937 8.937 9.037 -0.100 25085
4562 1 8 . 1 1 66 66 ALA N N 66 118.880 118.880 115.419 3.461 25085
4563 1 8 . 1 1 66 66 ALA HA H 66 5.115 5.115 4.797 0.318 25085
4564 1 8 . 1 1 66 66 ALA C C 66 177.625 177.625 177.102 0.523 25085
4565 1 8 . 1 1 66 66 ALA CA C 66 50.744 50.744 52.163 -1.419 25085
4566 1 8 . 1 1 66 66 ALA CB C 66 20.658 20.658 19.865 0.793 25085
4567 1 8 . 1 1 66 66 ALA H H 66 9.024 9.024 7.979 1.045 25085
4568 1 8 . 1 1 67 67 GLY N N 67 112.878 112.878 106.497 6.381 25085
4569 1 8 . 1 1 67 67 GLY C C 67 174.810 174.810 176.036 -1.226 25085
4570 1 8 . 1 1 67 67 GLY CA C 67 45.642 45.642 45.878 -0.236 25085
4571 1 8 . 1 1 67 67 GLY H H 67 8.845 8.845 8.147 0.698 25085
4572 1 8 . 1 1 68 68 LYS N N 68 120.133 120.133 120.799 -0.666 25085
4573 1 8 . 1 1 68 68 LYS HA H 68 4.158 4.158 4.106 0.052 25085
4574 1 8 . 1 1 68 68 LYS C C 68 177.939 177.939 178.337 -0.398 25085
4575 1 8 . 1 1 68 68 LYS CA C 68 58.811 58.811 58.637 0.174 25085
4576 1 8 . 1 1 68 68 LYS CB C 68 32.796 32.796 32.220 0.576 25085
4577 1 8 . 1 1 68 68 LYS H H 68 7.936 7.936 8.550 -0.614 25085
4578 1 8 . 1 1 69 69 ARG N N 69 125.804 125.804 117.991 7.813 25085
4579 1 8 . 1 1 69 69 ARG HA H 69 4.217 4.217 4.320 -0.103 25085
4580 1 8 . 1 1 69 69 ARG C C 69 180.944 180.944 178.282 2.662 25085
4581 1 8 . 1 1 69 69 ARG CA C 69 60.010 60.010 58.624 1.386 25085
4582 1 8 . 1 1 69 69 ARG CB C 69 30.974 30.974 29.370 1.604 25085
4583 1 8 . 1 1 69 69 ARG H H 69 8.981 8.981 8.482 0.499 25085
4584 1 8 . 1 1 70 70 THR N N 70 116.681 116.681 116.985 -0.304 25085
4585 1 8 . 1 1 70 70 THR HA H 70 3.607 3.607 3.994 -0.387 25085
4586 1 8 . 1 1 70 70 THR C C 70 176.434 176.434 176.680 -0.246 25085
4587 1 8 . 1 1 70 70 THR CA C 70 65.914 65.914 67.353 -1.439 25085
4588 1 8 . 1 1 70 70 THR CB C 70 68.169 68.169 68.195 -0.026 25085
4589 1 8 . 1 1 70 70 THR H H 70 10.382 10.382 7.513 2.869 25085
4590 1 8 . 1 1 71 71 SER N N 71 113.046 113.046 115.669 -2.623 25085
4591 1 8 . 1 1 71 71 SER HA H 71 3.993 3.993 4.214 -0.221 25085
4592 1 8 . 1 1 71 71 SER C C 71 177.594 177.594 175.550 2.044 25085
4593 1 8 . 1 1 71 71 SER CA C 71 62.500 62.500 61.886 0.614 25085
4594 1 8 . 1 1 71 71 SER H H 71 7.346 7.346 7.751 -0.405 25085
4595 1 8 . 1 1 72 72 ASN N N 72 117.540 117.540 117.653 -0.113 25085
4596 1 8 . 1 1 72 72 ASN HA H 72 4.598 4.598 4.655 -0.057 25085
4597 1 8 . 1 1 72 72 ASN C C 72 175.595 175.595 176.517 -0.922 25085
4598 1 8 . 1 1 72 72 ASN CA C 72 55.147 55.147 55.759 -0.612 25085
4599 1 8 . 1 1 72 72 ASN CB C 72 38.821 38.821 39.023 -0.202 25085
4600 1 8 . 1 1 72 72 ASN H H 72 8.078 8.078 7.561 0.517 25085
4601 1 8 . 1 1 73 73 ASN N N 73 114.869 114.869 118.474 -3.605 25085
4602 1 8 . 1 1 73 73 ASN HA H 73 5.159 5.159 4.598 0.561 25085
4603 1 8 . 1 1 73 73 ASN C C 73 174.375 174.375 176.247 -1.872 25085
4604 1 8 . 1 1 73 73 ASN CA C 73 52.976 52.976 54.326 -1.350 25085
4605 1 8 . 1 1 73 73 ASN CB C 73 39.862 39.862 38.659 1.203 25085
4606 1 8 . 1 1 73 73 ASN H H 73 7.290 7.290 8.649 -1.359 25085
4607 1 8 . 1 1 74 74 ALA N N 74 124.647 124.647 121.842 2.805 25085
4608 1 8 . 1 1 74 74 ALA HA H 74 3.721 3.721 3.810 -0.089 25085
4609 1 8 . 1 1 74 74 ALA C C 74 177.908 177.908 178.321 -0.413 25085
4610 1 8 . 1 1 74 74 ALA CA C 74 57.085 57.085 55.168 1.917 25085
4611 1 8 . 1 1 74 74 ALA CB C 74 19.427 19.427 18.422 1.005 25085
4612 1 8 . 1 1 74 74 ALA H H 74 7.105 7.105 8.689 -1.584 25085
4613 1 8 . 1 1 75 75 ASP N N 75 114.917 114.917 117.665 -2.748 25085
4614 1 8 . 1 1 75 75 ASP HA H 75 4.250 4.250 4.453 -0.203 25085
4615 1 8 . 1 1 75 75 ASP C C 75 179.100 179.100 178.250 0.850 25085
4616 1 8 . 1 1 75 75 ASP CA C 75 57.236 57.236 56.720 0.516 25085
4617 1 8 . 1 1 75 75 ASP CB C 75 39.783 39.783 40.163 -0.379 25085
4618 1 8 . 1 1 75 75 ASP H H 75 8.403 8.403 7.728 0.675 25085
4619 1 8 . 1 1 76 76 LYS N N 76 121.888 121.888 120.444 1.444 25085
4620 1 8 . 1 1 76 76 LYS HA H 76 4.053 4.053 4.115 -0.062 25085
4621 1 8 . 1 1 76 76 LYS C C 76 178.832 178.832 179.089 -0.257 25085
4622 1 8 . 1 1 76 76 LYS CA C 76 58.864 58.864 58.169 0.695 25085
4623 1 8 . 1 1 76 76 LYS CB C 76 32.423 32.423 31.912 0.511 25085
4624 1 8 . 1 1 76 76 LYS H H 76 7.652 7.652 7.896 -0.244 25085
4625 1 8 . 1 1 77 77 LEU N N 77 118.644 118.644 120.078 -1.434 25085
4626 1 8 . 1 1 77 77 LEU HA H 77 3.557 3.557 3.707 -0.150 25085
4627 1 8 . 1 1 77 77 LEU C C 77 178.068 178.068 178.346 -0.278 25085
4628 1 8 . 1 1 77 77 LEU CA C 77 57.692 57.692 57.763 -0.071 25085
4629 1 8 . 1 1 77 77 LEU CB C 77 40.077 40.077 41.276 -1.199 25085
4630 1 8 . 1 1 77 77 LEU H H 77 8.146 8.146 8.500 -0.354 25085
4631 1 8 . 1 1 78 78 ALA N N 78 119.668 119.668 121.379 -1.711 25085
4632 1 8 . 1 1 78 78 ALA HA H 78 3.990 3.990 3.895 0.095 25085
4633 1 8 . 1 1 78 78 ALA C C 78 179.542 179.542 180.264 -0.722 25085
4634 1 8 . 1 1 78 78 ALA CA C 78 54.937 54.937 54.869 0.068 25085
4635 1 8 . 1 1 78 78 ALA CB C 78 18.080 18.080 18.018 0.062 25085
4636 1 8 . 1 1 78 78 ALA H H 78 8.136 8.136 7.423 0.713 25085
4637 1 8 . 1 1 79 79 ALA N N 79 118.918 118.918 121.574 -2.656 25085
4638 1 8 . 1 1 79 79 ALA HA H 79 4.139 4.139 4.031 0.108 25085
4639 1 8 . 1 1 79 79 ALA C C 79 180.800 180.800 179.205 1.595 25085
4640 1 8 . 1 1 79 79 ALA CA C 79 54.571 54.571 54.860 -0.289 25085
4641 1 8 . 1 1 79 79 ALA CB C 79 18.268 18.268 18.389 -0.121 25085
4642 1 8 . 1 1 79 79 ALA H H 79 7.319 7.319 7.496 -0.177 25085
4643 1 8 . 1 1 80 80 ILE N N 80 118.438 118.438 114.687 3.751 25085
4644 1 8 . 1 1 80 80 ILE HA H 80 3.801 3.801 3.985 -0.184 25085
4645 1 8 . 1 1 80 80 ILE C C 80 177.302 177.302 175.085 2.217 25085
4646 1 8 . 1 1 80 80 ILE CA C 80 64.252 64.252 62.352 1.900 25085
4647 1 8 . 1 1 80 80 ILE CB C 80 39.115 39.115 37.321 1.794 25085
4648 1 8 . 1 1 80 80 ILE H H 80 8.227 8.227 7.461 0.766 25085
4649 1 8 . 1 1 81 81 ALA N N 81 117.917 117.917 120.908 -2.991 25085
4650 1 8 . 1 1 81 81 ALA HA H 81 4.466 4.466 4.592 -0.126 25085
4651 1 8 . 1 1 81 81 ALA C C 81 176.153 176.153 176.069 0.084 25085
4652 1 8 . 1 1 81 81 ALA CA C 81 51.404 51.404 49.778 1.626 25085
4653 1 8 . 1 1 81 81 ALA CB C 81 20.200 20.200 19.713 0.487 25085
4654 1 8 . 1 1 81 81 ALA H H 81 7.913 7.913 7.436 0.477 25085
4655 1 8 . 1 1 82 82 ALA N N 82 124.086 124.086 127.502 -3.416 25085
4656 1 8 . 1 1 82 82 ALA HA H 82 4.457 4.457 4.207 0.250 25085
4657 1 8 . 1 1 82 82 ALA CA C 82 52.276 52.276 51.433 0.843 25085
4658 1 8 . 1 1 82 82 ALA CB C 82 17.243 17.243 17.642 -0.399 25085
4659 1 8 . 1 1 82 82 ALA H H 82 7.223 7.223 8.404 -1.181 25085
4660 1 8 . 1 1 83 83 PRO HA H 83 4.692 4.692 4.238 0.454 25085
4661 1 8 . 1 1 83 83 PRO C C 83 175.169 175.169 175.552 -0.383 25085
4662 1 8 . 1 1 83 83 PRO CA C 83 63.767 63.767 63.755 0.012 25085
4663 1 8 . 1 1 83 83 PRO CB C 83 32.624 32.624 29.419 3.205 25085
4664 1 8 . 1 1 84 84 ALA N N 84 127.741 127.741 124.490 3.251 25085
4665 1 8 . 1 1 84 84 ALA HA H 84 4.138 4.138 4.449 -0.311 25085
4666 1 8 . 1 1 84 84 ALA C C 84 176.494 176.494 176.452 0.042 25085
4667 1 8 . 1 1 84 84 ALA CA C 84 53.432 53.432 50.932 2.500 25085
4668 1 8 . 1 1 84 84 ALA CB C 84 19.719 19.719 21.005 -1.286 25085
4669 1 8 . 1 1 84 84 ALA H H 84 8.528 8.528 8.562 -0.034 25085
4670 1 8 . 1 1 85 85 GLU N N 85 121.634 121.634 119.428 2.206 25085
4671 1 8 . 1 1 85 85 GLU HA H 85 4.228 4.228 4.586 -0.358 25085
4672 1 8 . 1 1 85 85 GLU C C 85 175.094 175.094 174.527 0.567 25085
4673 1 8 . 1 1 85 85 GLU CA C 85 56.444 56.444 54.682 1.762 25085
4674 1 8 . 1 1 85 85 GLU CB C 85 30.803 30.803 29.567 1.236 25085
4675 1 8 . 1 1 85 85 GLU H H 85 8.166 8.166 8.256 -0.090 25085
4676 1 8 . 1 1 86 86 ILE N N 86 122.543 122.543 119.827 2.716 25085
4677 1 8 . 1 1 86 86 ILE HA H 86 5.269 5.269 4.730 0.539 25085
4678 1 8 . 1 1 86 86 ILE C C 86 174.463 174.463 174.690 -0.227 25085
4679 1 8 . 1 1 86 86 ILE CA C 86 59.329 59.329 59.872 -0.543 25085
4680 1 8 . 1 1 86 86 ILE CB C 86 40.546 40.546 39.964 0.582 25085
4681 1 8 . 1 1 86 86 ILE H H 86 7.925 7.925 8.135 -0.210 25085
4682 1 8 . 1 1 87 87 PHE N N 87 122.457 122.457 123.017 -0.560 25085
4683 1 8 . 1 1 87 87 PHE HA H 87 5.428 5.428 5.690 -0.262 25085
4684 1 8 . 1 1 87 87 PHE C C 87 174.450 174.450 174.927 -0.477 25085
4685 1 8 . 1 1 87 87 PHE CA C 87 55.029 55.029 55.633 -0.605 25085
4686 1 8 . 1 1 87 87 PHE CB C 87 43.626 43.626 43.408 0.218 25085
4687 1 8 . 1 1 87 87 PHE H H 87 9.050 9.050 8.717 0.333 25085
4688 1 8 . 1 1 88 88 LEU N N 88 119.959 119.959 118.395 1.564 25085
4689 1 8 . 1 1 88 88 LEU HA H 88 5.358 5.358 4.906 0.452 25085
4690 1 8 . 1 1 88 88 LEU C C 88 176.627 176.627 175.034 1.593 25085
4691 1 8 . 1 1 88 88 LEU CA C 88 52.654 52.654 53.761 -1.107 25085
4692 1 8 . 1 1 88 88 LEU CB C 88 43.094 43.094 46.078 -2.984 25085
4693 1 8 . 1 1 88 88 LEU H H 88 8.824 8.824 8.470 0.354 25085
4694 1 8 . 1 1 89 89 LEU N N 89 124.096 124.096 123.631 0.465 25085
4695 1 8 . 1 1 89 89 LEU HA H 89 4.432 4.432 5.022 -0.590 25085
4696 1 8 . 1 1 89 89 LEU C C 89 176.693 176.693 176.007 0.686 25085
4697 1 8 . 1 1 89 89 LEU CA C 89 55.385 55.385 53.886 1.499 25085
4698 1 8 . 1 1 89 89 LEU CB C 89 43.537 43.537 43.828 -0.291 25085
4699 1 8 . 1 1 89 89 LEU H H 89 8.293 8.293 8.193 0.100 25085
4700 1 8 . 1 1 90 90 GLU N N 90 102.942 102.942 127.888 -24.946 25085
4701 1 8 . 1 1 90 90 GLU HA H 90 3.895 3.895 4.142 -0.247 25085
4702 1 8 . 1 1 90 90 GLU C C 90 175.199 175.199 176.651 -1.452 25085
4703 1 8 . 1 1 90 90 GLU CA C 90 58.586 58.586 58.398 0.188 25085
4704 1 8 . 1 1 90 90 GLU CB C 90 30.831 30.831 30.795 0.036 25085
4705 1 8 . 1 1 90 90 GLU H H 90 9.394 9.394 8.530 0.864 25085
4706 1 8 . 1 1 91 91 ASP N N 91 120.515 120.515 120.041 0.474 25085
4707 1 8 . 1 1 91 91 ASP HA H 91 4.184 4.184 4.321 -0.137 25085
4708 1 8 . 1 1 91 91 ASP C C 91 176.159 176.159 176.000 0.159 25085
4709 1 8 . 1 1 91 91 ASP CA C 91 55.814 55.814 56.639 -0.825 25085
4710 1 8 . 1 1 91 91 ASP CB C 91 39.033 39.033 40.997 -1.964 25085
4711 1 8 . 1 1 91 91 ASP H H 91 9.210 9.210 8.772 0.438 25085
4712 1 8 . 1 1 92 92 GLY N N 92 104.313 104.313 105.310 -0.997 25085
4713 1 8 . 1 1 92 92 GLY C C 92 172.980 172.980 175.203 -2.223 25085
4714 1 8 . 1 1 92 92 GLY CA C 92 46.946 46.946 44.637 2.309 25085
4715 1 8 . 1 1 92 92 GLY H H 92 7.902 7.902 7.430 0.472 25085
4716 1 8 . 1 1 93 93 ILE N N 93 121.445 121.445 122.716 -1.271 25085
4717 1 8 . 1 1 93 93 ILE HA H 93 3.902 3.902 3.737 0.165 25085
4718 1 8 . 1 1 93 93 ILE C C 93 176.528 176.528 176.582 -0.054 25085
4719 1 8 . 1 1 93 93 ILE CA C 93 63.908 63.908 64.283 -0.375 25085
4720 1 8 . 1 1 93 93 ILE CB C 93 38.416 38.416 37.927 0.489 25085
4721 1 8 . 1 1 93 93 ILE H H 93 8.129 8.129 8.069 0.060 25085
4722 1 8 . 1 1 94 94 ASP N N 94 126.304 126.304 120.029 6.275 25085
4723 1 8 . 1 1 94 94 ASP HA H 94 4.436 4.436 4.277 0.159 25085
4724 1 8 . 1 1 94 94 ASP C C 94 180.174 180.174 178.341 1.833 25085
4725 1 8 . 1 1 94 94 ASP CA C 94 58.351 58.351 58.093 0.258 25085
4726 1 8 . 1 1 94 94 ASP CB C 94 39.223 39.223 40.602 -1.379 25085
4727 1 8 . 1 1 94 94 ASP H H 94 9.161 9.161 8.121 1.040 25085
4728 1 8 . 1 1 95 95 GLY N N 95 110.690 110.690 107.250 3.440 25085
4729 1 8 . 1 1 95 95 GLY C C 95 176.108 176.108 175.649 0.459 25085
4730 1 8 . 1 1 95 95 GLY CA C 95 46.873 46.873 46.609 0.264 25085
4731 1 8 . 1 1 95 95 GLY H H 95 8.080 8.080 8.451 -0.371 25085
4732 1 8 . 1 1 96 96 TRP N N 96 126.965 126.965 124.328 2.637 25085
4733 1 8 . 1 1 96 96 TRP HA H 96 3.795 3.795 4.210 -0.415 25085
4734 1 8 . 1 1 96 96 TRP C C 96 177.058 177.058 177.425 -0.367 25085
4735 1 8 . 1 1 96 96 TRP CA C 96 61.633 61.633 59.968 1.665 25085
4736 1 8 . 1 1 96 96 TRP CB C 96 29.512 29.512 29.367 0.144 25085
4737 1 8 . 1 1 96 96 TRP H H 96 8.007 8.007 7.610 0.397 25085
4738 1 8 . 1 1 97 97 LYS N N 97 116.604 116.604 119.842 -3.238 25085
4739 1 8 . 1 1 97 97 LYS HA H 97 4.090 4.090 4.080 0.010 25085
4740 1 8 . 1 1 97 97 LYS C C 97 182.010 182.010 179.752 2.258 25085
4741 1 8 . 1 1 97 97 LYS CA C 97 59.776 59.776 59.549 0.227 25085
4742 1 8 . 1 1 97 97 LYS CB C 97 32.208 32.208 32.608 -0.400 25085
4743 1 8 . 1 1 97 97 LYS H H 97 8.696 8.696 8.364 0.332 25085
4744 1 8 . 1 1 98 98 ARG N N 98 122.491 122.491 119.003 3.488 25085
4745 1 8 . 1 1 98 98 ARG HA H 98 4.050 4.050 4.144 -0.094 25085
4746 1 8 . 1 1 98 98 ARG C C 98 177.666 177.666 177.942 -0.276 25085
4747 1 8 . 1 1 98 98 ARG CA C 98 59.509 59.509 58.134 1.375 25085
4748 1 8 . 1 1 98 98 ARG CB C 98 30.471 30.471 29.768 0.703 25085
4749 1 8 . 1 1 98 98 ARG H H 98 8.280 8.280 7.622 0.658 25085
4750 1 8 . 1 1 99 99 ALA N N 99 119.546 119.546 120.079 -0.533 25085
4751 1 8 . 1 1 99 99 ALA HA H 99 4.276 4.276 4.097 0.179 25085
4752 1 8 . 1 1 99 99 ALA C C 99 176.800 176.800 177.875 -1.075 25085
4753 1 8 . 1 1 99 99 ALA CA C 99 52.254 52.254 52.936 -0.682 25085
4754 1 8 . 1 1 99 99 ALA CB C 99 18.270 18.270 18.353 -0.083 25085
4755 1 8 . 1 1 99 99 ALA H H 99 7.519 7.519 8.181 -0.662 25085
4756 1 8 . 1 1 100 100 GLY N N 100 106.339 106.339 105.533 0.806 25085
4757 1 8 . 1 1 100 100 GLY C C 100 174.232 174.232 174.104 0.128 25085
4758 1 8 . 1 1 100 100 GLY CA C 100 45.050 45.050 44.797 0.253 25085
4759 1 8 . 1 1 100 100 GLY H H 100 7.926 7.926 7.515 0.411 25085
4760 1 8 . 1 1 101 101 LEU N N 101 122.181 122.181 120.114 2.067 25085
4761 1 8 . 1 1 101 101 LEU HA H 101 4.286 4.286 4.562 -0.276 25085
4762 1 8 . 1 1 101 101 LEU CA C 101 53.183 53.183 50.910 2.273 25085
4763 1 8 . 1 1 101 101 LEU CB C 101 37.320 37.320 42.834 -5.514 25085
4764 1 8 . 1 1 101 101 LEU H H 101 6.976 6.976 7.261 -0.285 25085
4765 1 8 . 1 1 102 102 PRO HA H 102 4.476 4.476 4.626 -0.150 25085
4766 1 8 . 1 1 102 102 PRO C C 102 177.424 177.424 176.239 1.185 25085
4767 1 8 . 1 1 102 102 PRO CA C 102 64.014 64.014 62.816 1.198 25085
4768 1 8 . 1 1 102 102 PRO CB C 102 33.200 33.200 31.914 1.286 25085
4769 1 8 . 1 1 103 103 VAL N N 103 110.512 110.512 116.891 -6.379 25085
4770 1 8 . 1 1 103 103 VAL HA H 103 4.643 4.643 4.317 0.326 25085
4771 1 8 . 1 1 103 103 VAL C C 103 174.297 174.297 174.797 -0.500 25085
4772 1 8 . 1 1 103 103 VAL CA C 103 59.693 59.693 59.328 0.365 25085
4773 1 8 . 1 1 103 103 VAL CB C 103 35.980 35.980 33.708 2.272 25085
4774 1 8 . 1 1 103 103 VAL H H 103 8.073 8.073 7.960 0.113 25085
4775 1 8 . 1 1 104 104 ALA N N 104 125.898 125.898 124.038 1.860 25085
4776 1 8 . 1 1 104 104 ALA HA H 104 4.550 4.550 4.660 -0.110 25085
4777 1 8 . 1 1 104 104 ALA C C 104 176.190 176.190 175.313 0.877 25085
4778 1 8 . 1 1 104 104 ALA CA C 104 50.699 50.699 50.782 -0.083 25085
4779 1 8 . 1 1 104 104 ALA CB C 104 19.534 19.534 21.049 -1.515 25085
4780 1 8 . 1 1 104 104 ALA H H 104 8.996 8.996 7.704 1.292 25085
4781 1 8 . 1 1 105 105 VAL N N 105 119.534 119.534 123.026 -3.492 25085
4782 1 8 . 1 1 105 105 VAL HA H 105 4.615 4.615 4.213 0.402 25085
4783 1 8 . 1 1 105 105 VAL C C 105 175.576 175.576 175.502 0.074 25085
4784 1 8 . 1 1 105 105 VAL CA C 105 60.234 60.234 61.479 -1.245 25085
4785 1 8 . 1 1 105 105 VAL CB C 105 34.683 34.683 32.994 1.689 25085
4786 1 8 . 1 1 105 105 VAL H H 105 8.276 8.276 8.385 -0.109 25085
4787 1 8 . 1 1 106 106 ASN N N 106 123.346 123.346 127.673 -4.327 25085
4788 1 8 . 1 1 106 106 ASN HA H 106 4.748 4.748 4.674 0.074 25085
4789 1 8 . 1 1 106 106 ASN C C 106 173.877 173.877 173.838 0.039 25085
4790 1 8 . 1 1 106 106 ASN CA C 106 53.465 53.465 53.339 0.126 25085
4791 1 8 . 1 1 106 106 ASN CB C 106 39.424 39.424 38.294 1.130 25085
4792 1 8 . 1 1 106 106 ASN H H 106 8.190 8.190 8.642 -0.452 25085
4793 1 9 . 1 1 2 2 ALA N N 2 125.104 125.104 123.827 1.277 25085
4794 1 9 . 1 1 2 2 ALA HA H 2 4.287 4.287 4.356 -0.069 25085
4795 1 9 . 1 1 2 2 ALA C C 2 176.800 176.800 176.654 0.146 25085
4796 1 9 . 1 1 2 2 ALA CA C 2 52.429 52.429 52.218 0.211 25085
4797 1 9 . 1 1 2 2 ALA CB C 2 19.407 19.407 18.843 0.564 25085
4798 1 9 . 1 1 2 2 ALA H H 2 8.344 8.344 8.202 0.142 25085
4799 1 9 . 1 1 3 3 LEU N N 3 120.515 120.515 115.008 5.507 25085
4800 1 9 . 1 1 3 3 LEU HA H 3 4.452 4.452 5.319 -0.867 25085
4801 1 9 . 1 1 3 3 LEU C C 3 176.497 176.497 176.339 0.158 25085
4802 1 9 . 1 1 3 3 LEU CA C 3 54.698 54.698 53.719 0.979 25085
4803 1 9 . 1 1 3 3 LEU CB C 3 43.203 43.203 43.223 -0.020 25085
4804 1 9 . 1 1 3 3 LEU H H 3 8.070 8.070 7.288 0.782 25085
4805 1 9 . 1 1 4 4 THR N N 4 117.803 117.803 117.299 0.504 25085
4806 1 9 . 1 1 4 4 THR HA H 4 4.480 4.480 4.673 -0.193 25085
4807 1 9 . 1 1 4 4 THR C C 4 173.872 173.872 174.329 -0.457 25085
4808 1 9 . 1 1 4 4 THR CA C 4 62.247 62.247 60.969 1.278 25085
4809 1 9 . 1 1 4 4 THR CB C 4 70.533 70.533 72.245 -1.712 25085
4810 1 9 . 1 1 4 4 THR H H 4 7.954 7.954 8.371 -0.417 25085
4811 1 9 . 1 1 5 5 THR N N 5 121.501 121.501 116.026 5.475 25085
4812 1 9 . 1 1 5 5 THR HA H 5 5.289 5.289 4.967 0.322 25085
4813 1 9 . 1 1 5 5 THR C C 5 174.162 174.162 174.003 0.159 25085
4814 1 9 . 1 1 5 5 THR CA C 5 62.102 62.102 62.356 -0.254 25085
4815 1 9 . 1 1 5 5 THR CB C 5 69.457 69.457 69.883 -0.426 25085
4816 1 9 . 1 1 5 5 THR H H 5 8.640 8.640 8.438 0.202 25085
4817 1 9 . 1 1 6 6 ILE N N 6 122.023 122.023 123.646 -1.623 25085
4818 1 9 . 1 1 6 6 ILE HA H 6 4.988 4.988 4.581 0.407 25085
4819 1 9 . 1 1 6 6 ILE C C 6 173.377 173.377 174.136 -0.759 25085
4820 1 9 . 1 1 6 6 ILE CA C 6 58.611 58.611 59.468 -0.857 25085
4821 1 9 . 1 1 6 6 ILE CB C 6 42.821 42.821 43.124 -0.304 25085
4822 1 9 . 1 1 6 6 ILE H H 6 8.977 8.977 9.211 -0.234 25085
4823 1 9 . 1 1 7 7 SER N N 7 122.659 122.659 118.811 3.848 25085
4824 1 9 . 1 1 7 7 SER HA H 7 4.768 4.768 5.126 -0.358 25085
4825 1 9 . 1 1 7 7 SER CA C 7 56.790 56.790 55.554 1.236 25085
4826 1 9 . 1 1 7 7 SER CB C 7 63.235 63.235 63.468 -0.233 25085
4827 1 9 . 1 1 7 7 SER H H 7 9.242 9.242 8.673 0.569 25085
4828 1 9 . 1 1 8 8 PRO HA H 8 4.207 4.207 4.321 -0.114 25085
4829 1 9 . 1 1 8 8 PRO C C 8 176.787 176.787 178.058 -1.271 25085
4830 1 9 . 1 1 8 8 PRO CA C 8 66.443 66.443 65.628 0.815 25085
4831 1 9 . 1 1 8 8 PRO CB C 8 32.724 32.724 31.913 0.811 25085
4832 1 9 . 1 1 9 9 HIS N N 9 113.700 113.700 114.589 -0.889 25085
4833 1 9 . 1 1 9 9 HIS HA H 9 3.990 3.990 4.402 -0.412 25085
4834 1 9 . 1 1 9 9 HIS C C 9 178.123 178.123 177.457 0.666 25085
4835 1 9 . 1 1 9 9 HIS CA C 9 60.827 60.827 59.576 1.251 25085
4836 1 9 . 1 1 9 9 HIS CB C 9 29.552 29.552 30.105 -0.553 25085
4837 1 9 . 1 1 9 9 HIS H H 9 8.172 8.172 8.155 0.017 25085
4838 1 9 . 1 1 10 10 ASP N N 10 120.665 120.665 120.483 0.182 25085
4839 1 9 . 1 1 10 10 ASP HA H 10 4.369 4.369 4.465 -0.096 25085
4840 1 9 . 1 1 10 10 ASP C C 10 179.100 179.100 178.018 1.082 25085
4841 1 9 . 1 1 10 10 ASP CA C 10 57.071 57.071 57.574 -0.503 25085
4842 1 9 . 1 1 10 10 ASP CB C 10 39.529 39.529 40.960 -1.431 25085
4843 1 9 . 1 1 10 10 ASP H H 10 7.706 7.706 8.866 -1.160 25085
4844 1 9 . 1 1 11 11 ALA N N 11 123.686 123.686 121.865 1.821 25085
4845 1 9 . 1 1 11 11 ALA HA H 11 3.782 3.782 3.945 -0.163 25085
4846 1 9 . 1 1 11 11 ALA C C 11 178.260 178.260 179.606 -1.346 25085
4847 1 9 . 1 1 11 11 ALA CA C 11 55.142 55.142 55.101 0.041 25085
4848 1 9 . 1 1 11 11 ALA CB C 11 18.293 18.293 18.223 0.070 25085
4849 1 9 . 1 1 11 11 ALA H H 11 8.896 8.896 7.698 1.198 25085
4850 1 9 . 1 1 12 12 GLN N N 12 117.521 117.521 118.056 -0.535 25085
4851 1 9 . 1 1 12 12 GLN HA H 12 4.000 4.000 4.201 -0.201 25085
4852 1 9 . 1 1 12 12 GLN C C 12 178.499 178.499 178.222 0.277 25085
4853 1 9 . 1 1 12 12 GLN CA C 12 60.102 60.102 59.346 0.756 25085
4854 1 9 . 1 1 12 12 GLN CB C 12 28.743 28.743 28.350 0.393 25085
4855 1 9 . 1 1 12 12 GLN H H 12 8.431 8.431 8.080 0.351 25085
4856 1 9 . 1 1 13 13 GLU N N 13 118.578 118.578 118.929 -0.351 25085
4857 1 9 . 1 1 13 13 GLU HA H 13 4.059 4.059 4.066 -0.007 25085
4858 1 9 . 1 1 13 13 GLU C C 13 178.352 178.352 179.477 -1.125 25085
4859 1 9 . 1 1 13 13 GLU CA C 13 59.079 59.079 59.117 -0.038 25085
4860 1 9 . 1 1 13 13 GLU CB C 13 29.213 29.213 29.256 -0.043 25085
4861 1 9 . 1 1 13 13 GLU H H 13 7.234 7.234 7.729 -0.495 25085
4862 1 9 . 1 1 14 14 LEU N N 14 119.848 119.848 120.219 -0.371 25085
4863 1 9 . 1 1 14 14 LEU HA H 14 3.891 3.891 4.095 -0.204 25085
4864 1 9 . 1 1 14 14 LEU C C 14 180.773 180.773 178.639 2.134 25085
4865 1 9 . 1 1 14 14 LEU CA C 14 57.958 57.958 57.541 0.417 25085
4866 1 9 . 1 1 14 14 LEU CB C 14 41.715 41.715 41.924 -0.209 25085
4867 1 9 . 1 1 14 14 LEU H H 14 7.582 7.582 8.231 -0.649 25085
4868 1 9 . 1 1 15 15 ILE N N 15 122.392 122.392 117.726 4.666 25085
4869 1 9 . 1 1 15 15 ILE HA H 15 3.924 3.924 3.679 0.245 25085
4870 1 9 . 1 1 15 15 ILE C C 15 180.109 180.109 177.421 2.688 25085
4871 1 9 . 1 1 15 15 ILE CA C 15 64.663 64.663 64.557 0.106 25085
4872 1 9 . 1 1 15 15 ILE CB C 15 38.900 38.900 37.870 1.030 25085
4873 1 9 . 1 1 15 15 ILE H H 15 8.772 8.772 8.055 0.717 25085
4874 1 9 . 1 1 16 16 ALA N N 16 123.856 123.856 119.674 4.182 25085
4875 1 9 . 1 1 16 16 ALA HA H 16 4.183 4.183 4.242 -0.059 25085
4876 1 9 . 1 1 16 16 ALA C C 16 179.100 179.100 178.816 0.284 25085
4877 1 9 . 1 1 16 16 ALA CA C 16 54.806 54.806 53.946 0.860 25085
4878 1 9 . 1 1 16 16 ALA CB C 16 17.646 17.646 18.855 -1.209 25085
4879 1 9 . 1 1 16 16 ALA H H 16 7.808 7.808 7.323 0.485 25085
4880 1 9 . 1 1 17 17 ARG N N 17 115.329 115.329 117.827 -2.498 25085
4881 1 9 . 1 1 17 17 ARG HA H 17 4.404 4.404 4.361 0.043 25085
4882 1 9 . 1 1 17 17 ARG C C 17 176.446 176.446 177.693 -1.247 25085
4883 1 9 . 1 1 17 17 ARG CA C 17 56.015 56.015 56.961 -0.946 25085
4884 1 9 . 1 1 17 17 ARG CB C 17 30.676 30.676 31.350 -0.674 25085
4885 1 9 . 1 1 17 17 ARG H H 17 7.280 7.280 8.435 -1.155 25085
4886 1 9 . 1 1 18 18 GLY N N 18 107.395 107.395 104.316 3.079 25085
4887 1 9 . 1 1 18 18 GLY C C 18 174.072 174.072 173.532 0.540 25085
4888 1 9 . 1 1 18 18 GLY CA C 18 45.218 45.218 44.788 0.430 25085
4889 1 9 . 1 1 18 18 GLY H H 18 7.795 7.795 8.398 -0.603 25085
4890 1 9 . 1 1 19 19 ALA N N 19 123.197 123.197 124.036 -0.839 25085
4891 1 9 . 1 1 19 19 ALA HA H 19 4.217 4.217 4.095 0.122 25085
4892 1 9 . 1 1 19 19 ALA C C 19 176.261 176.261 177.405 -1.144 25085
4893 1 9 . 1 1 19 19 ALA CA C 19 52.674 52.674 53.275 -0.601 25085
4894 1 9 . 1 1 19 19 ALA CB C 19 19.411 19.411 19.254 0.157 25085
4895 1 9 . 1 1 19 19 ALA H H 19 7.980 7.980 7.582 0.398 25085
4896 1 9 . 1 1 20 20 LYS N N 20 118.629 118.629 122.606 -3.977 25085
4897 1 9 . 1 1 20 20 LYS HA H 20 4.308 4.308 4.410 -0.102 25085
4898 1 9 . 1 1 20 20 LYS C C 20 173.981 173.981 175.144 -1.163 25085
4899 1 9 . 1 1 20 20 LYS CA C 20 53.820 53.820 55.269 -1.449 25085
4900 1 9 . 1 1 20 20 LYS CB C 20 33.571 33.571 32.891 0.680 25085
4901 1 9 . 1 1 20 20 LYS H H 20 7.589 7.589 8.017 -0.428 25085
4902 1 9 . 1 1 21 21 LEU N N 21 126.686 126.686 126.735 -0.049 25085
4903 1 9 . 1 1 21 21 LEU HA H 21 5.154 5.154 4.557 0.597 25085
4904 1 9 . 1 1 21 21 LEU C C 21 174.076 174.076 175.848 -1.772 25085
4905 1 9 . 1 1 21 21 LEU CA C 21 53.262 53.262 55.164 -1.902 25085
4906 1 9 . 1 1 21 21 LEU CB C 21 44.350 44.350 42.484 1.866 25085
4907 1 9 . 1 1 21 21 LEU H H 21 8.812 8.812 8.622 0.190 25085
4908 1 9 . 1 1 22 22 ILE N N 22 127.566 127.566 122.719 4.847 25085
4909 1 9 . 1 1 22 22 ILE HA H 22 4.678 4.678 4.969 -0.291 25085
4910 1 9 . 1 1 22 22 ILE C C 22 173.136 173.136 174.035 -0.899 25085
4911 1 9 . 1 1 22 22 ILE CA C 22 60.160 60.160 59.301 0.859 25085
4912 1 9 . 1 1 22 22 ILE CB C 22 39.842 39.842 41.015 -1.173 25085
4913 1 9 . 1 1 22 22 ILE H H 22 9.416 9.416 8.811 0.605 25085
4914 1 9 . 1 1 23 23 ASP N N 23 129.217 129.217 124.316 4.901 25085
4915 1 9 . 1 1 23 23 ASP HA H 23 3.806 3.806 5.146 -1.340 25085
4916 1 9 . 1 1 23 23 ASP C C 23 176.042 176.042 175.299 0.743 25085
4917 1 9 . 1 1 23 23 ASP CA C 23 52.005 52.005 51.874 0.131 25085
4918 1 9 . 1 1 23 23 ASP CB C 23 42.984 42.984 43.728 -0.744 25085
4919 1 9 . 1 1 23 23 ASP H H 23 8.619 8.619 8.644 -0.025 25085
4920 1 9 . 1 1 24 24 ILE N N 24 115.522 115.522 119.488 -3.966 25085
4921 1 9 . 1 1 24 24 ILE HA H 24 5.255 5.255 4.718 0.537 25085
4922 1 9 . 1 1 24 24 ILE C C 24 178.920 178.920 173.916 5.004 25085
4923 1 9 . 1 1 24 24 ILE CA C 24 60.188 60.188 60.085 0.103 25085
4924 1 9 . 1 1 24 24 ILE CB C 24 38.015 38.015 38.926 -0.911 25085
4925 1 9 . 1 1 24 24 ILE H H 24 7.877 7.877 7.746 0.131 25085
4926 1 9 . 1 1 25 25 ARG N N 25 124.317 124.317 122.224 2.093 25085
4927 1 9 . 1 1 25 25 ARG HA H 25 4.170 4.170 4.553 -0.383 25085
4928 1 9 . 1 1 25 25 ARG C C 25 171.756 171.756 174.491 -2.735 25085
4929 1 9 . 1 1 25 25 ARG CA C 25 56.547 56.547 54.721 1.826 25085
4930 1 9 . 1 1 25 25 ARG CB C 25 30.897 30.897 31.410 -0.513 25085
4931 1 9 . 1 1 25 25 ARG H H 25 8.235 8.235 7.779 0.456 25085
4932 1 9 . 1 1 26 26 ASP N N 26 112.059 112.059 120.626 -8.567 25085
4933 1 9 . 1 1 26 26 ASP HA H 26 4.609 4.609 4.956 -0.347 25085
4934 1 9 . 1 1 26 26 ASP C C 26 177.934 177.934 176.727 1.207 25085
4935 1 9 . 1 1 26 26 ASP CA C 26 54.398 54.398 53.300 1.099 25085
4936 1 9 . 1 1 26 26 ASP CB C 26 42.029 42.029 41.451 0.578 25085
4937 1 9 . 1 1 26 26 ASP H H 26 7.730 7.730 8.528 -0.798 25085
4938 1 9 . 1 1 27 27 ALA N N 27 121.435 121.435 129.158 -7.723 25085
4939 1 9 . 1 1 27 27 ALA HA H 27 3.959 3.959 3.897 0.062 25085
4940 1 9 . 1 1 27 27 ALA C C 27 179.388 179.388 178.681 0.707 25085
4941 1 9 . 1 1 27 27 ALA CA C 27 55.829 55.829 56.010 -0.181 25085
4942 1 9 . 1 1 27 27 ALA CB C 27 18.572 18.572 18.280 0.292 25085
4943 1 9 . 1 1 27 27 ALA H H 27 8.797 8.797 8.902 -0.105 25085
4944 1 9 . 1 1 28 28 ASP N N 28 114.759 114.759 117.959 -3.200 25085
4945 1 9 . 1 1 28 28 ASP HA H 28 4.314 4.314 4.340 -0.026 25085
4946 1 9 . 1 1 28 28 ASP C C 28 178.738 178.738 179.186 -0.448 25085
4947 1 9 . 1 1 28 28 ASP CA C 28 56.997 56.997 57.574 -0.577 25085
4948 1 9 . 1 1 28 28 ASP CB C 28 39.811 39.811 40.168 -0.357 25085
4949 1 9 . 1 1 28 28 ASP H H 28 8.755 8.755 8.787 -0.032 25085
4950 1 9 . 1 1 29 29 GLU N N 29 119.562 119.562 118.613 0.949 25085
4951 1 9 . 1 1 29 29 GLU HA H 29 4.116 4.116 4.280 -0.164 25085
4952 1 9 . 1 1 29 29 GLU C C 29 178.473 178.473 179.008 -0.535 25085
4953 1 9 . 1 1 29 29 GLU CA C 29 58.928 58.928 58.704 0.224 25085
4954 1 9 . 1 1 29 29 GLU CB C 29 29.395 29.395 30.241 -0.846 25085
4955 1 9 . 1 1 29 29 GLU H H 29 7.446 7.446 8.923 -1.477 25085
4956 1 9 . 1 1 30 30 TYR N N 30 120.494 120.494 120.886 -0.392 25085
4957 1 9 . 1 1 30 30 TYR HA H 30 4.092 4.092 4.623 -0.531 25085
4958 1 9 . 1 1 30 30 TYR C C 30 176.988 176.988 178.613 -1.625 25085
4959 1 9 . 1 1 30 30 TYR CA C 30 60.931 60.931 60.779 0.152 25085
4960 1 9 . 1 1 30 30 TYR CB C 30 39.534 39.534 38.678 0.855 25085
4961 1 9 . 1 1 30 30 TYR H H 30 7.545 7.545 7.451 0.094 25085
4962 1 9 . 1 1 31 31 LEU N N 31 118.227 118.227 120.454 -2.227 25085
4963 1 9 . 1 1 31 31 LEU HA H 31 3.916 3.916 3.962 -0.046 25085
4964 1 9 . 1 1 31 31 LEU C C 31 178.824 178.824 177.914 0.910 25085
4965 1 9 . 1 1 31 31 LEU CA C 31 57.444 57.444 58.812 -1.368 25085
4966 1 9 . 1 1 31 31 LEU CB C 31 41.941 41.941 42.095 -0.154 25085
4967 1 9 . 1 1 31 31 LEU H H 31 8.235 8.235 9.044 -0.809 25085
4968 1 9 . 1 1 32 32 ARG N N 32 117.334 117.334 114.215 3.119 25085
4969 1 9 . 1 1 32 32 ARG HA H 32 4.112 4.112 4.078 0.034 25085
4970 1 9 . 1 1 32 32 ARG C C 32 177.008 177.008 175.919 1.089 25085
4971 1 9 . 1 1 32 32 ARG CA C 32 59.366 59.366 58.324 1.042 25085
4972 1 9 . 1 1 32 32 ARG CB C 32 30.938 30.938 30.466 0.472 25085
4973 1 9 . 1 1 32 32 ARG H H 32 7.133 7.133 7.665 -0.532 25085
4974 1 9 . 1 1 33 33 GLU N N 33 117.282 117.282 118.826 -1.544 25085
4975 1 9 . 1 1 33 33 GLU HA H 33 4.893 4.893 4.767 0.126 25085
4976 1 9 . 1 1 33 33 GLU C C 33 173.503 173.503 173.703 -0.200 25085
4977 1 9 . 1 1 33 33 GLU CA C 33 56.291 56.291 55.841 0.450 25085
4978 1 9 . 1 1 33 33 GLU CB C 33 32.248 32.248 32.090 0.158 25085
4979 1 9 . 1 1 33 33 GLU H H 33 7.521 7.521 7.371 0.150 25085
4980 1 9 . 1 1 34 34 HIS N N 34 117.828 117.828 119.242 -1.414 25085
4981 1 9 . 1 1 34 34 HIS HA H 34 4.627 4.627 4.195 0.432 25085
4982 1 9 . 1 1 34 34 HIS C C 34 171.950 171.950 173.045 -1.095 25085
4983 1 9 . 1 1 34 34 HIS CA C 34 54.304 54.304 53.951 0.353 25085
4984 1 9 . 1 1 34 34 HIS CB C 34 30.712 30.712 32.302 -1.590 25085
4985 1 9 . 1 1 34 34 HIS H H 34 8.354 8.354 8.814 -0.460 25085
4986 1 9 . 1 1 35 35 ILE N N 35 126.965 126.965 117.124 9.841 25085
4987 1 9 . 1 1 35 35 ILE HA H 35 3.973 3.973 4.581 -0.608 25085
4988 1 9 . 1 1 35 35 ILE CA C 35 60.500 60.500 57.842 2.658 25085
4989 1 9 . 1 1 35 35 ILE CB C 35 38.822 38.822 38.488 0.334 25085
4990 1 9 . 1 1 35 35 ILE H H 35 10.032 10.032 7.593 2.439 25085
4991 1 9 . 1 1 36 36 PRO HA H 36 4.033 4.033 4.419 -0.386 25085
4992 1 9 . 1 1 36 36 PRO C C 36 177.308 177.308 176.085 1.223 25085
4993 1 9 . 1 1 36 36 PRO CA C 36 66.191 66.191 64.128 2.063 25085
4994 1 9 . 1 1 36 36 PRO CB C 36 31.701 31.701 30.869 0.832 25085
4995 1 9 . 1 1 37 37 GLU N N 37 113.735 113.735 114.336 -0.601 25085
4996 1 9 . 1 1 37 37 GLU HA H 37 4.083 4.083 4.482 -0.399 25085
4997 1 9 . 1 1 37 37 GLU C C 37 176.274 176.274 175.394 0.880 25085
4998 1 9 . 1 1 37 37 GLU CA C 37 58.285 58.285 55.356 2.929 25085
4999 1 9 . 1 1 37 37 GLU CB C 37 28.895 28.895 30.337 -1.442 25085
5000 1 9 . 1 1 37 37 GLU H H 37 8.625 8.625 8.526 0.099 25085
5001 1 9 . 1 1 38 38 ALA N N 38 122.325 122.325 123.217 -0.892 25085
5002 1 9 . 1 1 38 38 ALA HA H 38 4.484 4.484 4.620 -0.136 25085
5003 1 9 . 1 1 38 38 ALA C C 38 178.043 178.043 175.439 2.604 25085
5004 1 9 . 1 1 38 38 ALA CA C 38 52.385 52.385 50.753 1.632 25085
5005 1 9 . 1 1 38 38 ALA CB C 38 21.151 21.151 22.009 -0.858 25085
5006 1 9 . 1 1 38 38 ALA H H 38 8.160 8.160 8.096 0.064 25085
5007 1 9 . 1 1 39 39 ASP N N 39 123.726 123.726 121.744 1.982 25085
5008 1 9 . 1 1 39 39 ASP HA H 39 4.856 4.856 4.755 0.101 25085
5009 1 9 . 1 1 39 39 ASP C C 39 174.077 174.077 175.213 -1.136 25085
5010 1 9 . 1 1 39 39 ASP CA C 39 53.498 53.498 53.529 -0.031 25085
5011 1 9 . 1 1 39 39 ASP CB C 39 45.176 45.176 41.810 3.365 25085
5012 1 9 . 1 1 39 39 ASP H H 39 9.095 9.095 9.028 0.067 25085
5013 1 9 . 1 1 40 40 LEU N N 40 123.111 123.111 125.112 -2.001 25085
5014 1 9 . 1 1 40 40 LEU HA H 40 4.339 4.339 4.092 0.247 25085
5015 1 9 . 1 1 40 40 LEU C C 40 176.159 176.159 175.450 0.709 25085
5016 1 9 . 1 1 40 40 LEU CA C 40 54.766 54.766 54.708 0.058 25085
5017 1 9 . 1 1 40 40 LEU CB C 40 41.988 41.988 42.559 -0.570 25085
5018 1 9 . 1 1 40 40 LEU H H 40 8.199 8.199 8.600 -0.401 25085
5019 1 9 . 1 1 41 41 ALA N N 41 130.678 130.678 130.151 0.527 25085
5020 1 9 . 1 1 41 41 ALA HA H 41 4.430 4.430 4.659 -0.229 25085
5021 1 9 . 1 1 41 41 ALA CA C 41 49.844 49.844 49.691 0.153 25085
5022 1 9 . 1 1 41 41 ALA CB C 41 18.765 18.765 19.594 -0.829 25085
5023 1 9 . 1 1 41 41 ALA H H 41 8.705 8.705 8.613 0.092 25085
5024 1 9 . 1 1 42 42 PRO HA H 42 4.133 4.133 4.417 -0.284 25085
5025 1 9 . 1 1 42 42 PRO C C 42 178.946 178.946 177.658 1.288 25085
5026 1 9 . 1 1 42 42 PRO CA C 42 62.119 62.119 62.956 -0.837 25085
5027 1 9 . 1 1 42 42 PRO CB C 42 33.383 33.383 32.084 1.299 25085
5028 1 9 . 1 1 43 43 LEU N N 43 124.604 124.604 122.862 1.742 25085
5029 1 9 . 1 1 43 43 LEU HA H 43 3.881 3.881 4.189 -0.308 25085
5030 1 9 . 1 1 43 43 LEU C C 43 176.869 176.869 178.209 -1.340 25085
5031 1 9 . 1 1 43 43 LEU CA C 43 58.639 58.639 57.777 0.862 25085
5032 1 9 . 1 1 43 43 LEU CB C 43 41.848 41.848 41.969 -0.121 25085
5033 1 9 . 1 1 43 43 LEU H H 43 8.330 8.330 8.186 0.144 25085
5034 1 9 . 1 1 44 44 SER N N 44 110.167 110.167 115.020 -4.853 25085
5035 1 9 . 1 1 44 44 SER HA H 44 4.147 4.147 4.215 -0.068 25085
5036 1 9 . 1 1 44 44 SER C C 44 177.107 177.107 176.264 0.843 25085
5037 1 9 . 1 1 44 44 SER CA C 44 61.043 61.043 61.176 -0.133 25085
5038 1 9 . 1 1 44 44 SER CB C 44 61.765 61.765 62.967 -1.202 25085
5039 1 9 . 1 1 44 44 SER H H 44 8.553 8.553 8.400 0.153 25085
5040 1 9 . 1 1 45 45 VAL N N 45 123.549 123.549 118.169 5.380 25085
5041 1 9 . 1 1 45 45 VAL HA H 45 3.825 3.825 4.020 -0.195 25085
5042 1 9 . 1 1 45 45 VAL C C 45 178.328 178.328 177.165 1.163 25085
5043 1 9 . 1 1 45 45 VAL CA C 45 65.576 65.576 64.558 1.017 25085
5044 1 9 . 1 1 45 45 VAL CB C 45 31.889 31.889 31.911 -0.022 25085
5045 1 9 . 1 1 45 45 VAL H H 45 7.181 7.181 7.482 -0.301 25085
5046 1 9 . 1 1 46 46 LEU N N 46 120.336 120.336 121.989 -1.653 25085
5047 1 9 . 1 1 46 46 LEU HA H 46 3.826 3.826 3.881 -0.055 25085
5048 1 9 . 1 1 46 46 LEU C C 46 179.996 179.996 178.425 1.571 25085
5049 1 9 . 1 1 46 46 LEU CA C 46 57.602 57.602 58.458 -0.856 25085
5050 1 9 . 1 1 46 46 LEU CB C 46 41.691 41.691 41.700 -0.009 25085
5051 1 9 . 1 1 46 46 LEU H H 46 8.040 8.040 8.080 -0.040 25085
5052 1 9 . 1 1 47 47 GLU N N 47 115.713 115.713 118.069 -2.356 25085
5053 1 9 . 1 1 47 47 GLU HA H 47 3.820 3.820 3.876 -0.056 25085
5054 1 9 . 1 1 47 47 GLU C C 47 177.029 177.029 178.540 -1.511 25085
5055 1 9 . 1 1 47 47 GLU CA C 47 59.317 59.317 59.098 0.219 25085
5056 1 9 . 1 1 47 47 GLU CB C 47 30.526 30.526 29.410 1.116 25085
5057 1 9 . 1 1 47 47 GLU H H 47 8.567 8.567 7.723 0.844 25085
5058 1 9 . 1 1 48 48 GLN N N 48 116.740 116.740 116.921 -0.181 25085
5059 1 9 . 1 1 48 48 GLN HA H 48 4.281 4.281 4.129 0.152 25085
5060 1 9 . 1 1 48 48 GLN C C 48 177.605 177.605 178.183 -0.578 25085
5061 1 9 . 1 1 48 48 GLN CA C 48 57.827 57.827 57.592 0.235 25085
5062 1 9 . 1 1 48 48 GLN CB C 48 29.985 29.985 29.122 0.863 25085
5063 1 9 . 1 1 48 48 GLN H H 48 7.472 7.472 7.737 -0.265 25085
5064 1 9 . 1 1 49 49 SER N N 49 111.004 111.004 114.994 -3.990 25085
5065 1 9 . 1 1 49 49 SER HA H 49 4.648 4.648 4.240 0.408 25085
5066 1 9 . 1 1 49 49 SER C C 49 174.859 174.859 175.178 -0.319 25085
5067 1 9 . 1 1 49 49 SER CA C 49 58.406 58.406 59.834 -1.428 25085
5068 1 9 . 1 1 49 49 SER CB C 49 64.758 64.758 64.218 0.541 25085
5069 1 9 . 1 1 49 49 SER H H 49 8.657 8.657 8.425 0.232 25085
5070 1 9 . 1 1 50 50 GLY N N 50 110.839 110.839 109.064 1.775 25085
5071 1 9 . 1 1 50 50 GLY C C 50 172.398 172.398 173.469 -1.071 25085
5072 1 9 . 1 1 50 50 GLY CA C 50 44.444 44.444 44.964 -0.520 25085
5073 1 9 . 1 1 50 50 GLY H H 50 7.846 7.846 7.982 -0.136 25085
5074 1 9 . 1 1 51 51 LEU N N 51 121.009 121.009 122.822 -1.813 25085
5075 1 9 . 1 1 51 51 LEU HA H 51 4.244 4.244 4.793 -0.549 25085
5076 1 9 . 1 1 51 51 LEU CA C 51 52.593 52.593 51.258 1.335 25085
5077 1 9 . 1 1 51 51 LEU CB C 51 43.381 43.381 43.218 0.163 25085
5078 1 9 . 1 1 51 51 LEU H H 51 8.647 8.647 7.897 0.750 25085
5079 1 9 . 1 1 52 52 PRO HA H 52 4.349 4.349 4.546 -0.197 25085
5080 1 9 . 1 1 52 52 PRO C C 52 177.247 177.247 177.167 0.080 25085
5081 1 9 . 1 1 52 52 PRO CA C 52 62.980 62.980 62.681 0.299 25085
5082 1 9 . 1 1 52 52 PRO CB C 52 32.423 32.423 30.277 2.146 25085
5083 1 9 . 1 1 53 53 ALA N N 53 126.595 126.595 127.360 -0.765 25085
5084 1 9 . 1 1 53 53 ALA HA H 53 3.870 3.870 3.880 -0.010 25085
5085 1 9 . 1 1 53 53 ALA C C 53 180.484 180.484 179.303 1.181 25085
5086 1 9 . 1 1 53 53 ALA CA C 53 55.829 55.829 54.991 0.838 25085
5087 1 9 . 1 1 53 53 ALA CB C 53 18.248 18.248 18.529 -0.281 25085
5088 1 9 . 1 1 53 53 ALA H H 53 8.643 8.643 8.406 0.237 25085
5089 1 9 . 1 1 54 54 LYS N N 54 113.898 113.898 118.928 -5.030 25085
5090 1 9 . 1 1 54 54 LYS HA H 54 4.167 4.167 4.143 0.024 25085
5091 1 9 . 1 1 54 54 LYS C C 54 176.704 176.704 178.998 -2.294 25085
5092 1 9 . 1 1 54 54 LYS CA C 54 57.893 57.893 58.575 -0.681 25085
5093 1 9 . 1 1 54 54 LYS CB C 54 31.892 31.892 32.188 -0.296 25085
5094 1 9 . 1 1 54 54 LYS H H 54 8.442 8.442 8.163 0.279 25085
5095 1 9 . 1 1 55 55 LEU N N 55 117.932 117.932 118.975 -1.043 25085
5096 1 9 . 1 1 55 55 LEU HA H 55 4.308 4.308 4.243 0.065 25085
5097 1 9 . 1 1 55 55 LEU C C 55 174.589 174.589 177.975 -3.386 25085
5098 1 9 . 1 1 55 55 LEU CA C 55 54.003 54.003 56.974 -2.971 25085
5099 1 9 . 1 1 55 55 LEU CB C 55 41.649 41.649 42.222 -0.573 25085
5100 1 9 . 1 1 55 55 LEU H H 55 7.805 7.805 8.579 -0.774 25085
5101 1 9 . 1 1 56 56 ARG N N 56 116.873 116.873 116.521 0.352 25085
5102 1 9 . 1 1 56 56 ARG HA H 56 4.006 4.006 4.612 -0.606 25085
5103 1 9 . 1 1 56 56 ARG C C 56 175.542 175.542 175.540 0.002 25085
5104 1 9 . 1 1 56 56 ARG CA C 56 57.428 57.428 55.487 1.941 25085
5105 1 9 . 1 1 56 56 ARG CB C 56 29.651 29.651 30.992 -1.341 25085
5106 1 9 . 1 1 56 56 ARG H H 56 6.971 6.971 8.096 -1.125 25085
5107 1 9 . 1 1 57 57 HIS N N 57 122.622 122.622 116.902 5.720 25085
5108 1 9 . 1 1 57 57 HIS HA H 57 4.596 4.596 4.612 -0.016 25085
5109 1 9 . 1 1 57 57 HIS C C 57 173.855 173.855 173.168 0.687 25085
5110 1 9 . 1 1 57 57 HIS CA C 57 55.780 55.780 56.170 -0.390 25085
5111 1 9 . 1 1 57 57 HIS CB C 57 33.878 33.878 31.560 2.318 25085
5112 1 9 . 1 1 57 57 HIS H H 57 7.281 7.281 7.486 -0.205 25085
5113 1 9 . 1 1 58 58 GLU N N 58 120.479 120.479 118.267 2.212 25085
5114 1 9 . 1 1 58 58 GLU HA H 58 4.052 4.052 4.399 -0.347 25085
5115 1 9 . 1 1 58 58 GLU C C 58 176.762 176.762 175.111 1.651 25085
5116 1 9 . 1 1 58 58 GLU CA C 58 59.634 59.634 56.411 3.223 25085
5117 1 9 . 1 1 58 58 GLU CB C 58 29.931 29.931 31.422 -1.490 25085
5118 1 9 . 1 1 58 58 GLU H H 58 7.626 7.626 8.119 -0.493 25085
5119 1 9 . 1 1 59 59 GLN N N 59 118.110 118.110 118.674 -0.564 25085
5120 1 9 . 1 1 59 59 GLN HA H 59 5.479 5.479 5.346 0.133 25085
5121 1 9 . 1 1 59 59 GLN C C 59 174.322 174.322 174.976 -0.654 25085
5122 1 9 . 1 1 59 59 GLN CA C 59 55.486 55.486 54.790 0.696 25085
5123 1 9 . 1 1 59 59 GLN CB C 59 33.151 33.151 31.554 1.597 25085
5124 1 9 . 1 1 59 59 GLN H H 59 8.560 8.560 7.964 0.596 25085
5125 1 9 . 1 1 60 60 ILE N N 60 122.789 122.789 122.302 0.487 25085
5126 1 9 . 1 1 60 60 ILE HA H 60 4.531 4.531 4.684 -0.153 25085
5127 1 9 . 1 1 60 60 ILE C C 60 173.352 173.352 174.336 -0.984 25085
5128 1 9 . 1 1 60 60 ILE CA C 60 59.794 59.794 59.953 -0.159 25085
5129 1 9 . 1 1 60 60 ILE CB C 60 43.188 43.188 41.377 1.812 25085
5130 1 9 . 1 1 60 60 ILE H H 60 8.735 8.735 8.038 0.697 25085
5131 1 9 . 1 1 61 61 ILE N N 61 125.871 125.871 122.562 3.309 25085
5132 1 9 . 1 1 61 61 ILE HA H 61 5.002 5.002 4.556 0.446 25085
5133 1 9 . 1 1 61 61 ILE C C 61 175.195 175.195 174.402 0.793 25085
5134 1 9 . 1 1 61 61 ILE CA C 61 58.419 58.419 59.768 -1.349 25085
5135 1 9 . 1 1 61 61 ILE CB C 61 40.270 40.270 40.394 -0.124 25085
5136 1 9 . 1 1 61 61 ILE H H 61 9.057 9.057 8.738 0.319 25085
5137 1 9 . 1 1 62 62 PHE N N 62 123.742 123.742 125.414 -1.672 25085
5138 1 9 . 1 1 62 62 PHE HA H 62 5.810 5.810 5.405 0.405 25085
5139 1 9 . 1 1 62 62 PHE C C 62 176.135 176.135 174.767 1.368 25085
5140 1 9 . 1 1 62 62 PHE CA C 62 56.960 56.960 56.045 0.915 25085
5141 1 9 . 1 1 62 62 PHE CB C 62 43.352 43.352 41.952 1.400 25085
5142 1 9 . 1 1 62 62 PHE H H 62 8.977 8.977 8.248 0.729 25085
5143 1 9 . 1 1 63 63 HIS N N 63 116.939 116.939 117.735 -0.796 25085
5144 1 9 . 1 1 63 63 HIS HA H 63 5.979 5.979 5.187 0.792 25085
5145 1 9 . 1 1 63 63 HIS C C 63 171.108 171.108 173.205 -2.097 25085
5146 1 9 . 1 1 63 63 HIS CA C 63 54.115 54.115 55.024 -0.909 25085
5147 1 9 . 1 1 63 63 HIS CB C 63 36.861 36.861 31.795 5.066 25085
5148 1 9 . 1 1 63 63 HIS H H 63 9.298 9.298 8.236 1.062 25085
5149 1 9 . 1 1 64 64 CYS N N 64 119.251 119.251 122.216 -2.965 25085
5150 1 9 . 1 1 64 64 CYS HA H 64 5.044 5.044 5.410 -0.366 25085
5151 1 9 . 1 1 64 64 CYS C C 64 177.438 177.438 175.633 1.805 25085
5152 1 9 . 1 1 64 64 CYS CA C 64 56.886 56.886 55.486 1.400 25085
5153 1 9 . 1 1 64 64 CYS CB C 64 29.425 29.425 31.657 -2.232 25085
5154 1 9 . 1 1 64 64 CYS H H 64 8.156 8.156 8.344 -0.188 25085
5155 1 9 . 1 1 65 65 GLN N N 65 125.627 125.627 124.083 1.544 25085
5156 1 9 . 1 1 65 65 GLN HA H 65 4.220 4.220 3.984 0.236 25085
5157 1 9 . 1 1 65 65 GLN C C 65 174.440 174.440 176.101 -1.661 25085
5158 1 9 . 1 1 65 65 GLN CA C 65 59.788 59.788 59.740 0.048 25085
5159 1 9 . 1 1 65 65 GLN CB C 65 29.370 29.370 28.585 0.785 25085
5160 1 9 . 1 1 65 65 GLN H H 65 8.937 8.937 9.156 -0.219 25085
5161 1 9 . 1 1 66 66 ALA N N 66 118.880 118.880 115.442 3.438 25085
5162 1 9 . 1 1 66 66 ALA HA H 66 5.115 5.115 4.630 0.485 25085
5163 1 9 . 1 1 66 66 ALA C C 66 177.625 177.625 178.340 -0.715 25085
5164 1 9 . 1 1 66 66 ALA CA C 66 50.744 50.744 51.625 -0.881 25085
5165 1 9 . 1 1 66 66 ALA CB C 66 20.658 20.658 19.552 1.105 25085
5166 1 9 . 1 1 66 66 ALA H H 66 9.024 9.024 7.600 1.424 25085
5167 1 9 . 1 1 67 67 GLY N N 67 112.878 112.878 108.335 4.543 25085
5168 1 9 . 1 1 67 67 GLY C C 67 174.810 174.810 175.921 -1.111 25085
5169 1 9 . 1 1 67 67 GLY CA C 67 45.642 45.642 46.828 -1.186 25085
5170 1 9 . 1 1 67 67 GLY H H 67 8.845 8.845 8.495 0.350 25085
5171 1 9 . 1 1 68 68 LYS N N 68 120.133 120.133 121.134 -1.001 25085
5172 1 9 . 1 1 68 68 LYS HA H 68 4.158 4.158 3.862 0.296 25085
5173 1 9 . 1 1 68 68 LYS C C 68 177.939 177.939 178.455 -0.516 25085
5174 1 9 . 1 1 68 68 LYS CA C 68 58.811 58.811 59.415 -0.604 25085
5175 1 9 . 1 1 68 68 LYS CB C 68 32.796 32.796 32.324 0.472 25085
5176 1 9 . 1 1 68 68 LYS H H 68 7.936 7.936 8.004 -0.068 25085
5177 1 9 . 1 1 69 69 ARG N N 69 125.804 125.804 118.432 7.372 25085
5178 1 9 . 1 1 69 69 ARG HA H 69 4.217 4.217 4.115 0.102 25085
5179 1 9 . 1 1 69 69 ARG C C 69 180.944 180.944 178.298 2.646 25085
5180 1 9 . 1 1 69 69 ARG CA C 69 60.010 60.010 59.289 0.721 25085
5181 1 9 . 1 1 69 69 ARG CB C 69 30.974 30.974 29.662 1.312 25085
5182 1 9 . 1 1 69 69 ARG H H 69 8.981 8.981 8.259 0.722 25085
5183 1 9 . 1 1 70 70 THR N N 70 116.681 116.681 116.901 -0.220 25085
5184 1 9 . 1 1 70 70 THR HA H 70 3.607 3.607 3.803 -0.196 25085
5185 1 9 . 1 1 70 70 THR C C 70 176.434 176.434 176.734 -0.300 25085
5186 1 9 . 1 1 70 70 THR CA C 70 65.914 65.914 67.001 -1.087 25085
5187 1 9 . 1 1 70 70 THR CB C 70 68.169 68.169 68.307 -0.138 25085
5188 1 9 . 1 1 70 70 THR H H 70 10.382 10.382 8.183 2.199 25085
5189 1 9 . 1 1 71 71 SER N N 71 113.046 113.046 115.296 -2.250 25085
5190 1 9 . 1 1 71 71 SER HA H 71 3.993 3.993 4.149 -0.156 25085
5191 1 9 . 1 1 71 71 SER C C 71 177.594 177.594 175.594 2.000 25085
5192 1 9 . 1 1 71 71 SER CA C 71 62.500 62.500 61.449 1.051 25085
5193 1 9 . 1 1 71 71 SER H H 71 7.346 7.346 7.819 -0.473 25085
5194 1 9 . 1 1 72 72 ASN N N 72 117.540 117.540 119.012 -1.472 25085
5195 1 9 . 1 1 72 72 ASN HA H 72 4.598 4.598 4.667 -0.069 25085
5196 1 9 . 1 1 72 72 ASN C C 72 175.595 175.595 177.355 -1.760 25085
5197 1 9 . 1 1 72 72 ASN CA C 72 55.147 55.147 55.616 -0.469 25085
5198 1 9 . 1 1 72 72 ASN CB C 72 38.821 38.821 39.236 -0.415 25085
5199 1 9 . 1 1 72 72 ASN H H 72 8.078 8.078 8.125 -0.047 25085
5200 1 9 . 1 1 73 73 ASN N N 73 114.869 114.869 117.762 -2.893 25085
5201 1 9 . 1 1 73 73 ASN HA H 73 5.159 5.159 4.676 0.483 25085
5202 1 9 . 1 1 73 73 ASN C C 73 174.375 174.375 176.797 -2.422 25085
5203 1 9 . 1 1 73 73 ASN CA C 73 52.976 52.976 54.193 -1.217 25085
5204 1 9 . 1 1 73 73 ASN CB C 73 39.862 39.862 38.905 0.957 25085
5205 1 9 . 1 1 73 73 ASN H H 73 7.290 7.290 8.511 -1.221 25085
5206 1 9 . 1 1 74 74 ALA N N 74 124.647 124.647 123.658 0.989 25085
5207 1 9 . 1 1 74 74 ALA HA H 74 3.721 3.721 3.804 -0.083 25085
5208 1 9 . 1 1 74 74 ALA C C 74 177.908 177.908 178.389 -0.481 25085
5209 1 9 . 1 1 74 74 ALA CA C 74 57.085 57.085 55.192 1.893 25085
5210 1 9 . 1 1 74 74 ALA CB C 74 19.427 19.427 17.925 1.502 25085
5211 1 9 . 1 1 74 74 ALA H H 74 7.105 7.105 8.794 -1.689 25085
5212 1 9 . 1 1 75 75 ASP N N 75 114.917 114.917 116.729 -1.812 25085
5213 1 9 . 1 1 75 75 ASP HA H 75 4.250 4.250 4.377 -0.127 25085
5214 1 9 . 1 1 75 75 ASP C C 75 179.100 179.100 178.384 0.716 25085
5215 1 9 . 1 1 75 75 ASP CA C 75 57.236 57.236 56.917 0.319 25085
5216 1 9 . 1 1 75 75 ASP CB C 75 39.783 39.783 40.196 -0.413 25085
5217 1 9 . 1 1 75 75 ASP H H 75 8.403 8.403 8.057 0.346 25085
5218 1 9 . 1 1 76 76 LYS N N 76 121.888 121.888 118.873 3.015 25085
5219 1 9 . 1 1 76 76 LYS HA H 76 4.053 4.053 4.238 -0.185 25085
5220 1 9 . 1 1 76 76 LYS C C 76 178.832 178.832 178.750 0.082 25085
5221 1 9 . 1 1 76 76 LYS CA C 76 58.864 58.864 57.312 1.552 25085
5222 1 9 . 1 1 76 76 LYS CB C 76 32.423 32.423 32.566 -0.143 25085
5223 1 9 . 1 1 76 76 LYS H H 76 7.652 7.652 8.128 -0.476 25085
5224 1 9 . 1 1 77 77 LEU N N 77 118.644 118.644 120.422 -1.778 25085
5225 1 9 . 1 1 77 77 LEU HA H 77 3.557 3.557 3.949 -0.392 25085
5226 1 9 . 1 1 77 77 LEU C C 77 178.068 178.068 178.340 -0.272 25085
5227 1 9 . 1 1 77 77 LEU CA C 77 57.692 57.692 57.281 0.411 25085
5228 1 9 . 1 1 77 77 LEU CB C 77 40.077 40.077 40.904 -0.827 25085
5229 1 9 . 1 1 77 77 LEU H H 77 8.146 8.146 7.445 0.701 25085
5230 1 9 . 1 1 78 78 ALA N N 78 119.668 119.668 120.530 -0.862 25085
5231 1 9 . 1 1 78 78 ALA HA H 78 3.990 3.990 3.845 0.145 25085
5232 1 9 . 1 1 78 78 ALA C C 78 179.542 179.542 178.181 1.361 25085
5233 1 9 . 1 1 78 78 ALA CA C 78 54.937 54.937 54.738 0.199 25085
5234 1 9 . 1 1 78 78 ALA CB C 78 18.080 18.080 18.376 -0.296 25085
5235 1 9 . 1 1 78 78 ALA H H 78 8.136 8.136 7.897 0.239 25085
5236 1 9 . 1 1 79 79 ALA N N 79 118.918 118.918 118.963 -0.045 25085
5237 1 9 . 1 1 79 79 ALA HA H 79 4.139 4.139 4.255 -0.116 25085
5238 1 9 . 1 1 79 79 ALA C C 79 180.800 180.800 178.859 1.941 25085
5239 1 9 . 1 1 79 79 ALA CA C 79 54.571 54.571 53.746 0.825 25085
5240 1 9 . 1 1 79 79 ALA CB C 79 18.268 18.268 19.061 -0.793 25085
5241 1 9 . 1 1 79 79 ALA H H 79 7.319 7.319 7.742 -0.423 25085
5242 1 9 . 1 1 80 80 ILE N N 80 118.438 118.438 117.649 0.789 25085
5243 1 9 . 1 1 80 80 ILE HA H 80 3.801 3.801 3.945 -0.144 25085
5244 1 9 . 1 1 80 80 ILE C C 80 177.302 177.302 176.524 0.778 25085
5245 1 9 . 1 1 80 80 ILE CA C 80 64.252 64.252 62.774 1.478 25085
5246 1 9 . 1 1 80 80 ILE CB C 80 39.115 39.115 38.285 0.830 25085
5247 1 9 . 1 1 80 80 ILE H H 80 8.227 8.227 7.913 0.314 25085
5248 1 9 . 1 1 81 81 ALA N N 81 117.917 117.917 118.964 -1.047 25085
5249 1 9 . 1 1 81 81 ALA HA H 81 4.466 4.466 4.493 -0.027 25085
5250 1 9 . 1 1 81 81 ALA C C 81 176.153 176.153 176.369 -0.216 25085
5251 1 9 . 1 1 81 81 ALA CA C 81 51.404 51.404 51.220 0.184 25085
5252 1 9 . 1 1 81 81 ALA CB C 81 20.200 20.200 19.467 0.733 25085
5253 1 9 . 1 1 81 81 ALA H H 81 7.913 7.913 7.991 -0.078 25085
5254 1 9 . 1 1 82 82 ALA N N 82 124.086 124.086 122.015 2.071 25085
5255 1 9 . 1 1 82 82 ALA HA H 82 4.457 4.457 4.081 0.376 25085
5256 1 9 . 1 1 82 82 ALA CA C 82 52.276 52.276 52.713 -0.437 25085
5257 1 9 . 1 1 82 82 ALA CB C 82 17.243 17.243 16.994 0.249 25085
5258 1 9 . 1 1 82 82 ALA H H 82 7.223 7.223 7.135 0.088 25085
5259 1 9 . 1 1 83 83 PRO HA H 83 4.692 4.692 4.299 0.393 25085
5260 1 9 . 1 1 83 83 PRO C C 83 175.169 175.169 175.819 -0.650 25085
5261 1 9 . 1 1 83 83 PRO CA C 83 63.767 63.767 63.323 0.444 25085
5262 1 9 . 1 1 83 83 PRO CB C 83 32.624 32.624 30.712 1.912 25085
5263 1 9 . 1 1 84 84 ALA N N 84 127.741 127.741 121.747 5.994 25085
5264 1 9 . 1 1 84 84 ALA HA H 84 4.138 4.138 4.187 -0.049 25085
5265 1 9 . 1 1 84 84 ALA C C 84 176.494 176.494 177.413 -0.919 25085
5266 1 9 . 1 1 84 84 ALA CA C 84 53.432 53.432 52.089 1.343 25085
5267 1 9 . 1 1 84 84 ALA CB C 84 19.719 19.719 20.023 -0.304 25085
5268 1 9 . 1 1 84 84 ALA H H 84 8.528 8.528 7.721 0.807 25085
5269 1 9 . 1 1 85 85 GLU N N 85 121.634 121.634 119.795 1.839 25085
5270 1 9 . 1 1 85 85 GLU HA H 85 4.228 4.228 4.627 -0.399 25085
5271 1 9 . 1 1 85 85 GLU C C 85 175.094 175.094 174.980 0.114 25085
5272 1 9 . 1 1 85 85 GLU CA C 85 56.444 56.444 55.189 1.255 25085
5273 1 9 . 1 1 85 85 GLU CB C 85 30.803 30.803 29.450 1.353 25085
5274 1 9 . 1 1 85 85 GLU H H 85 8.166 8.166 8.192 -0.026 25085
5275 1 9 . 1 1 86 86 ILE N N 86 122.543 122.543 119.421 3.122 25085
5276 1 9 . 1 1 86 86 ILE HA H 86 5.269 5.269 5.043 0.226 25085
5277 1 9 . 1 1 86 86 ILE C C 86 174.463 174.463 174.764 -0.301 25085
5278 1 9 . 1 1 86 86 ILE CA C 86 59.329 59.329 59.910 -0.581 25085
5279 1 9 . 1 1 86 86 ILE CB C 86 40.546 40.546 40.186 0.360 25085
5280 1 9 . 1 1 86 86 ILE H H 86 7.925 7.925 7.932 -0.007 25085
5281 1 9 . 1 1 87 87 PHE N N 87 122.457 122.457 122.634 -0.177 25085
5282 1 9 . 1 1 87 87 PHE HA H 87 5.428 5.428 5.741 -0.313 25085
5283 1 9 . 1 1 87 87 PHE C C 87 174.450 174.450 174.369 0.081 25085
5284 1 9 . 1 1 87 87 PHE CA C 87 55.029 55.029 56.589 -1.560 25085
5285 1 9 . 1 1 87 87 PHE CB C 87 43.626 43.626 43.871 -0.245 25085
5286 1 9 . 1 1 87 87 PHE H H 87 9.050 9.050 8.480 0.570 25085
5287 1 9 . 1 1 88 88 LEU N N 88 119.959 119.959 120.935 -0.976 25085
5288 1 9 . 1 1 88 88 LEU HA H 88 5.358 5.358 5.024 0.334 25085
5289 1 9 . 1 1 88 88 LEU C C 88 176.627 176.627 174.547 2.080 25085
5290 1 9 . 1 1 88 88 LEU CA C 88 52.654 52.654 53.942 -1.288 25085
5291 1 9 . 1 1 88 88 LEU CB C 88 43.094 43.094 46.679 -3.585 25085
5292 1 9 . 1 1 88 88 LEU H H 88 8.824 8.824 9.357 -0.533 25085
5293 1 9 . 1 1 89 89 LEU N N 89 124.096 124.096 128.479 -4.383 25085
5294 1 9 . 1 1 89 89 LEU HA H 89 4.432 4.432 4.882 -0.450 25085
5295 1 9 . 1 1 89 89 LEU C C 89 176.693 176.693 175.774 0.919 25085
5296 1 9 . 1 1 89 89 LEU CA C 89 55.385 55.385 53.922 1.463 25085
5297 1 9 . 1 1 89 89 LEU CB C 89 43.537 43.537 42.813 0.724 25085
5298 1 9 . 1 1 89 89 LEU H H 89 8.293 8.293 8.241 0.052 25085
5299 1 9 . 1 1 90 90 GLU N N 90 102.942 102.942 126.653 -23.711 25085
5300 1 9 . 1 1 90 90 GLU HA H 90 3.895 3.895 4.002 -0.107 25085
5301 1 9 . 1 1 90 90 GLU C C 90 175.199 175.199 176.462 -1.263 25085
5302 1 9 . 1 1 90 90 GLU CA C 90 58.586 58.586 59.104 -0.518 25085
5303 1 9 . 1 1 90 90 GLU CB C 90 30.831 30.831 30.300 0.531 25085
5304 1 9 . 1 1 90 90 GLU H H 90 9.394 9.394 8.179 1.215 25085
5305 1 9 . 1 1 91 91 ASP N N 91 120.515 120.515 119.811 0.704 25085
5306 1 9 . 1 1 91 91 ASP HA H 91 4.184 4.184 4.335 -0.151 25085
5307 1 9 . 1 1 91 91 ASP C C 91 176.159 176.159 176.376 -0.217 25085
5308 1 9 . 1 1 91 91 ASP CA C 91 55.814 55.814 56.032 -0.218 25085
5309 1 9 . 1 1 91 91 ASP CB C 91 39.033 39.033 39.914 -0.881 25085
5310 1 9 . 1 1 91 91 ASP H H 91 9.210 9.210 8.976 0.234 25085
5311 1 9 . 1 1 92 92 GLY N N 92 104.313 104.313 106.907 -2.594 25085
5312 1 9 . 1 1 92 92 GLY C C 92 172.980 172.980 174.489 -1.509 25085
5313 1 9 . 1 1 92 92 GLY CA C 92 46.946 46.946 44.422 2.524 25085
5314 1 9 . 1 1 92 92 GLY H H 92 7.902 7.902 8.011 -0.109 25085
5315 1 9 . 1 1 93 93 ILE N N 93 121.445 121.445 123.419 -1.974 25085
5316 1 9 . 1 1 93 93 ILE HA H 93 3.902 3.902 3.703 0.199 25085
5317 1 9 . 1 1 93 93 ILE C C 93 176.528 176.528 176.343 0.185 25085
5318 1 9 . 1 1 93 93 ILE CA C 93 63.908 63.908 64.247 -0.339 25085
5319 1 9 . 1 1 93 93 ILE CB C 93 38.416 38.416 37.949 0.467 25085
5320 1 9 . 1 1 93 93 ILE H H 93 8.129 8.129 8.196 -0.067 25085
5321 1 9 . 1 1 94 94 ASP N N 94 126.304 126.304 120.359 5.945 25085
5322 1 9 . 1 1 94 94 ASP HA H 94 4.436 4.436 4.388 0.048 25085
5323 1 9 . 1 1 94 94 ASP C C 94 180.174 180.174 178.986 1.188 25085
5324 1 9 . 1 1 94 94 ASP CA C 94 58.351 58.351 57.814 0.537 25085
5325 1 9 . 1 1 94 94 ASP CB C 94 39.223 39.223 40.019 -0.796 25085
5326 1 9 . 1 1 94 94 ASP H H 94 9.161 9.161 8.155 1.006 25085
5327 1 9 . 1 1 95 95 GLY N N 95 110.690 110.690 107.012 3.678 25085
5328 1 9 . 1 1 95 95 GLY C C 95 176.108 176.108 175.769 0.339 25085
5329 1 9 . 1 1 95 95 GLY CA C 95 46.873 46.873 46.310 0.563 25085
5330 1 9 . 1 1 95 95 GLY H H 95 8.080 8.080 8.597 -0.517 25085
5331 1 9 . 1 1 96 96 TRP N N 96 126.965 126.965 123.335 3.630 25085
5332 1 9 . 1 1 96 96 TRP HA H 96 3.795 3.795 4.367 -0.572 25085
5333 1 9 . 1 1 96 96 TRP C C 96 177.058 177.058 177.291 -0.233 25085
5334 1 9 . 1 1 96 96 TRP CA C 96 61.633 61.633 61.640 -0.007 25085
5335 1 9 . 1 1 96 96 TRP CB C 96 29.512 29.512 29.521 -0.009 25085
5336 1 9 . 1 1 96 96 TRP H H 96 8.007 8.007 7.593 0.414 25085
5337 1 9 . 1 1 97 97 LYS N N 97 116.604 116.604 118.999 -2.395 25085
5338 1 9 . 1 1 97 97 LYS HA H 97 4.090 4.090 4.338 -0.248 25085
5339 1 9 . 1 1 97 97 LYS C C 97 182.010 182.010 178.985 3.025 25085
5340 1 9 . 1 1 97 97 LYS CA C 97 59.776 59.776 58.681 1.095 25085
5341 1 9 . 1 1 97 97 LYS CB C 97 32.208 32.208 32.661 -0.453 25085
5342 1 9 . 1 1 97 97 LYS H H 97 8.696 8.696 8.393 0.303 25085
5343 1 9 . 1 1 98 98 ARG N N 98 122.491 122.491 119.342 3.149 25085
5344 1 9 . 1 1 98 98 ARG HA H 98 4.050 4.050 4.190 -0.140 25085
5345 1 9 . 1 1 98 98 ARG C C 98 177.666 177.666 177.895 -0.229 25085
5346 1 9 . 1 1 98 98 ARG CA C 98 59.509 59.509 58.042 1.467 25085
5347 1 9 . 1 1 98 98 ARG CB C 98 30.471 30.471 30.370 0.101 25085
5348 1 9 . 1 1 98 98 ARG H H 98 8.280 8.280 7.693 0.587 25085
5349 1 9 . 1 1 99 99 ALA N N 99 119.546 119.546 120.687 -1.141 25085
5350 1 9 . 1 1 99 99 ALA HA H 99 4.276 4.276 4.152 0.124 25085
5351 1 9 . 1 1 99 99 ALA C C 99 176.800 176.800 177.784 -0.984 25085
5352 1 9 . 1 1 99 99 ALA CA C 99 52.254 52.254 53.802 -1.548 25085
5353 1 9 . 1 1 99 99 ALA CB C 99 18.270 18.270 19.104 -0.834 25085
5354 1 9 . 1 1 99 99 ALA H H 99 7.519 7.519 8.202 -0.683 25085
5355 1 9 . 1 1 100 100 GLY N N 100 106.339 106.339 103.594 2.745 25085
5356 1 9 . 1 1 100 100 GLY C C 100 174.232 174.232 173.657 0.575 25085
5357 1 9 . 1 1 100 100 GLY CA C 100 45.050 45.050 44.592 0.458 25085
5358 1 9 . 1 1 100 100 GLY H H 100 7.926 7.926 7.769 0.157 25085
5359 1 9 . 1 1 101 101 LEU N N 101 122.181 122.181 121.133 1.048 25085
5360 1 9 . 1 1 101 101 LEU HA H 101 4.286 4.286 4.645 -0.359 25085
5361 1 9 . 1 1 101 101 LEU CA C 101 53.183 53.183 51.152 2.031 25085
5362 1 9 . 1 1 101 101 LEU CB C 101 37.320 37.320 42.413 -5.093 25085
5363 1 9 . 1 1 101 101 LEU H H 101 6.976 6.976 7.388 -0.412 25085
5364 1 9 . 1 1 102 102 PRO HA H 102 4.476 4.476 4.460 0.016 25085
5365 1 9 . 1 1 102 102 PRO C C 102 177.424 177.424 176.115 1.309 25085
5366 1 9 . 1 1 102 102 PRO CA C 102 64.014 64.014 62.635 1.379 25085
5367 1 9 . 1 1 102 102 PRO CB C 102 33.200 33.200 32.197 1.003 25085
5368 1 9 . 1 1 103 103 VAL N N 103 110.512 110.512 113.352 -2.840 25085
5369 1 9 . 1 1 103 103 VAL HA H 103 4.643 4.643 4.387 0.256 25085
5370 1 9 . 1 1 103 103 VAL C C 103 174.297 174.297 175.086 -0.789 25085
5371 1 9 . 1 1 103 103 VAL CA C 103 59.693 59.693 60.069 -0.376 25085
5372 1 9 . 1 1 103 103 VAL CB C 103 35.980 35.980 33.290 2.690 25085
5373 1 9 . 1 1 103 103 VAL H H 103 8.073 8.073 7.796 0.277 25085
5374 1 9 . 1 1 104 104 ALA N N 104 125.898 125.898 125.339 0.559 25085
5375 1 9 . 1 1 104 104 ALA HA H 104 4.550 4.550 4.677 -0.127 25085
5376 1 9 . 1 1 104 104 ALA C C 104 176.190 176.190 175.268 0.922 25085
5377 1 9 . 1 1 104 104 ALA CA C 104 50.699 50.699 50.898 -0.199 25085
5378 1 9 . 1 1 104 104 ALA CB C 104 19.534 19.534 20.157 -0.623 25085
5379 1 9 . 1 1 104 104 ALA H H 104 8.996 8.996 7.980 1.016 25085
5380 1 9 . 1 1 105 105 VAL N N 105 119.534 119.534 125.039 -5.505 25085
5381 1 9 . 1 1 105 105 VAL HA H 105 4.615 4.615 3.972 0.643 25085
5382 1 9 . 1 1 105 105 VAL C C 105 175.576 175.576 175.433 0.143 25085
5383 1 9 . 1 1 105 105 VAL CA C 105 60.234 60.234 60.613 -0.379 25085
5384 1 9 . 1 1 105 105 VAL CB C 105 34.683 34.683 32.802 1.881 25085
5385 1 9 . 1 1 105 105 VAL H H 105 8.276 8.276 8.422 -0.146 25085
5386 1 9 . 1 1 106 106 ASN N N 106 123.346 123.346 126.829 -3.483 25085
5387 1 9 . 1 1 106 106 ASN HA H 106 4.748 4.748 4.882 -0.134 25085
5388 1 9 . 1 1 106 106 ASN C C 106 173.877 173.877 174.923 -1.046 25085
5389 1 9 . 1 1 106 106 ASN CA C 106 53.465 53.465 53.591 -0.126 25085
5390 1 9 . 1 1 106 106 ASN CB C 106 39.424 39.424 39.212 0.212 25085
5391 1 9 . 1 1 106 106 ASN H H 106 8.190 8.190 8.140 0.050 25085
5392 1 10 . 1 1 2 2 ALA N N 2 125.104 125.104 123.046 2.058 25085
5393 1 10 . 1 1 2 2 ALA HA H 2 4.287 4.287 4.465 -0.178 25085
5394 1 10 . 1 1 2 2 ALA C C 2 176.800 176.800 174.269 2.531 25085
5395 1 10 . 1 1 2 2 ALA CA C 2 52.429 52.429 52.318 0.111 25085
5396 1 10 . 1 1 2 2 ALA CB C 2 19.407 19.407 18.871 0.536 25085
5397 1 10 . 1 1 2 2 ALA H H 2 8.344 8.344 7.884 0.460 25085
5398 1 10 . 1 1 3 3 LEU N N 3 120.515 120.515 119.935 0.580 25085
5399 1 10 . 1 1 3 3 LEU HA H 3 4.452 4.452 5.594 -1.142 25085
5400 1 10 . 1 1 3 3 LEU C C 3 176.497 176.497 175.908 0.589 25085
5401 1 10 . 1 1 3 3 LEU CA C 3 54.698 54.698 53.910 0.788 25085
5402 1 10 . 1 1 3 3 LEU CB C 3 43.203 43.203 44.789 -1.586 25085
5403 1 10 . 1 1 3 3 LEU H H 3 8.070 8.070 7.972 0.098 25085
5404 1 10 . 1 1 4 4 THR N N 4 117.803 117.803 120.122 -2.319 25085
5405 1 10 . 1 1 4 4 THR HA H 4 4.480 4.480 4.834 -0.354 25085
5406 1 10 . 1 1 4 4 THR C C 4 173.872 173.872 174.463 -0.591 25085
5407 1 10 . 1 1 4 4 THR CA C 4 62.247 62.247 61.181 1.066 25085
5408 1 10 . 1 1 4 4 THR CB C 4 70.533 70.533 71.430 -0.897 25085
5409 1 10 . 1 1 4 4 THR H H 4 7.954 7.954 8.744 -0.790 25085
5410 1 10 . 1 1 5 5 THR N N 5 121.501 121.501 116.782 4.719 25085
5411 1 10 . 1 1 5 5 THR HA H 5 5.289 5.289 4.557 0.732 25085
5412 1 10 . 1 1 5 5 THR C C 5 174.162 174.162 173.848 0.314 25085
5413 1 10 . 1 1 5 5 THR CA C 5 62.102 62.102 62.022 0.080 25085
5414 1 10 . 1 1 5 5 THR CB C 5 69.457 69.457 69.516 -0.059 25085
5415 1 10 . 1 1 5 5 THR H H 5 8.640 8.640 8.557 0.083 25085
5416 1 10 . 1 1 6 6 ILE N N 6 122.023 122.023 123.438 -1.415 25085
5417 1 10 . 1 1 6 6 ILE HA H 6 4.988 4.988 4.482 0.506 25085
5418 1 10 . 1 1 6 6 ILE C C 6 173.377 173.377 174.310 -0.933 25085
5419 1 10 . 1 1 6 6 ILE CA C 6 58.611 58.611 59.745 -1.134 25085
5420 1 10 . 1 1 6 6 ILE CB C 6 42.821 42.821 42.426 0.395 25085
5421 1 10 . 1 1 6 6 ILE H H 6 8.977 8.977 9.157 -0.180 25085
5422 1 10 . 1 1 7 7 SER N N 7 122.659 122.659 117.511 5.148 25085
5423 1 10 . 1 1 7 7 SER HA H 7 4.768 4.768 5.098 -0.330 25085
5424 1 10 . 1 1 7 7 SER CA C 7 56.790 56.790 54.285 2.505 25085
5425 1 10 . 1 1 7 7 SER CB C 7 63.235 63.235 64.287 -1.052 25085
5426 1 10 . 1 1 7 7 SER H H 7 9.242 9.242 8.444 0.798 25085
5427 1 10 . 1 1 8 8 PRO HA H 8 4.207 4.207 4.303 -0.096 25085
5428 1 10 . 1 1 8 8 PRO C C 8 176.787 176.787 177.875 -1.088 25085
5429 1 10 . 1 1 8 8 PRO CA C 8 66.443 66.443 65.280 1.163 25085
5430 1 10 . 1 1 8 8 PRO CB C 8 32.724 32.724 31.697 1.027 25085
5431 1 10 . 1 1 9 9 HIS N N 9 113.700 113.700 114.269 -0.569 25085
5432 1 10 . 1 1 9 9 HIS HA H 9 3.990 3.990 4.321 -0.331 25085
5433 1 10 . 1 1 9 9 HIS C C 9 178.123 178.123 177.032 1.091 25085
5434 1 10 . 1 1 9 9 HIS CA C 9 60.827 60.827 59.332 1.495 25085
5435 1 10 . 1 1 9 9 HIS CB C 9 29.552 29.552 29.838 -0.286 25085
5436 1 10 . 1 1 9 9 HIS H H 9 8.172 8.172 7.915 0.257 25085
5437 1 10 . 1 1 10 10 ASP N N 10 120.665 120.665 120.771 -0.106 25085
5438 1 10 . 1 1 10 10 ASP HA H 10 4.369 4.369 4.690 -0.321 25085
5439 1 10 . 1 1 10 10 ASP C C 10 179.100 179.100 177.688 1.412 25085
5440 1 10 . 1 1 10 10 ASP CA C 10 57.071 57.071 57.453 -0.382 25085
5441 1 10 . 1 1 10 10 ASP CB C 10 39.529 39.529 41.225 -1.696 25085
5442 1 10 . 1 1 10 10 ASP H H 10 7.706 7.706 8.673 -0.967 25085
5443 1 10 . 1 1 11 11 ALA N N 11 123.686 123.686 121.931 1.755 25085
5444 1 10 . 1 1 11 11 ALA HA H 11 3.782 3.782 3.890 -0.108 25085
5445 1 10 . 1 1 11 11 ALA C C 11 178.260 178.260 179.255 -0.995 25085
5446 1 10 . 1 1 11 11 ALA CA C 11 55.142 55.142 55.242 -0.100 25085
5447 1 10 . 1 1 11 11 ALA CB C 11 18.293 18.293 18.160 0.133 25085
5448 1 10 . 1 1 11 11 ALA H H 11 8.896 8.896 7.608 1.288 25085
5449 1 10 . 1 1 12 12 GLN N N 12 117.521 117.521 117.747 -0.226 25085
5450 1 10 . 1 1 12 12 GLN HA H 12 4.000 4.000 4.049 -0.049 25085
5451 1 10 . 1 1 12 12 GLN C C 12 178.499 178.499 178.187 0.312 25085
5452 1 10 . 1 1 12 12 GLN CA C 12 60.102 60.102 58.943 1.159 25085
5453 1 10 . 1 1 12 12 GLN CB C 12 28.743 28.743 28.294 0.449 25085
5454 1 10 . 1 1 12 12 GLN H H 12 8.431 8.431 8.093 0.338 25085
5455 1 10 . 1 1 13 13 GLU N N 13 118.578 118.578 119.158 -0.580 25085
5456 1 10 . 1 1 13 13 GLU HA H 13 4.059 4.059 4.090 -0.031 25085
5457 1 10 . 1 1 13 13 GLU C C 13 178.352 178.352 179.588 -1.236 25085
5458 1 10 . 1 1 13 13 GLU CA C 13 59.079 59.079 58.724 0.355 25085
5459 1 10 . 1 1 13 13 GLU CB C 13 29.213 29.213 29.576 -0.363 25085
5460 1 10 . 1 1 13 13 GLU H H 13 7.234 7.234 8.107 -0.873 25085
5461 1 10 . 1 1 14 14 LEU N N 14 119.848 119.848 120.955 -1.107 25085
5462 1 10 . 1 1 14 14 LEU HA H 14 3.891 3.891 4.023 -0.132 25085
5463 1 10 . 1 1 14 14 LEU C C 14 180.773 180.773 179.278 1.495 25085
5464 1 10 . 1 1 14 14 LEU CA C 14 57.958 57.958 57.508 0.451 25085
5465 1 10 . 1 1 14 14 LEU CB C 14 41.715 41.715 41.700 0.015 25085
5466 1 10 . 1 1 14 14 LEU H H 14 7.582 7.582 8.111 -0.529 25085
5467 1 10 . 1 1 15 15 ILE N N 15 122.392 122.392 117.809 4.583 25085
5468 1 10 . 1 1 15 15 ILE HA H 15 3.924 3.924 3.678 0.246 25085
5469 1 10 . 1 1 15 15 ILE C C 15 180.109 180.109 177.067 3.042 25085
5470 1 10 . 1 1 15 15 ILE CA C 15 64.663 64.663 64.569 0.094 25085
5471 1 10 . 1 1 15 15 ILE CB C 15 38.900 38.900 37.797 1.103 25085
5472 1 10 . 1 1 15 15 ILE H H 15 8.772 8.772 8.521 0.251 25085
5473 1 10 . 1 1 16 16 ALA N N 16 123.856 123.856 119.605 4.251 25085
5474 1 10 . 1 1 16 16 ALA HA H 16 4.183 4.183 4.218 -0.035 25085
5475 1 10 . 1 1 16 16 ALA C C 16 179.100 179.100 178.619 0.481 25085
5476 1 10 . 1 1 16 16 ALA CA C 16 54.806 54.806 53.819 0.987 25085
5477 1 10 . 1 1 16 16 ALA CB C 16 17.646 17.646 18.786 -1.140 25085
5478 1 10 . 1 1 16 16 ALA H H 16 7.808 7.808 7.313 0.495 25085
5479 1 10 . 1 1 17 17 ARG N N 17 115.329 115.329 118.179 -2.850 25085
5480 1 10 . 1 1 17 17 ARG HA H 17 4.404 4.404 4.340 0.064 25085
5481 1 10 . 1 1 17 17 ARG C C 17 176.446 176.446 177.302 -0.856 25085
5482 1 10 . 1 1 17 17 ARG CA C 17 56.015 56.015 57.232 -1.217 25085
5483 1 10 . 1 1 17 17 ARG CB C 17 30.676 30.676 31.630 -0.954 25085
5484 1 10 . 1 1 17 17 ARG H H 17 7.280 7.280 8.402 -1.122 25085
5485 1 10 . 1 1 18 18 GLY N N 18 107.395 107.395 104.321 3.074 25085
5486 1 10 . 1 1 18 18 GLY C C 18 174.072 174.072 173.292 0.780 25085
5487 1 10 . 1 1 18 18 GLY CA C 18 45.218 45.218 44.804 0.414 25085
5488 1 10 . 1 1 18 18 GLY H H 18 7.795 7.795 8.172 -0.377 25085
5489 1 10 . 1 1 19 19 ALA N N 19 123.197 123.197 123.955 -0.758 25085
5490 1 10 . 1 1 19 19 ALA HA H 19 4.217 4.217 3.925 0.292 25085
5491 1 10 . 1 1 19 19 ALA C C 19 176.261 176.261 177.025 -0.764 25085
5492 1 10 . 1 1 19 19 ALA CA C 19 52.674 52.674 53.164 -0.490 25085
5493 1 10 . 1 1 19 19 ALA CB C 19 19.411 19.411 19.204 0.207 25085
5494 1 10 . 1 1 19 19 ALA H H 19 7.980 7.980 7.518 0.462 25085
5495 1 10 . 1 1 20 20 LYS N N 20 118.629 118.629 122.767 -4.138 25085
5496 1 10 . 1 1 20 20 LYS HA H 20 4.308 4.308 4.403 -0.095 25085
5497 1 10 . 1 1 20 20 LYS C C 20 173.981 173.981 174.878 -0.897 25085
5498 1 10 . 1 1 20 20 LYS CA C 20 53.820 53.820 55.134 -1.314 25085
5499 1 10 . 1 1 20 20 LYS CB C 20 33.571 33.571 33.708 -0.137 25085
5500 1 10 . 1 1 20 20 LYS H H 20 7.589 7.589 7.892 -0.303 25085
5501 1 10 . 1 1 21 21 LEU N N 21 126.686 126.686 126.162 0.524 25085
5502 1 10 . 1 1 21 21 LEU HA H 21 5.154 5.154 4.845 0.309 25085
5503 1 10 . 1 1 21 21 LEU C C 21 174.076 174.076 175.786 -1.710 25085
5504 1 10 . 1 1 21 21 LEU CA C 21 53.262 53.262 54.224 -0.962 25085
5505 1 10 . 1 1 21 21 LEU CB C 21 44.350 44.350 43.458 0.892 25085
5506 1 10 . 1 1 21 21 LEU H H 21 8.812 8.812 8.722 0.090 25085
5507 1 10 . 1 1 22 22 ILE N N 22 127.566 127.566 121.611 5.955 25085
5508 1 10 . 1 1 22 22 ILE HA H 22 4.678 4.678 4.853 -0.174 25085
5509 1 10 . 1 1 22 22 ILE C C 22 173.136 173.136 173.908 -0.772 25085
5510 1 10 . 1 1 22 22 ILE CA C 22 60.160 60.160 59.488 0.672 25085
5511 1 10 . 1 1 22 22 ILE CB C 22 39.842 39.842 41.920 -2.078 25085
5512 1 10 . 1 1 22 22 ILE H H 22 9.416 9.416 9.045 0.371 25085
5513 1 10 . 1 1 23 23 ASP N N 23 129.217 129.217 123.680 5.537 25085
5514 1 10 . 1 1 23 23 ASP HA H 23 3.806 3.806 4.780 -0.974 25085
5515 1 10 . 1 1 23 23 ASP C C 23 176.042 176.042 175.461 0.581 25085
5516 1 10 . 1 1 23 23 ASP CA C 23 52.005 52.005 52.084 -0.079 25085
5517 1 10 . 1 1 23 23 ASP CB C 23 42.984 42.984 43.112 -0.128 25085
5518 1 10 . 1 1 23 23 ASP H H 23 8.619 8.619 8.528 0.091 25085
5519 1 10 . 1 1 24 24 ILE N N 24 115.522 115.522 118.263 -2.741 25085
5520 1 10 . 1 1 24 24 ILE HA H 24 5.255 5.255 4.995 0.260 25085
5521 1 10 . 1 1 24 24 ILE C C 24 178.920 178.920 174.388 4.532 25085
5522 1 10 . 1 1 24 24 ILE CA C 24 60.188 60.188 59.915 0.273 25085
5523 1 10 . 1 1 24 24 ILE CB C 24 38.015 38.015 39.098 -1.083 25085
5524 1 10 . 1 1 24 24 ILE H H 24 7.877 7.877 7.673 0.204 25085
5525 1 10 . 1 1 25 25 ARG N N 25 124.317 124.317 123.803 0.514 25085
5526 1 10 . 1 1 25 25 ARG HA H 25 4.170 4.170 4.445 -0.275 25085
5527 1 10 . 1 1 25 25 ARG C C 25 171.756 171.756 174.223 -2.467 25085
5528 1 10 . 1 1 25 25 ARG CA C 25 56.547 56.547 54.489 2.058 25085
5529 1 10 . 1 1 25 25 ARG CB C 25 30.897 30.897 32.337 -1.440 25085
5530 1 10 . 1 1 25 25 ARG H H 25 8.235 8.235 7.927 0.308 25085
5531 1 10 . 1 1 26 26 ASP N N 26 112.059 112.059 121.629 -9.570 25085
5532 1 10 . 1 1 26 26 ASP HA H 26 4.609 4.609 4.857 -0.248 25085
5533 1 10 . 1 1 26 26 ASP C C 26 177.934 177.934 177.014 0.920 25085
5534 1 10 . 1 1 26 26 ASP CA C 26 54.398 54.398 54.048 0.349 25085
5535 1 10 . 1 1 26 26 ASP CB C 26 42.029 42.029 41.763 0.266 25085
5536 1 10 . 1 1 26 26 ASP H H 26 7.730 7.730 8.587 -0.857 25085
5537 1 10 . 1 1 27 27 ALA N N 27 121.435 121.435 129.133 -7.698 25085
5538 1 10 . 1 1 27 27 ALA HA H 27 3.959 3.959 3.850 0.109 25085
5539 1 10 . 1 1 27 27 ALA C C 27 179.388 179.388 178.589 0.799 25085
5540 1 10 . 1 1 27 27 ALA CA C 27 55.829 55.829 56.085 -0.256 25085
5541 1 10 . 1 1 27 27 ALA CB C 27 18.572 18.572 18.874 -0.302 25085
5542 1 10 . 1 1 27 27 ALA H H 27 8.797 8.797 8.651 0.146 25085
5543 1 10 . 1 1 28 28 ASP N N 28 114.759 114.759 117.037 -2.278 25085
5544 1 10 . 1 1 28 28 ASP HA H 28 4.314 4.314 4.286 0.028 25085
5545 1 10 . 1 1 28 28 ASP C C 28 178.738 178.738 178.047 0.691 25085
5546 1 10 . 1 1 28 28 ASP CA C 28 56.997 56.997 57.151 -0.154 25085
5547 1 10 . 1 1 28 28 ASP CB C 28 39.811 39.811 40.718 -0.907 25085
5548 1 10 . 1 1 28 28 ASP H H 28 8.755 8.755 8.720 0.035 25085
5549 1 10 . 1 1 29 29 GLU N N 29 119.562 119.562 117.739 1.823 25085
5550 1 10 . 1 1 29 29 GLU HA H 29 4.116 4.116 4.240 -0.124 25085
5551 1 10 . 1 1 29 29 GLU C C 29 178.473 178.473 178.867 -0.394 25085
5552 1 10 . 1 1 29 29 GLU CA C 29 58.928 58.928 58.505 0.423 25085
5553 1 10 . 1 1 29 29 GLU CB C 29 29.395 29.395 30.075 -0.680 25085
5554 1 10 . 1 1 29 29 GLU H H 29 7.446 7.446 8.788 -1.342 25085
5555 1 10 . 1 1 30 30 TYR N N 30 120.494 120.494 121.130 -0.636 25085
5556 1 10 . 1 1 30 30 TYR HA H 30 4.092 4.092 4.681 -0.589 25085
5557 1 10 . 1 1 30 30 TYR C C 30 176.988 176.988 177.603 -0.615 25085
5558 1 10 . 1 1 30 30 TYR CA C 30 60.931 60.931 60.260 0.671 25085
5559 1 10 . 1 1 30 30 TYR CB C 30 39.534 39.534 38.911 0.623 25085
5560 1 10 . 1 1 30 30 TYR H H 30 7.545 7.545 8.268 -0.723 25085
5561 1 10 . 1 1 31 31 LEU N N 31 118.227 118.227 118.630 -0.403 25085
5562 1 10 . 1 1 31 31 LEU HA H 31 3.916 3.916 3.991 -0.075 25085
5563 1 10 . 1 1 31 31 LEU C C 31 178.824 178.824 178.538 0.286 25085
5564 1 10 . 1 1 31 31 LEU CA C 31 57.444 57.444 57.294 0.150 25085
5565 1 10 . 1 1 31 31 LEU CB C 31 41.941 41.941 41.749 0.192 25085
5566 1 10 . 1 1 31 31 LEU H H 31 8.235 8.235 8.809 -0.574 25085
5567 1 10 . 1 1 32 32 ARG N N 32 117.334 117.334 114.976 2.358 25085
5568 1 10 . 1 1 32 32 ARG HA H 32 4.112 4.112 4.137 -0.025 25085
5569 1 10 . 1 1 32 32 ARG C C 32 177.008 177.008 176.360 0.648 25085
5570 1 10 . 1 1 32 32 ARG CA C 32 59.366 59.366 58.264 1.101 25085
5571 1 10 . 1 1 32 32 ARG CB C 32 30.938 30.938 30.814 0.124 25085
5572 1 10 . 1 1 32 32 ARG H H 32 7.133 7.133 7.516 -0.383 25085
5573 1 10 . 1 1 33 33 GLU N N 33 117.282 117.282 116.764 0.518 25085
5574 1 10 . 1 1 33 33 GLU HA H 33 4.893 4.893 4.659 0.234 25085
5575 1 10 . 1 1 33 33 GLU C C 33 173.503 173.503 173.746 -0.243 25085
5576 1 10 . 1 1 33 33 GLU CA C 33 56.291 56.291 56.166 0.125 25085
5577 1 10 . 1 1 33 33 GLU CB C 33 32.248 32.248 32.916 -0.668 25085
5578 1 10 . 1 1 33 33 GLU H H 33 7.521 7.521 7.451 0.070 25085
5579 1 10 . 1 1 34 34 HIS N N 34 117.828 117.828 118.733 -0.905 25085
5580 1 10 . 1 1 34 34 HIS HA H 34 4.627 4.627 3.767 0.860 25085
5581 1 10 . 1 1 34 34 HIS C C 34 171.950 171.950 173.351 -1.401 25085
5582 1 10 . 1 1 34 34 HIS CA C 34 54.304 54.304 52.421 1.883 25085
5583 1 10 . 1 1 34 34 HIS CB C 34 30.712 30.712 33.207 -2.495 25085
5584 1 10 . 1 1 34 34 HIS H H 34 8.354 8.354 8.916 -0.562 25085
5585 1 10 . 1 1 35 35 ILE N N 35 126.965 126.965 119.199 7.766 25085
5586 1 10 . 1 1 35 35 ILE HA H 35 3.973 3.973 4.282 -0.309 25085
5587 1 10 . 1 1 35 35 ILE CA C 35 60.500 60.500 57.788 2.712 25085
5588 1 10 . 1 1 35 35 ILE CB C 35 38.822 38.822 39.245 -0.423 25085
5589 1 10 . 1 1 35 35 ILE H H 35 10.032 10.032 8.010 2.022 25085
5590 1 10 . 1 1 36 36 PRO HA H 36 4.033 4.033 4.544 -0.511 25085
5591 1 10 . 1 1 36 36 PRO C C 36 177.308 177.308 175.990 1.318 25085
5592 1 10 . 1 1 36 36 PRO CA C 36 66.191 66.191 63.388 2.803 25085
5593 1 10 . 1 1 36 36 PRO CB C 36 31.701 31.701 31.531 0.170 25085
5594 1 10 . 1 1 37 37 GLU N N 37 113.735 113.735 118.107 -4.372 25085
5595 1 10 . 1 1 37 37 GLU HA H 37 4.083 4.083 4.560 -0.477 25085
5596 1 10 . 1 1 37 37 GLU C C 37 176.274 176.274 174.573 1.701 25085
5597 1 10 . 1 1 37 37 GLU CA C 37 58.285 58.285 56.088 2.197 25085
5598 1 10 . 1 1 37 37 GLU CB C 37 28.895 28.895 30.048 -1.153 25085
5599 1 10 . 1 1 37 37 GLU H H 37 8.625 8.625 8.358 0.267 25085
5600 1 10 . 1 1 38 38 ALA N N 38 122.325 122.325 120.278 2.047 25085
5601 1 10 . 1 1 38 38 ALA HA H 38 4.484 4.484 4.587 -0.103 25085
5602 1 10 . 1 1 38 38 ALA C C 38 178.043 178.043 175.173 2.870 25085
5603 1 10 . 1 1 38 38 ALA CA C 38 52.385 52.385 51.376 1.009 25085
5604 1 10 . 1 1 38 38 ALA CB C 38 21.151 21.151 21.585 -0.434 25085
5605 1 10 . 1 1 38 38 ALA H H 38 8.160 8.160 7.367 0.793 25085
5606 1 10 . 1 1 39 39 ASP N N 39 123.726 123.726 120.269 3.457 25085
5607 1 10 . 1 1 39 39 ASP HA H 39 4.856 4.856 4.781 0.075 25085
5608 1 10 . 1 1 39 39 ASP C C 39 174.077 174.077 175.071 -0.994 25085
5609 1 10 . 1 1 39 39 ASP CA C 39 53.498 53.498 53.370 0.128 25085
5610 1 10 . 1 1 39 39 ASP CB C 39 45.176 45.176 43.582 1.594 25085
5611 1 10 . 1 1 39 39 ASP H H 39 9.095 9.095 8.774 0.321 25085
5612 1 10 . 1 1 40 40 LEU N N 40 123.111 123.111 123.579 -0.468 25085
5613 1 10 . 1 1 40 40 LEU HA H 40 4.339 4.339 4.278 0.061 25085
5614 1 10 . 1 1 40 40 LEU C C 40 176.159 176.159 175.294 0.865 25085
5615 1 10 . 1 1 40 40 LEU CA C 40 54.766 54.766 54.549 0.217 25085
5616 1 10 . 1 1 40 40 LEU CB C 40 41.988 41.988 43.901 -1.913 25085
5617 1 10 . 1 1 40 40 LEU H H 40 8.199 8.199 8.266 -0.067 25085
5618 1 10 . 1 1 41 41 ALA N N 41 130.678 130.678 129.390 1.288 25085
5619 1 10 . 1 1 41 41 ALA HA H 41 4.430 4.430 4.736 -0.306 25085
5620 1 10 . 1 1 41 41 ALA CA C 41 49.844 49.844 49.503 0.341 25085
5621 1 10 . 1 1 41 41 ALA CB C 41 18.765 18.765 19.902 -1.137 25085
5622 1 10 . 1 1 41 41 ALA H H 41 8.705 8.705 8.832 -0.127 25085
5623 1 10 . 1 1 42 42 PRO HA H 42 4.133 4.133 4.526 -0.393 25085
5624 1 10 . 1 1 42 42 PRO C C 42 178.946 178.946 177.951 0.995 25085
5625 1 10 . 1 1 42 42 PRO CA C 42 62.119 62.119 62.346 -0.227 25085
5626 1 10 . 1 1 42 42 PRO CB C 42 33.383 33.383 31.922 1.461 25085
5627 1 10 . 1 1 43 43 LEU N N 43 124.604 124.604 125.594 -0.990 25085
5628 1 10 . 1 1 43 43 LEU HA H 43 3.881 3.881 4.013 -0.132 25085
5629 1 10 . 1 1 43 43 LEU C C 43 176.869 176.869 178.095 -1.226 25085
5630 1 10 . 1 1 43 43 LEU CA C 43 58.639 58.639 57.795 0.844 25085
5631 1 10 . 1 1 43 43 LEU CB C 43 41.848 41.848 41.700 0.148 25085
5632 1 10 . 1 1 43 43 LEU H H 43 8.330 8.330 8.405 -0.075 25085
5633 1 10 . 1 1 44 44 SER N N 44 110.167 110.167 112.887 -2.720 25085
5634 1 10 . 1 1 44 44 SER HA H 44 4.147 4.147 4.312 -0.165 25085
5635 1 10 . 1 1 44 44 SER C C 44 177.107 177.107 176.113 0.994 25085
5636 1 10 . 1 1 44 44 SER CA C 44 61.043 61.043 60.895 0.148 25085
5637 1 10 . 1 1 44 44 SER CB C 44 61.765 61.765 62.934 -1.169 25085
5638 1 10 . 1 1 44 44 SER H H 44 8.553 8.553 8.285 0.268 25085
5639 1 10 . 1 1 45 45 VAL N N 45 123.549 123.549 120.352 3.197 25085
5640 1 10 . 1 1 45 45 VAL HA H 45 3.825 3.825 4.042 -0.217 25085
5641 1 10 . 1 1 45 45 VAL C C 45 178.328 178.328 177.757 0.571 25085
5642 1 10 . 1 1 45 45 VAL CA C 45 65.576 65.576 64.744 0.832 25085
5643 1 10 . 1 1 45 45 VAL CB C 45 31.889 31.889 31.054 0.835 25085
5644 1 10 . 1 1 45 45 VAL H H 45 7.181 7.181 8.375 -1.194 25085
5645 1 10 . 1 1 46 46 LEU N N 46 120.336 120.336 122.392 -2.056 25085
5646 1 10 . 1 1 46 46 LEU HA H 46 3.826 3.826 4.057 -0.231 25085
5647 1 10 . 1 1 46 46 LEU C C 46 179.996 179.996 178.306 1.690 25085
5648 1 10 . 1 1 46 46 LEU CA C 46 57.602 57.602 58.921 -1.319 25085
5649 1 10 . 1 1 46 46 LEU CB C 46 41.691 41.691 41.969 -0.278 25085
5650 1 10 . 1 1 46 46 LEU H H 46 8.040 8.040 7.981 0.059 25085
5651 1 10 . 1 1 47 47 GLU N N 47 115.713 115.713 117.233 -1.520 25085
5652 1 10 . 1 1 47 47 GLU HA H 47 3.820 3.820 4.067 -0.247 25085
5653 1 10 . 1 1 47 47 GLU C C 47 177.029 177.029 178.419 -1.390 25085
5654 1 10 . 1 1 47 47 GLU CA C 47 59.317 59.317 58.661 0.656 25085
5655 1 10 . 1 1 47 47 GLU CB C 47 30.526 30.526 29.772 0.754 25085
5656 1 10 . 1 1 47 47 GLU H H 47 8.567 8.567 7.681 0.886 25085
5657 1 10 . 1 1 48 48 GLN N N 48 116.740 116.740 117.050 -0.310 25085
5658 1 10 . 1 1 48 48 GLN HA H 48 4.281 4.281 4.290 -0.009 25085
5659 1 10 . 1 1 48 48 GLN C C 48 177.605 177.605 177.361 0.244 25085
5660 1 10 . 1 1 48 48 GLN CA C 48 57.827 57.827 57.274 0.553 25085
5661 1 10 . 1 1 48 48 GLN CB C 48 29.985 29.985 29.256 0.729 25085
5662 1 10 . 1 1 48 48 GLN H H 48 7.472 7.472 7.753 -0.281 25085
5663 1 10 . 1 1 49 49 SER N N 49 111.004 111.004 113.726 -2.722 25085
5664 1 10 . 1 1 49 49 SER HA H 49 4.648 4.648 4.460 0.188 25085
5665 1 10 . 1 1 49 49 SER C C 49 174.859 174.859 174.567 0.292 25085
5666 1 10 . 1 1 49 49 SER CA C 49 58.406 58.406 58.891 -0.485 25085
5667 1 10 . 1 1 49 49 SER CB C 49 64.758 64.758 64.878 -0.120 25085
5668 1 10 . 1 1 49 49 SER H H 49 8.657 8.657 8.327 0.330 25085
5669 1 10 . 1 1 50 50 GLY N N 50 110.839 110.839 109.408 1.431 25085
5670 1 10 . 1 1 50 50 GLY C C 50 172.398 172.398 173.017 -0.619 25085
5671 1 10 . 1 1 50 50 GLY CA C 50 44.444 44.444 44.893 -0.449 25085
5672 1 10 . 1 1 50 50 GLY H H 50 7.846 7.846 7.736 0.110 25085
5673 1 10 . 1 1 51 51 LEU N N 51 121.009 121.009 124.193 -3.184 25085
5674 1 10 . 1 1 51 51 LEU HA H 51 4.244 4.244 4.804 -0.560 25085
5675 1 10 . 1 1 51 51 LEU CA C 51 52.593 52.593 51.215 1.378 25085
5676 1 10 . 1 1 51 51 LEU CB C 51 43.381 43.381 43.158 0.223 25085
5677 1 10 . 1 1 51 51 LEU H H 51 8.647 8.647 8.005 0.641 25085
5678 1 10 . 1 1 52 52 PRO HA H 52 4.349 4.349 4.603 -0.254 25085
5679 1 10 . 1 1 52 52 PRO C C 52 177.247 177.247 177.206 0.041 25085
5680 1 10 . 1 1 52 52 PRO CA C 52 62.980 62.980 62.554 0.426 25085
5681 1 10 . 1 1 52 52 PRO CB C 52 32.423 32.423 29.675 2.748 25085
5682 1 10 . 1 1 53 53 ALA N N 53 126.595 126.595 125.356 1.239 25085
5683 1 10 . 1 1 53 53 ALA HA H 53 3.870 3.870 3.912 -0.042 25085
5684 1 10 . 1 1 53 53 ALA C C 53 180.484 180.484 179.185 1.299 25085
5685 1 10 . 1 1 53 53 ALA CA C 53 55.829 55.829 55.309 0.519 25085
5686 1 10 . 1 1 53 53 ALA CB C 53 18.248 18.248 18.552 -0.304 25085
5687 1 10 . 1 1 53 53 ALA H H 53 8.643 8.643 8.753 -0.110 25085
5688 1 10 . 1 1 54 54 LYS N N 54 113.898 113.898 118.216 -4.318 25085
5689 1 10 . 1 1 54 54 LYS HA H 54 4.167 4.167 4.071 0.096 25085
5690 1 10 . 1 1 54 54 LYS C C 54 176.704 176.704 178.554 -1.850 25085
5691 1 10 . 1 1 54 54 LYS CA C 54 57.893 57.893 58.529 -0.636 25085
5692 1 10 . 1 1 54 54 LYS CB C 54 31.892 31.892 31.895 -0.003 25085
5693 1 10 . 1 1 54 54 LYS H H 54 8.442 8.442 8.324 0.118 25085
5694 1 10 . 1 1 55 55 LEU N N 55 117.932 117.932 119.588 -1.656 25085
5695 1 10 . 1 1 55 55 LEU HA H 55 4.308 4.308 4.323 -0.015 25085
5696 1 10 . 1 1 55 55 LEU C C 55 174.589 174.589 177.716 -3.127 25085
5697 1 10 . 1 1 55 55 LEU CA C 55 54.003 54.003 56.729 -2.726 25085
5698 1 10 . 1 1 55 55 LEU CB C 55 41.649 41.649 42.612 -0.963 25085
5699 1 10 . 1 1 55 55 LEU H H 55 7.805 7.805 8.631 -0.826 25085
5700 1 10 . 1 1 56 56 ARG N N 56 116.873 116.873 116.947 -0.074 25085
5701 1 10 . 1 1 56 56 ARG HA H 56 4.006 4.006 4.537 -0.531 25085
5702 1 10 . 1 1 56 56 ARG C C 56 175.542 175.542 175.598 -0.056 25085
5703 1 10 . 1 1 56 56 ARG CA C 56 57.428 57.428 55.625 1.803 25085
5704 1 10 . 1 1 56 56 ARG CB C 56 29.651 29.651 31.112 -1.461 25085
5705 1 10 . 1 1 56 56 ARG H H 56 6.971 6.971 8.343 -1.372 25085
5706 1 10 . 1 1 57 57 HIS N N 57 122.622 122.622 116.701 5.921 25085
5707 1 10 . 1 1 57 57 HIS HA H 57 4.596 4.596 4.570 0.026 25085
5708 1 10 . 1 1 57 57 HIS C C 57 173.855 173.855 172.976 0.879 25085
5709 1 10 . 1 1 57 57 HIS CA C 57 55.780 55.780 56.581 -0.801 25085
5710 1 10 . 1 1 57 57 HIS CB C 57 33.878 33.878 31.311 2.567 25085
5711 1 10 . 1 1 57 57 HIS H H 57 7.281 7.281 7.457 -0.176 25085
5712 1 10 . 1 1 58 58 GLU N N 58 120.479 120.479 118.060 2.419 25085
5713 1 10 . 1 1 58 58 GLU HA H 58 4.052 4.052 4.418 -0.366 25085
5714 1 10 . 1 1 58 58 GLU C C 58 176.762 176.762 175.104 1.658 25085
5715 1 10 . 1 1 58 58 GLU CA C 58 59.634 59.634 56.534 3.100 25085
5716 1 10 . 1 1 58 58 GLU CB C 58 29.931 29.931 31.547 -1.615 25085
5717 1 10 . 1 1 58 58 GLU H H 58 7.626 7.626 8.616 -0.990 25085
5718 1 10 . 1 1 59 59 GLN N N 59 118.110 118.110 118.081 0.029 25085
5719 1 10 . 1 1 59 59 GLN HA H 59 5.479 5.479 5.162 0.317 25085
5720 1 10 . 1 1 59 59 GLN C C 59 174.322 174.322 175.377 -1.055 25085
5721 1 10 . 1 1 59 59 GLN CA C 59 55.486 55.486 55.421 0.065 25085
5722 1 10 . 1 1 59 59 GLN CB C 59 33.151 33.151 31.030 2.121 25085
5723 1 10 . 1 1 59 59 GLN H H 59 8.560 8.560 8.025 0.535 25085
5724 1 10 . 1 1 60 60 ILE N N 60 122.789 122.789 122.584 0.205 25085
5725 1 10 . 1 1 60 60 ILE HA H 60 4.531 4.531 4.700 -0.169 25085
5726 1 10 . 1 1 60 60 ILE C C 60 173.352 173.352 174.704 -1.352 25085
5727 1 10 . 1 1 60 60 ILE CA C 60 59.794 59.794 60.216 -0.422 25085
5728 1 10 . 1 1 60 60 ILE CB C 60 43.188 43.188 41.524 1.664 25085
5729 1 10 . 1 1 60 60 ILE H H 60 8.735 8.735 8.333 0.402 25085
5730 1 10 . 1 1 61 61 ILE N N 61 125.871 125.871 120.841 5.030 25085
5731 1 10 . 1 1 61 61 ILE HA H 61 5.002 5.002 4.692 0.310 25085
5732 1 10 . 1 1 61 61 ILE C C 61 175.195 175.195 174.252 0.943 25085
5733 1 10 . 1 1 61 61 ILE CA C 61 58.419 58.419 60.210 -1.791 25085
5734 1 10 . 1 1 61 61 ILE CB C 61 40.270 40.270 41.703 -1.433 25085
5735 1 10 . 1 1 61 61 ILE H H 61 9.057 9.057 8.961 0.096 25085
5736 1 10 . 1 1 62 62 PHE N N 62 123.742 123.742 124.640 -0.898 25085
5737 1 10 . 1 1 62 62 PHE HA H 62 5.810 5.810 5.662 0.148 25085
5738 1 10 . 1 1 62 62 PHE C C 62 176.135 176.135 175.026 1.109 25085
5739 1 10 . 1 1 62 62 PHE CA C 62 56.960 56.960 56.171 0.789 25085
5740 1 10 . 1 1 62 62 PHE CB C 62 43.352 43.352 42.315 1.037 25085
5741 1 10 . 1 1 62 62 PHE H H 62 8.977 8.977 8.663 0.314 25085
5742 1 10 . 1 1 63 63 HIS N N 63 116.939 116.939 118.037 -1.098 25085
5743 1 10 . 1 1 63 63 HIS HA H 63 5.979 5.979 5.191 0.788 25085
5744 1 10 . 1 1 63 63 HIS C C 63 171.108 171.108 173.460 -2.352 25085
5745 1 10 . 1 1 63 63 HIS CA C 63 54.115 54.115 53.828 0.287 25085
5746 1 10 . 1 1 63 63 HIS CB C 63 36.861 36.861 32.265 4.596 25085
5747 1 10 . 1 1 63 63 HIS H H 63 9.298 9.298 8.951 0.347 25085
5748 1 10 . 1 1 64 64 CYS N N 64 119.251 119.251 122.533 -3.282 25085
5749 1 10 . 1 1 64 64 CYS HA H 64 5.044 5.044 4.889 0.155 25085
5750 1 10 . 1 1 64 64 CYS C C 64 177.438 177.438 175.325 2.113 25085
5751 1 10 . 1 1 64 64 CYS CA C 64 56.886 56.886 55.828 1.058 25085
5752 1 10 . 1 1 64 64 CYS CB C 64 29.425 29.425 31.582 -2.157 25085
5753 1 10 . 1 1 64 64 CYS H H 64 8.156 8.156 8.554 -0.398 25085
5754 1 10 . 1 1 65 65 GLN N N 65 125.627 125.627 125.121 0.506 25085
5755 1 10 . 1 1 65 65 GLN HA H 65 4.220 4.220 4.038 0.182 25085
5756 1 10 . 1 1 65 65 GLN C C 65 174.440 174.440 175.713 -1.273 25085
5757 1 10 . 1 1 65 65 GLN CA C 65 59.788 59.788 59.249 0.538 25085
5758 1 10 . 1 1 65 65 GLN CB C 65 29.370 29.370 28.438 0.932 25085
5759 1 10 . 1 1 65 65 GLN H H 65 8.937 8.937 9.102 -0.165 25085
5760 1 10 . 1 1 66 66 ALA N N 66 118.880 118.880 114.620 4.260 25085
5761 1 10 . 1 1 66 66 ALA HA H 66 5.115 5.115 4.819 0.296 25085
5762 1 10 . 1 1 66 66 ALA C C 66 177.625 177.625 176.385 1.240 25085
5763 1 10 . 1 1 66 66 ALA CA C 66 50.744 50.744 52.041 -1.297 25085
5764 1 10 . 1 1 66 66 ALA CB C 66 20.658 20.658 21.160 -0.501 25085
5765 1 10 . 1 1 66 66 ALA H H 66 9.024 9.024 7.498 1.526 25085
5766 1 10 . 1 1 67 67 GLY N N 67 112.878 112.878 105.169 7.709 25085
5767 1 10 . 1 1 67 67 GLY C C 67 174.810 174.810 176.260 -1.450 25085
5768 1 10 . 1 1 67 67 GLY CA C 67 45.642 45.642 45.434 0.208 25085
5769 1 10 . 1 1 67 67 GLY H H 67 8.845 8.845 7.676 1.169 25085
5770 1 10 . 1 1 68 68 LYS N N 68 120.133 120.133 121.933 -1.800 25085
5771 1 10 . 1 1 68 68 LYS HA H 68 4.158 4.158 3.909 0.249 25085
5772 1 10 . 1 1 68 68 LYS C C 68 177.939 177.939 178.506 -0.567 25085
5773 1 10 . 1 1 68 68 LYS CA C 68 58.811 58.811 59.093 -0.282 25085
5774 1 10 . 1 1 68 68 LYS CB C 68 32.796 32.796 32.022 0.774 25085
5775 1 10 . 1 1 68 68 LYS H H 68 7.936 7.936 8.522 -0.586 25085
5776 1 10 . 1 1 69 69 ARG N N 69 125.804 125.804 118.987 6.817 25085
5777 1 10 . 1 1 69 69 ARG HA H 69 4.217 4.217 4.167 0.050 25085
5778 1 10 . 1 1 69 69 ARG C C 69 180.944 180.944 178.606 2.338 25085
5779 1 10 . 1 1 69 69 ARG CA C 69 60.010 60.010 58.830 1.180 25085
5780 1 10 . 1 1 69 69 ARG CB C 69 30.974 30.974 29.815 1.159 25085
5781 1 10 . 1 1 69 69 ARG H H 69 8.981 8.981 8.058 0.923 25085
5782 1 10 . 1 1 70 70 THR N N 70 116.681 116.681 115.568 1.113 25085
5783 1 10 . 1 1 70 70 THR HA H 70 3.607 3.607 3.977 -0.370 25085
5784 1 10 . 1 1 70 70 THR C C 70 176.434 176.434 176.311 0.123 25085
5785 1 10 . 1 1 70 70 THR CA C 70 65.914 65.914 66.737 -0.823 25085
5786 1 10 . 1 1 70 70 THR CB C 70 68.169 68.169 68.531 -0.362 25085
5787 1 10 . 1 1 70 70 THR H H 70 10.382 10.382 8.555 1.827 25085
5788 1 10 . 1 1 71 71 SER N N 71 113.046 113.046 116.500 -3.454 25085
5789 1 10 . 1 1 71 71 SER HA H 71 3.993 3.993 4.339 -0.346 25085
5790 1 10 . 1 1 71 71 SER C C 71 177.594 177.594 175.875 1.719 25085
5791 1 10 . 1 1 71 71 SER CA C 71 62.500 62.500 60.722 1.778 25085
5792 1 10 . 1 1 71 71 SER H H 71 7.346 7.346 7.856 -0.510 25085
5793 1 10 . 1 1 72 72 ASN N N 72 117.540 117.540 119.085 -1.545 25085
5794 1 10 . 1 1 72 72 ASN HA H 72 4.598 4.598 4.673 -0.075 25085
5795 1 10 . 1 1 72 72 ASN C C 72 175.595 175.595 176.523 -0.928 25085
5796 1 10 . 1 1 72 72 ASN CA C 72 55.147 55.147 55.358 -0.211 25085
5797 1 10 . 1 1 72 72 ASN CB C 72 38.821 38.821 39.057 -0.236 25085
5798 1 10 . 1 1 72 72 ASN H H 72 8.078 8.078 7.953 0.125 25085
5799 1 10 . 1 1 73 73 ASN N N 73 114.869 114.869 117.180 -2.311 25085
5800 1 10 . 1 1 73 73 ASN HA H 73 5.159 5.159 4.698 0.461 25085
5801 1 10 . 1 1 73 73 ASN C C 73 174.375 174.375 175.705 -1.330 25085
5802 1 10 . 1 1 73 73 ASN CA C 73 52.976 52.976 53.877 -0.901 25085
5803 1 10 . 1 1 73 73 ASN CB C 73 39.862 39.862 39.160 0.702 25085
5804 1 10 . 1 1 73 73 ASN H H 73 7.290 7.290 8.631 -1.341 25085
5805 1 10 . 1 1 74 74 ALA N N 74 124.647 124.647 122.381 2.266 25085
5806 1 10 . 1 1 74 74 ALA HA H 74 3.721 3.721 3.715 0.006 25085
5807 1 10 . 1 1 74 74 ALA C C 74 177.908 177.908 178.155 -0.247 25085
5808 1 10 . 1 1 74 74 ALA CA C 74 57.085 57.085 55.459 1.626 25085
5809 1 10 . 1 1 74 74 ALA CB C 74 19.427 19.427 18.307 1.120 25085
5810 1 10 . 1 1 74 74 ALA H H 74 7.105 7.105 7.790 -0.685 25085
5811 1 10 . 1 1 75 75 ASP N N 75 114.917 114.917 115.437 -0.520 25085
5812 1 10 . 1 1 75 75 ASP HA H 75 4.250 4.250 4.367 -0.117 25085
5813 1 10 . 1 1 75 75 ASP C C 75 179.100 179.100 177.791 1.309 25085
5814 1 10 . 1 1 75 75 ASP CA C 75 57.236 57.236 56.522 0.714 25085
5815 1 10 . 1 1 75 75 ASP CB C 75 39.783 39.783 40.116 -0.333 25085
5816 1 10 . 1 1 75 75 ASP H H 75 8.403 8.403 8.412 -0.009 25085
5817 1 10 . 1 1 76 76 LYS N N 76 121.888 121.888 118.738 3.150 25085
5818 1 10 . 1 1 76 76 LYS HA H 76 4.053 4.053 4.312 -0.259 25085
5819 1 10 . 1 1 76 76 LYS C C 76 178.832 178.832 178.666 0.166 25085
5820 1 10 . 1 1 76 76 LYS CA C 76 58.864 58.864 56.611 2.253 25085
5821 1 10 . 1 1 76 76 LYS CB C 76 32.423 32.423 32.448 -0.025 25085
5822 1 10 . 1 1 76 76 LYS H H 76 7.652 7.652 7.869 -0.217 25085
5823 1 10 . 1 1 77 77 LEU N N 77 118.644 118.644 120.870 -2.226 25085
5824 1 10 . 1 1 77 77 LEU HA H 77 3.557 3.557 4.021 -0.464 25085
5825 1 10 . 1 1 77 77 LEU C C 77 178.068 178.068 178.280 -0.212 25085
5826 1 10 . 1 1 77 77 LEU CA C 77 57.692 57.692 57.432 0.260 25085
5827 1 10 . 1 1 77 77 LEU CB C 77 40.077 40.077 41.260 -1.183 25085
5828 1 10 . 1 1 77 77 LEU H H 77 8.146 8.146 7.747 0.399 25085
5829 1 10 . 1 1 78 78 ALA N N 78 119.668 119.668 120.827 -1.159 25085
5830 1 10 . 1 1 78 78 ALA HA H 78 3.990 3.990 3.840 0.150 25085
5831 1 10 . 1 1 78 78 ALA C C 78 179.542 179.542 178.086 1.456 25085
5832 1 10 . 1 1 78 78 ALA CA C 78 54.937 54.937 54.788 0.148 25085
5833 1 10 . 1 1 78 78 ALA CB C 78 18.080 18.080 18.312 -0.232 25085
5834 1 10 . 1 1 78 78 ALA H H 78 8.136 8.136 7.893 0.243 25085
5835 1 10 . 1 1 79 79 ALA N N 79 118.918 118.918 118.885 0.033 25085
5836 1 10 . 1 1 79 79 ALA HA H 79 4.139 4.139 4.166 -0.027 25085
5837 1 10 . 1 1 79 79 ALA C C 79 180.800 180.800 180.062 0.738 25085
5838 1 10 . 1 1 79 79 ALA CA C 79 54.571 54.571 54.117 0.454 25085
5839 1 10 . 1 1 79 79 ALA CB C 79 18.268 18.268 18.590 -0.323 25085
5840 1 10 . 1 1 79 79 ALA H H 79 7.319 7.319 7.921 -0.602 25085
5841 1 10 . 1 1 80 80 ILE N N 80 118.438 118.438 119.285 -0.847 25085
5842 1 10 . 1 1 80 80 ILE HA H 80 3.801 3.801 3.918 -0.117 25085
5843 1 10 . 1 1 80 80 ILE C C 80 177.302 177.302 176.917 0.385 25085
5844 1 10 . 1 1 80 80 ILE CA C 80 64.252 64.252 63.202 1.050 25085
5845 1 10 . 1 1 80 80 ILE CB C 80 39.115 39.115 38.172 0.944 25085
5846 1 10 . 1 1 80 80 ILE H H 80 8.227 8.227 7.743 0.484 25085
5847 1 10 . 1 1 81 81 ALA N N 81 117.917 117.917 119.475 -1.558 25085
5848 1 10 . 1 1 81 81 ALA HA H 81 4.466 4.466 4.480 -0.014 25085
5849 1 10 . 1 1 81 81 ALA C C 81 176.153 176.153 176.474 -0.321 25085
5850 1 10 . 1 1 81 81 ALA CA C 81 51.404 51.404 50.829 0.575 25085
5851 1 10 . 1 1 81 81 ALA CB C 81 20.200 20.200 18.881 1.319 25085
5852 1 10 . 1 1 81 81 ALA H H 81 7.913 7.913 8.566 -0.653 25085
5853 1 10 . 1 1 82 82 ALA N N 82 124.086 124.086 122.410 1.676 25085
5854 1 10 . 1 1 82 82 ALA HA H 82 4.457 4.457 4.073 0.384 25085
5855 1 10 . 1 1 82 82 ALA CA C 82 52.276 52.276 52.764 -0.488 25085
5856 1 10 . 1 1 82 82 ALA CB C 82 17.243 17.243 16.656 0.587 25085
5857 1 10 . 1 1 82 82 ALA H H 82 7.223 7.223 7.233 -0.010 25085
5858 1 10 . 1 1 83 83 PRO HA H 83 4.692 4.692 4.291 0.401 25085
5859 1 10 . 1 1 83 83 PRO C C 83 175.169 175.169 175.757 -0.588 25085
5860 1 10 . 1 1 83 83 PRO CA C 83 63.767 63.767 63.205 0.562 25085
5861 1 10 . 1 1 83 83 PRO CB C 83 32.624 32.624 30.617 2.007 25085
5862 1 10 . 1 1 84 84 ALA N N 84 127.741 127.741 121.610 6.131 25085
5863 1 10 . 1 1 84 84 ALA HA H 84 4.138 4.138 4.194 -0.057 25085
5864 1 10 . 1 1 84 84 ALA C C 84 176.494 176.494 177.093 -0.599 25085
5865 1 10 . 1 1 84 84 ALA CA C 84 53.432 53.432 51.641 1.792 25085
5866 1 10 . 1 1 84 84 ALA CB C 84 19.719 19.719 20.107 -0.388 25085
5867 1 10 . 1 1 84 84 ALA H H 84 8.528 8.528 7.691 0.837 25085
5868 1 10 . 1 1 85 85 GLU N N 85 121.634 121.634 119.284 2.350 25085
5869 1 10 . 1 1 85 85 GLU HA H 85 4.228 4.228 4.267 -0.039 25085
5870 1 10 . 1 1 85 85 GLU C C 85 175.094 175.094 175.138 -0.044 25085
5871 1 10 . 1 1 85 85 GLU CA C 85 56.444 56.444 56.172 0.272 25085
5872 1 10 . 1 1 85 85 GLU CB C 85 30.803 30.803 29.739 1.064 25085
5873 1 10 . 1 1 85 85 GLU H H 85 8.166 8.166 8.282 -0.116 25085
5874 1 10 . 1 1 86 86 ILE N N 86 122.543 122.543 123.286 -0.743 25085
5875 1 10 . 1 1 86 86 ILE HA H 86 5.269 5.269 4.806 0.463 25085
5876 1 10 . 1 1 86 86 ILE C C 86 174.463 174.463 174.580 -0.117 25085
5877 1 10 . 1 1 86 86 ILE CA C 86 59.329 59.329 59.869 -0.540 25085
5878 1 10 . 1 1 86 86 ILE CB C 86 40.546 40.546 40.283 0.263 25085
5879 1 10 . 1 1 86 86 ILE H H 86 7.925 7.925 7.456 0.469 25085
5880 1 10 . 1 1 87 87 PHE N N 87 122.457 122.457 123.065 -0.608 25085
5881 1 10 . 1 1 87 87 PHE HA H 87 5.428 5.428 5.831 -0.403 25085
5882 1 10 . 1 1 87 87 PHE C C 87 174.450 174.450 175.281 -0.831 25085
5883 1 10 . 1 1 87 87 PHE CA C 87 55.029 55.029 55.564 -0.535 25085
5884 1 10 . 1 1 87 87 PHE CB C 87 43.626 43.626 43.154 0.472 25085
5885 1 10 . 1 1 87 87 PHE H H 87 9.050 9.050 8.268 0.782 25085
5886 1 10 . 1 1 88 88 LEU N N 88 119.959 119.959 118.573 1.386 25085
5887 1 10 . 1 1 88 88 LEU HA H 88 5.358 5.358 4.877 0.481 25085
5888 1 10 . 1 1 88 88 LEU C C 88 176.627 176.627 175.470 1.157 25085
5889 1 10 . 1 1 88 88 LEU CA C 88 52.654 52.654 53.815 -1.161 25085
5890 1 10 . 1 1 88 88 LEU CB C 88 43.094 43.094 45.766 -2.671 25085
5891 1 10 . 1 1 88 88 LEU H H 88 8.824 8.824 8.547 0.277 25085
5892 1 10 . 1 1 89 89 LEU N N 89 124.096 124.096 125.410 -1.314 25085
5893 1 10 . 1 1 89 89 LEU HA H 89 4.432 4.432 4.618 -0.186 25085
5894 1 10 . 1 1 89 89 LEU C C 89 176.693 176.693 176.192 0.501 25085
5895 1 10 . 1 1 89 89 LEU CA C 89 55.385 55.385 53.602 1.783 25085
5896 1 10 . 1 1 89 89 LEU CB C 89 43.537 43.537 40.859 2.678 25085
5897 1 10 . 1 1 89 89 LEU H H 89 8.293 8.293 8.365 -0.072 25085
5898 1 10 . 1 1 90 90 GLU N N 90 102.942 102.942 128.534 -25.592 25085
5899 1 10 . 1 1 90 90 GLU HA H 90 3.895 3.895 4.069 -0.174 25085
5900 1 10 . 1 1 90 90 GLU C C 90 175.199 175.199 176.315 -1.116 25085
5901 1 10 . 1 1 90 90 GLU CA C 90 58.586 58.586 58.371 0.215 25085
5902 1 10 . 1 1 90 90 GLU CB C 90 30.831 30.831 30.161 0.670 25085
5903 1 10 . 1 1 90 90 GLU H H 90 9.394 9.394 8.080 1.314 25085
5904 1 10 . 1 1 91 91 ASP N N 91 120.515 120.515 122.453 -1.938 25085
5905 1 10 . 1 1 91 91 ASP HA H 91 4.184 4.184 4.430 -0.246 25085
5906 1 10 . 1 1 91 91 ASP C C 91 176.159 176.159 175.886 0.273 25085
5907 1 10 . 1 1 91 91 ASP CA C 91 55.814 55.814 55.641 0.173 25085
5908 1 10 . 1 1 91 91 ASP CB C 91 39.033 39.033 40.839 -1.806 25085
5909 1 10 . 1 1 91 91 ASP H H 91 9.210 9.210 8.541 0.669 25085
5910 1 10 . 1 1 92 92 GLY N N 92 104.313 104.313 106.675 -2.362 25085
5911 1 10 . 1 1 92 92 GLY C C 92 172.980 172.980 174.792 -1.812 25085
5912 1 10 . 1 1 92 92 GLY CA C 92 46.946 46.946 44.896 2.050 25085
5913 1 10 . 1 1 92 92 GLY H H 92 7.902 7.902 7.793 0.109 25085
5914 1 10 . 1 1 93 93 ILE N N 93 121.445 121.445 122.962 -1.517 25085
5915 1 10 . 1 1 93 93 ILE HA H 93 3.902 3.902 3.906 -0.004 25085
5916 1 10 . 1 1 93 93 ILE C C 93 176.528 176.528 176.738 -0.210 25085
5917 1 10 . 1 1 93 93 ILE CA C 93 63.908 63.908 63.758 0.150 25085
5918 1 10 . 1 1 93 93 ILE CB C 93 38.416 38.416 38.028 0.389 25085
5919 1 10 . 1 1 93 93 ILE H H 93 8.129 8.129 8.131 -0.002 25085
5920 1 10 . 1 1 94 94 ASP N N 94 126.304 126.304 120.321 5.983 25085
5921 1 10 . 1 1 94 94 ASP HA H 94 4.436 4.436 4.328 0.108 25085
5922 1 10 . 1 1 94 94 ASP C C 94 180.174 180.174 178.559 1.615 25085
5923 1 10 . 1 1 94 94 ASP CA C 94 58.351 58.351 59.203 -0.852 25085
5924 1 10 . 1 1 94 94 ASP CB C 94 39.223 39.223 40.282 -1.059 25085
5925 1 10 . 1 1 94 94 ASP H H 94 9.161 9.161 8.008 1.153 25085
5926 1 10 . 1 1 95 95 GLY N N 95 110.690 110.690 107.404 3.286 25085
5927 1 10 . 1 1 95 95 GLY C C 95 176.108 176.108 175.972 0.136 25085
5928 1 10 . 1 1 95 95 GLY CA C 95 46.873 46.873 46.661 0.212 25085
5929 1 10 . 1 1 95 95 GLY H H 95 8.080 8.080 7.889 0.191 25085
5930 1 10 . 1 1 96 96 TRP N N 96 126.965 126.965 123.014 3.951 25085
5931 1 10 . 1 1 96 96 TRP HA H 96 3.795 3.795 4.251 -0.456 25085
5932 1 10 . 1 1 96 96 TRP C C 96 177.058 177.058 177.183 -0.125 25085
5933 1 10 . 1 1 96 96 TRP CA C 96 61.633 61.633 60.512 1.121 25085
5934 1 10 . 1 1 96 96 TRP CB C 96 29.512 29.512 29.364 0.148 25085
5935 1 10 . 1 1 96 96 TRP H H 96 8.007 8.007 7.625 0.382 25085
5936 1 10 . 1 1 97 97 LYS N N 97 116.604 116.604 117.922 -1.318 25085
5937 1 10 . 1 1 97 97 LYS HA H 97 4.090 4.090 4.254 -0.164 25085
5938 1 10 . 1 1 97 97 LYS C C 97 182.010 182.010 179.834 2.176 25085
5939 1 10 . 1 1 97 97 LYS CA C 97 59.776 59.776 59.085 0.691 25085
5940 1 10 . 1 1 97 97 LYS CB C 97 32.208 32.208 32.296 -0.088 25085
5941 1 10 . 1 1 97 97 LYS H H 97 8.696 8.696 8.222 0.474 25085
5942 1 10 . 1 1 98 98 ARG N N 98 122.491 122.491 120.559 1.932 25085
5943 1 10 . 1 1 98 98 ARG HA H 98 4.050 4.050 4.096 -0.046 25085
5944 1 10 . 1 1 98 98 ARG C C 98 177.666 177.666 177.595 0.071 25085
5945 1 10 . 1 1 98 98 ARG CA C 98 59.509 59.509 58.798 0.711 25085
5946 1 10 . 1 1 98 98 ARG CB C 98 30.471 30.471 30.137 0.334 25085
5947 1 10 . 1 1 98 98 ARG H H 98 8.280 8.280 8.362 -0.082 25085
5948 1 10 . 1 1 99 99 ALA N N 99 119.546 119.546 118.207 1.339 25085
5949 1 10 . 1 1 99 99 ALA HA H 99 4.276 4.276 4.512 -0.236 25085
5950 1 10 . 1 1 99 99 ALA C C 99 176.800 176.800 176.725 0.075 25085
5951 1 10 . 1 1 99 99 ALA CA C 99 52.254 52.254 51.988 0.266 25085
5952 1 10 . 1 1 99 99 ALA CB C 99 18.270 18.270 19.995 -1.725 25085
5953 1 10 . 1 1 99 99 ALA H H 99 7.519 7.519 7.660 -0.141 25085
5954 1 10 . 1 1 100 100 GLY N N 100 106.339 106.339 108.058 -1.719 25085
5955 1 10 . 1 1 100 100 GLY C C 100 174.232 174.232 173.429 0.803 25085
5956 1 10 . 1 1 100 100 GLY CA C 100 45.050 45.050 45.277 -0.227 25085
5957 1 10 . 1 1 100 100 GLY H H 100 7.926 7.926 7.776 0.150 25085
5958 1 10 . 1 1 101 101 LEU N N 101 122.181 122.181 122.378 -0.197 25085
5959 1 10 . 1 1 101 101 LEU HA H 101 4.286 4.286 4.533 -0.247 25085
5960 1 10 . 1 1 101 101 LEU CA C 101 53.183 53.183 50.869 2.314 25085
5961 1 10 . 1 1 101 101 LEU CB C 101 37.320 37.320 43.014 -5.694 25085
5962 1 10 . 1 1 101 101 LEU H H 101 6.976 6.976 7.597 -0.621 25085
5963 1 10 . 1 1 102 102 PRO HA H 102 4.476 4.476 4.309 0.167 25085
5964 1 10 . 1 1 102 102 PRO C C 102 177.424 177.424 175.996 1.428 25085
5965 1 10 . 1 1 102 102 PRO CA C 102 64.014 64.014 64.547 -0.533 25085
5966 1 10 . 1 1 102 102 PRO CB C 102 33.200 33.200 31.704 1.496 25085
5967 1 10 . 1 1 103 103 VAL N N 103 110.512 110.512 122.109 -11.597 25085
5968 1 10 . 1 1 103 103 VAL HA H 103 4.643 4.643 4.091 0.552 25085
5969 1 10 . 1 1 103 103 VAL C C 103 174.297 174.297 173.983 0.314 25085
5970 1 10 . 1 1 103 103 VAL CA C 103 59.693 59.693 59.926 -0.233 25085
5971 1 10 . 1 1 103 103 VAL CB C 103 35.980 35.980 35.991 -0.011 25085
5972 1 10 . 1 1 103 103 VAL H H 103 8.073 8.073 7.969 0.104 25085
5973 1 10 . 1 1 104 104 ALA N N 104 125.898 125.898 129.433 -3.535 25085
5974 1 10 . 1 1 104 104 ALA HA H 104 4.550 4.550 4.707 -0.157 25085
5975 1 10 . 1 1 104 104 ALA C C 104 176.190 176.190 174.701 1.489 25085
5976 1 10 . 1 1 104 104 ALA CA C 104 50.699 50.699 50.885 -0.186 25085
5977 1 10 . 1 1 104 104 ALA CB C 104 19.534 19.534 21.725 -2.191 25085
5978 1 10 . 1 1 104 104 ALA H H 104 8.996 8.996 8.713 0.283 25085
5979 1 10 . 1 1 105 105 VAL N N 105 119.534 119.534 122.973 -3.439 25085
5980 1 10 . 1 1 105 105 VAL HA H 105 4.615 4.615 4.010 0.605 25085
5981 1 10 . 1 1 105 105 VAL C C 105 175.576 175.576 175.164 0.412 25085
5982 1 10 . 1 1 105 105 VAL CA C 105 60.234 60.234 61.303 -1.069 25085
5983 1 10 . 1 1 105 105 VAL CB C 105 34.683 34.683 33.324 1.359 25085
5984 1 10 . 1 1 105 105 VAL H H 105 8.276 8.276 8.335 -0.059 25085
5985 1 10 . 1 1 106 106 ASN N N 106 123.346 123.346 126.034 -2.688 25085
5986 1 10 . 1 1 106 106 ASN HA H 106 4.748 4.748 4.917 -0.169 25085
5987 1 10 . 1 1 106 106 ASN C C 106 173.877 173.877 174.037 -0.160 25085
5988 1 10 . 1 1 106 106 ASN CA C 106 53.465 53.465 53.605 -0.140 25085
5989 1 10 . 1 1 106 106 ASN CB C 106 39.424 39.424 38.895 0.528 25085
5990 1 10 . 1 1 106 106 ASN H H 106 8.190 8.190 8.373 -0.183 25085
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 99 3.937 0.193 3.953 25085
2 1 1 "Average Difference" HA 111 0.318 0.009 0.319 25085
3 1 1 "Average Difference" C 99 1.320 -0.152 1.318 25085
4 1 1 "Average Difference" CA 105 1.044 -0.337 0.993 25085
5 1 1 "Average Difference" CB 98 1.305 -0.035 1.312 25085
6 1 1 "Average Difference" HN 99 0.701 -0.100 0.698 25085
7 1 2 "Average Difference" N 99 4.025 0.137 4.043 25085
8 1 2 "Average Difference" HA 111 0.343 -0.003 0.344 25085
9 1 2 "Average Difference" C 99 1.347 -0.084 1.351 25085
10 1 2 "Average Difference" CA 105 1.121 -0.311 1.082 25085
11 1 2 "Average Difference" CB 98 1.402 -0.117 1.404 25085
12 1 2 "Average Difference" HN 99 0.679 -0.097 0.675 25085
13 1 3 "Average Difference" N 99 3.915 -0.010 3.935 25085
14 1 3 "Average Difference" HA 111 0.316 0.020 0.317 25085
15 1 3 "Average Difference" C 99 1.314 -0.117 1.316 25085
16 1 3 "Average Difference" CA 105 1.052 -0.281 1.019 25085
17 1 3 "Average Difference" CB 98 1.361 -0.007 1.368 25085
18 1 3 "Average Difference" HN 99 0.649 -0.079 0.647 25085
19 1 4 "Average Difference" N 99 4.042 -0.119 4.061 25085
20 1 4 "Average Difference" HA 111 0.331 0.003 0.333 25085
21 1 4 "Average Difference" C 99 1.240 -0.068 1.245 25085
22 1 4 "Average Difference" CA 105 1.077 -0.259 1.051 25085
23 1 4 "Average Difference" CB 98 1.302 -0.019 1.308 25085
24 1 4 "Average Difference" HN 99 0.682 -0.095 0.679 25085
25 1 5 "Average Difference" N 99 3.955 0.282 3.965 25085
26 1 5 "Average Difference" HA 111 0.323 0.005 0.324 25085
27 1 5 "Average Difference" C 99 1.306 -0.064 1.311 25085
28 1 5 "Average Difference" CA 105 1.110 -0.338 1.062 25085
29 1 5 "Average Difference" CB 98 1.359 -0.114 1.361 25085
30 1 5 "Average Difference" HN 99 0.710 -0.110 0.705 25085
31 1 6 "Average Difference" N 99 4.199 -0.055 4.220 25085
32 1 6 "Average Difference" HA 111 0.317 0.032 0.317 25085
33 1 6 "Average Difference" C 99 1.257 -0.077 1.261 25085
34 1 6 "Average Difference" CA 105 1.144 -0.262 1.120 25085
35 1 6 "Average Difference" CB 98 1.330 0.033 1.337 25085
36 1 6 "Average Difference" HN 99 0.655 -0.080 0.654 25085
37 1 7 "Average Difference" N 99 4.098 0.016 4.119 25085
38 1 7 "Average Difference" HA 111 0.331 0.013 0.332 25085
39 1 7 "Average Difference" C 99 1.306 -0.110 1.308 25085
40 1 7 "Average Difference" CA 105 1.107 -0.341 1.058 25085
41 1 7 "Average Difference" CB 98 1.269 -0.013 1.276 25085
42 1 7 "Average Difference" HN 99 0.648 -0.090 0.645 25085
43 1 8 "Average Difference" N 99 4.067 0.032 4.087 25085
44 1 8 "Average Difference" HA 111 0.335 0.009 0.336 25085
45 1 8 "Average Difference" C 99 1.325 -0.117 1.327 25085
46 1 8 "Average Difference" CA 105 1.166 -0.337 1.122 25085
47 1 8 "Average Difference" CB 98 1.453 -0.116 1.456 25085
48 1 8 "Average Difference" HN 99 0.687 -0.104 0.682 25085
49 1 9 "Average Difference" N 99 3.992 -0.021 4.012 25085
50 1 9 "Average Difference" HA 111 0.342 0.026 0.343 25085
51 1 9 "Average Difference" C 99 1.361 -0.053 1.367 25085
52 1 9 "Average Difference" CA 105 1.120 -0.270 1.093 25085
53 1 9 "Average Difference" CB 98 1.302 -0.098 1.305 25085
54 1 9 "Average Difference" HN 99 0.672 -0.079 0.670 25085
55 1 10 "Average Difference" N 99 4.209 0.107 4.229 25085
56 1 10 "Average Difference" HA 111 0.336 0.021 0.337 25085
57 1 10 "Average Difference" C 99 1.286 -0.193 1.278 25085
58 1 10 "Average Difference" CA 105 1.098 -0.371 1.039 25085
59 1 10 "Average Difference" CB 98 1.354 0.059 1.360 25085
60 1 10 "Average Difference" HN 99 0.651 -0.061 0.652 25085
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 25085
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 ALA N N 2 125.104 125.104 124.357 0.747 25085
2 1 . 1 1 2 2 ALA HA H 2 4.287 4.287 4.507 -0.220 25085
3 1 . 1 1 2 2 ALA C C 2 176.800 176.800 176.590 0.210 25085
4 1 . 1 1 2 2 ALA CA C 2 52.429 52.429 51.993 0.436 25085
5 1 . 1 1 2 2 ALA CB C 2 19.407 19.407 19.036 0.371 25085
6 1 . 1 1 2 2 ALA H H 2 8.344 8.344 8.220 0.124 25085
7 1 . 1 1 3 3 LEU N N 3 120.515 120.515 117.838 2.677 25085
8 1 . 1 1 3 3 LEU HA H 3 4.452 4.452 4.720 -0.268 25085
9 1 . 1 1 3 3 LEU C C 3 176.497 176.497 176.390 0.107 25085
10 1 . 1 1 3 3 LEU CA C 3 54.698 54.698 54.827 -0.129 25085
11 1 . 1 1 3 3 LEU CB C 3 43.203 43.203 41.822 1.381 25085
12 1 . 1 1 3 3 LEU H H 3 8.070 8.070 7.581 0.489 25085
13 1 . 1 1 4 4 THR N N 4 117.803 117.803 119.905 -2.102 25085
14 1 . 1 1 4 4 THR HA H 4 4.480 4.480 4.745 -0.265 25085
15 1 . 1 1 4 4 THR C C 4 173.872 173.872 173.968 -0.096 25085
16 1 . 1 1 4 4 THR CA C 4 62.247 62.247 61.236 1.011 25085
17 1 . 1 1 4 4 THR CB C 4 70.533 70.533 71.592 -1.059 25085
18 1 . 1 1 4 4 THR H H 4 7.954 7.954 8.397 -0.444 25085
19 1 . 1 1 5 5 THR N N 5 121.501 121.501 115.678 5.823 25085
20 1 . 1 1 5 5 THR HA H 5 5.289 5.289 4.603 0.686 25085
21 1 . 1 1 5 5 THR C C 5 174.162 174.162 173.786 0.376 25085
22 1 . 1 1 5 5 THR CA C 5 62.102 62.102 62.030 0.072 25085
23 1 . 1 1 5 5 THR CB C 5 69.457 69.457 69.741 -0.284 25085
24 1 . 1 1 5 5 THR H H 5 8.640 8.640 8.467 0.173 25085
25 1 . 1 1 6 6 ILE N N 6 122.023 122.023 122.978 -0.955 25085
26 1 . 1 1 6 6 ILE HA H 6 4.988 4.988 4.522 0.466 25085
27 1 . 1 1 6 6 ILE C C 6 173.377 173.377 173.886 -0.509 25085
28 1 . 1 1 6 6 ILE CA C 6 58.611 58.611 59.742 -1.131 25085
29 1 . 1 1 6 6 ILE CB C 6 42.821 42.821 42.613 0.208 25085
30 1 . 1 1 6 6 ILE H H 6 8.977 8.977 9.197 -0.220 25085
31 1 . 1 1 7 7 SER N N 7 122.659 122.659 118.632 4.027 25085
32 1 . 1 1 7 7 SER HA H 7 4.768 4.768 5.116 -0.348 25085
33 1 . 1 1 7 7 SER CA C 7 56.790 56.790 55.209 1.581 25085
34 1 . 1 1 7 7 SER CB C 7 63.235 63.235 63.874 -0.639 25085
35 1 . 1 1 7 7 SER H H 7 9.242 9.242 8.511 0.731 25085
36 1 . 1 1 8 8 PRO HA H 8 4.207 4.207 4.297 -0.090 25085
37 1 . 1 1 8 8 PRO C C 8 176.787 176.787 178.293 -1.506 25085
38 1 . 1 1 8 8 PRO CA C 8 66.443 66.443 65.424 1.019 25085
39 1 . 1 1 8 8 PRO CB C 8 32.724 32.724 31.823 0.901 25085
40 1 . 1 1 9 9 HIS N N 9 113.700 113.700 114.849 -1.149 25085
41 1 . 1 1 9 9 HIS HA H 9 3.990 3.990 4.339 -0.349 25085
42 1 . 1 1 9 9 HIS C C 9 178.123 178.123 177.361 0.763 25085
43 1 . 1 1 9 9 HIS CA C 9 60.827 60.827 59.120 1.707 25085
44 1 . 1 1 9 9 HIS CB C 9 29.552 29.552 29.815 -0.263 25085
45 1 . 1 1 9 9 HIS H H 9 8.172 8.172 8.157 0.015 25085
46 1 . 1 1 10 10 ASP N N 10 120.665 120.665 120.208 0.457 25085
47 1 . 1 1 10 10 ASP HA H 10 4.369 4.369 4.536 -0.167 25085
48 1 . 1 1 10 10 ASP C C 10 179.100 179.100 177.865 1.235 25085
49 1 . 1 1 10 10 ASP CA C 10 57.071 57.071 57.084 -0.013 25085
50 1 . 1 1 10 10 ASP CB C 10 39.529 39.529 41.058 -1.529 25085
51 1 . 1 1 10 10 ASP H H 10 7.706 7.706 8.695 -0.989 25085
52 1 . 1 1 11 11 ALA N N 11 123.686 123.686 122.163 1.523 25085
53 1 . 1 1 11 11 ALA HA H 11 3.782 3.782 3.871 -0.089 25085
54 1 . 1 1 11 11 ALA C C 11 178.260 178.260 179.344 -1.084 25085
55 1 . 1 1 11 11 ALA CA C 11 55.142 55.142 55.206 -0.064 25085
56 1 . 1 1 11 11 ALA CB C 11 18.293 18.293 18.164 0.129 25085
57 1 . 1 1 11 11 ALA H H 11 8.896 8.896 7.634 1.262 25085
58 1 . 1 1 12 12 GLN N N 12 117.521 117.521 117.943 -0.422 25085
59 1 . 1 1 12 12 GLN HA H 12 4.000 4.000 4.112 -0.112 25085
60 1 . 1 1 12 12 GLN C C 12 178.499 178.499 178.299 0.200 25085
61 1 . 1 1 12 12 GLN CA C 12 60.102 60.102 59.137 0.965 25085
62 1 . 1 1 12 12 GLN CB C 12 28.743 28.743 28.390 0.353 25085
63 1 . 1 1 12 12 GLN H H 12 8.431 8.431 8.016 0.415 25085
64 1 . 1 1 13 13 GLU N N 13 118.578 118.578 118.949 -0.371 25085
65 1 . 1 1 13 13 GLU HA H 13 4.059 4.059 4.072 -0.013 25085
66 1 . 1 1 13 13 GLU C C 13 178.352 178.352 179.175 -0.823 25085
67 1 . 1 1 13 13 GLU CA C 13 59.079 59.079 58.913 0.166 25085
68 1 . 1 1 13 13 GLU CB C 13 29.213 29.213 29.382 -0.169 25085
69 1 . 1 1 13 13 GLU H H 13 7.234 7.234 7.901 -0.667 25085
70 1 . 1 1 14 14 LEU N N 14 119.848 119.848 119.630 0.218 25085
71 1 . 1 1 14 14 LEU HA H 14 3.891 3.891 4.093 -0.202 25085
72 1 . 1 1 14 14 LEU C C 14 180.773 180.773 178.964 1.809 25085
73 1 . 1 1 14 14 LEU CA C 14 57.958 57.958 57.402 0.556 25085
74 1 . 1 1 14 14 LEU CB C 14 41.715 41.715 41.900 -0.185 25085
75 1 . 1 1 14 14 LEU H H 14 7.582 7.582 7.845 -0.263 25085
76 1 . 1 1 15 15 ILE N N 15 122.392 122.392 118.122 4.270 25085
77 1 . 1 1 15 15 ILE HA H 15 3.924 3.924 3.661 0.263 25085
78 1 . 1 1 15 15 ILE C C 15 180.109 180.109 177.500 2.609 25085
79 1 . 1 1 15 15 ILE CA C 15 64.663 64.663 64.523 0.140 25085
80 1 . 1 1 15 15 ILE CB C 15 38.900 38.900 37.737 1.163 25085
81 1 . 1 1 15 15 ILE H H 15 8.772 8.772 8.263 0.509 25085
82 1 . 1 1 16 16 ALA N N 16 123.856 123.856 119.775 4.081 25085
83 1 . 1 1 16 16 ALA HA H 16 4.183 4.183 4.237 -0.054 25085
84 1 . 1 1 16 16 ALA C C 16 179.100 179.100 178.593 0.507 25085
85 1 . 1 1 16 16 ALA CA C 16 54.806 54.806 53.826 0.980 25085
86 1 . 1 1 16 16 ALA CB C 16 17.646 17.646 18.777 -1.131 25085
87 1 . 1 1 16 16 ALA H H 16 7.808 7.808 7.411 0.397 25085
88 1 . 1 1 17 17 ARG N N 17 115.329 115.329 118.328 -2.999 25085
89 1 . 1 1 17 17 ARG HA H 17 4.404 4.404 4.343 0.061 25085
90 1 . 1 1 17 17 ARG C C 17 176.446 176.446 177.238 -0.792 25085
91 1 . 1 1 17 17 ARG CA C 17 56.015 56.015 57.060 -1.045 25085
92 1 . 1 1 17 17 ARG CB C 17 30.676 30.676 31.496 -0.820 25085
93 1 . 1 1 17 17 ARG H H 17 7.280 7.280 8.405 -1.125 25085
94 1 . 1 1 18 18 GLY N N 18 107.395 107.395 104.886 2.509 25085
95 1 . 1 1 18 18 GLY C C 18 174.072 174.072 173.400 0.672 25085
96 1 . 1 1 18 18 GLY CA C 18 45.218 45.218 44.675 0.542 25085
97 1 . 1 1 18 18 GLY H H 18 7.795 7.795 8.267 -0.472 25085
98 1 . 1 1 19 19 ALA N N 19 123.197 123.197 123.268 -0.071 25085
99 1 . 1 1 19 19 ALA HA H 19 4.217 4.217 4.125 0.092 25085
100 1 . 1 1 19 19 ALA C C 19 176.261 176.261 177.120 -0.859 25085
101 1 . 1 1 19 19 ALA CA C 19 52.674 52.674 52.687 -0.013 25085
102 1 . 1 1 19 19 ALA CB C 19 19.411 19.411 19.556 -0.145 25085
103 1 . 1 1 19 19 ALA H H 19 7.980 7.980 7.502 0.478 25085
104 1 . 1 1 20 20 LYS N N 20 118.629 118.629 121.885 -3.256 25085
105 1 . 1 1 20 20 LYS HA H 20 4.308 4.308 4.397 -0.089 25085
106 1 . 1 1 20 20 LYS C C 20 173.981 173.981 174.969 -0.988 25085
107 1 . 1 1 20 20 LYS CA C 20 53.820 53.820 55.113 -1.293 25085
108 1 . 1 1 20 20 LYS CB C 20 33.571 33.571 33.053 0.517 25085
109 1 . 1 1 20 20 LYS H H 20 7.589 7.589 7.989 -0.400 25085
110 1 . 1 1 21 21 LEU N N 21 126.686 126.686 126.384 0.302 25085
111 1 . 1 1 21 21 LEU HA H 21 5.154 5.154 4.722 0.432 25085
112 1 . 1 1 21 21 LEU C C 21 174.076 174.076 175.752 -1.676 25085
113 1 . 1 1 21 21 LEU CA C 21 53.262 53.262 54.663 -1.401 25085
114 1 . 1 1 21 21 LEU CB C 21 44.350 44.350 43.103 1.247 25085
115 1 . 1 1 21 21 LEU H H 21 8.812 8.812 8.629 0.183 25085
116 1 . 1 1 22 22 ILE N N 22 127.566 127.566 121.865 5.701 25085
117 1 . 1 1 22 22 ILE HA H 22 4.678 4.678 4.875 -0.196 25085
118 1 . 1 1 22 22 ILE C C 22 173.136 173.136 173.974 -0.838 25085
119 1 . 1 1 22 22 ILE CA C 22 60.160 60.160 59.376 0.784 25085
120 1 . 1 1 22 22 ILE CB C 22 39.842 39.842 41.540 -1.698 25085
121 1 . 1 1 22 22 ILE H H 22 9.416 9.416 8.905 0.512 25085
122 1 . 1 1 23 23 ASP N N 23 129.217 129.217 123.743 5.474 25085
123 1 . 1 1 23 23 ASP HA H 23 3.806 3.806 5.040 -1.234 25085
124 1 . 1 1 23 23 ASP C C 23 176.042 176.042 175.375 0.667 25085
125 1 . 1 1 23 23 ASP CA C 23 52.005 52.005 52.034 -0.029 25085
126 1 . 1 1 23 23 ASP CB C 23 42.984 42.984 43.571 -0.587 25085
127 1 . 1 1 23 23 ASP H H 23 8.619 8.619 8.516 0.103 25085
128 1 . 1 1 24 24 ILE N N 24 115.522 115.522 119.118 -3.596 25085
129 1 . 1 1 24 24 ILE HA H 24 5.255 5.255 4.858 0.397 25085
130 1 . 1 1 24 24 ILE C C 24 178.920 178.920 174.471 4.449 25085
131 1 . 1 1 24 24 ILE CA C 24 60.188 60.188 60.209 -0.021 25085
132 1 . 1 1 24 24 ILE CB C 24 38.015 38.015 38.771 -0.756 25085
133 1 . 1 1 24 24 ILE H H 24 7.877 7.877 7.671 0.206 25085
134 1 . 1 1 25 25 ARG N N 25 124.317 124.317 123.003 1.315 25085
135 1 . 1 1 25 25 ARG HA H 25 4.170 4.170 4.358 -0.188 25085
136 1 . 1 1 25 25 ARG C C 25 171.756 171.756 174.352 -2.596 25085
137 1 . 1 1 25 25 ARG CA C 25 56.547 56.547 55.487 1.060 25085
138 1 . 1 1 25 25 ARG CB C 25 30.897 30.897 31.161 -0.264 25085
139 1 . 1 1 25 25 ARG H H 25 8.235 8.235 7.863 0.372 25085
140 1 . 1 1 26 26 ASP N N 26 112.059 112.059 120.601 -8.542 25085
141 1 . 1 1 26 26 ASP HA H 26 4.609 4.609 4.884 -0.275 25085
142 1 . 1 1 26 26 ASP C C 26 177.934 177.934 176.880 1.054 25085
143 1 . 1 1 26 26 ASP CA C 26 54.398 54.398 53.317 1.081 25085
144 1 . 1 1 26 26 ASP CB C 26 42.029 42.029 41.658 0.371 25085
145 1 . 1 1 26 26 ASP H H 26 7.730 7.730 8.528 -0.798 25085
146 1 . 1 1 27 27 ALA N N 27 121.435 121.435 128.986 -7.551 25085
147 1 . 1 1 27 27 ALA HA H 27 3.959 3.959 3.924 0.035 25085
148 1 . 1 1 27 27 ALA C C 27 179.388 179.388 178.690 0.698 25085
149 1 . 1 1 27 27 ALA CA C 27 55.829 55.829 55.620 0.209 25085
150 1 . 1 1 27 27 ALA CB C 27 18.572 18.572 18.480 0.092 25085
151 1 . 1 1 27 27 ALA H H 27 8.797 8.797 8.856 -0.059 25085
152 1 . 1 1 28 28 ASP N N 28 114.759 114.759 117.928 -3.169 25085
153 1 . 1 1 28 28 ASP HA H 28 4.314 4.314 4.340 -0.026 25085
154 1 . 1 1 28 28 ASP C C 28 178.738 178.738 178.847 -0.109 25085
155 1 . 1 1 28 28 ASP CA C 28 56.997 56.997 57.506 -0.509 25085
156 1 . 1 1 28 28 ASP CB C 28 39.811 39.811 40.364 -0.553 25085
157 1 . 1 1 28 28 ASP H H 28 8.755 8.755 8.603 0.152 25085
158 1 . 1 1 29 29 GLU N N 29 119.562 119.562 118.523 1.039 25085
159 1 . 1 1 29 29 GLU HA H 29 4.116 4.116 4.246 -0.130 25085
160 1 . 1 1 29 29 GLU C C 29 178.473 178.473 178.726 -0.253 25085
161 1 . 1 1 29 29 GLU CA C 29 58.928 58.928 58.408 0.520 25085
162 1 . 1 1 29 29 GLU CB C 29 29.395 29.395 30.090 -0.695 25085
163 1 . 1 1 29 29 GLU H H 29 7.446 7.446 8.665 -1.219 25085
164 1 . 1 1 30 30 TYR N N 30 120.494 120.494 120.835 -0.341 25085
165 1 . 1 1 30 30 TYR HA H 30 4.092 4.092 4.571 -0.479 25085
166 1 . 1 1 30 30 TYR C C 30 176.988 176.988 177.812 -0.824 25085
167 1 . 1 1 30 30 TYR CA C 30 60.931 60.931 60.696 0.235 25085
168 1 . 1 1 30 30 TYR CB C 30 39.534 39.534 38.899 0.635 25085
169 1 . 1 1 30 30 TYR H H 30 7.545 7.545 7.681 -0.136 25085
170 1 . 1 1 31 31 LEU N N 31 118.227 118.227 119.687 -1.460 25085
171 1 . 1 1 31 31 LEU HA H 31 3.916 3.916 3.942 -0.026 25085
172 1 . 1 1 31 31 LEU C C 31 178.824 178.824 178.223 0.601 25085
173 1 . 1 1 31 31 LEU CA C 31 57.444 57.444 58.033 -0.589 25085
174 1 . 1 1 31 31 LEU CB C 31 41.941 41.941 42.104 -0.163 25085
175 1 . 1 1 31 31 LEU H H 31 8.235 8.235 8.866 -0.631 25085
176 1 . 1 1 32 32 ARG N N 32 117.334 117.334 115.880 1.454 25085
177 1 . 1 1 32 32 ARG HA H 32 4.112 4.112 4.092 0.020 25085
178 1 . 1 1 32 32 ARG C C 32 177.008 177.008 176.113 0.895 25085
179 1 . 1 1 32 32 ARG CA C 32 59.366 59.366 58.174 1.192 25085
180 1 . 1 1 32 32 ARG CB C 32 30.938 30.938 30.604 0.334 25085
181 1 . 1 1 32 32 ARG H H 32 7.133 7.133 7.582 -0.449 25085
182 1 . 1 1 33 33 GLU N N 33 117.282 117.282 117.612 -0.330 25085
183 1 . 1 1 33 33 GLU HA H 33 4.893 4.893 4.581 0.312 25085
184 1 . 1 1 33 33 GLU C C 33 173.503 173.503 173.720 -0.216 25085
185 1 . 1 1 33 33 GLU CA C 33 56.291 56.291 56.034 0.257 25085
186 1 . 1 1 33 33 GLU CB C 33 32.248 32.248 32.739 -0.491 25085
187 1 . 1 1 33 33 GLU H H 33 7.521 7.521 7.340 0.181 25085
188 1 . 1 1 34 34 HIS N N 34 117.828 117.828 119.969 -2.141 25085
189 1 . 1 1 34 34 HIS HA H 34 4.627 4.627 3.997 0.630 25085
190 1 . 1 1 34 34 HIS C C 34 171.950 171.950 172.907 -0.957 25085
191 1 . 1 1 34 34 HIS CA C 34 54.304 54.304 53.595 0.709 25085
192 1 . 1 1 34 34 HIS CB C 34 30.712 30.712 32.744 -2.032 25085
193 1 . 1 1 34 34 HIS H H 34 8.354 8.354 9.061 -0.707 25085
194 1 . 1 1 35 35 ILE N N 35 126.965 126.965 119.653 7.312 25085
195 1 . 1 1 35 35 ILE HA H 35 3.973 3.973 4.278 -0.305 25085
196 1 . 1 1 35 35 ILE CA C 35 60.500 60.500 57.793 2.708 25085
197 1 . 1 1 35 35 ILE CB C 35 38.822 38.822 38.414 0.407 25085
198 1 . 1 1 35 35 ILE H H 35 10.032 10.032 7.988 2.044 25085
199 1 . 1 1 36 36 PRO HA H 36 4.033 4.033 4.425 -0.392 25085
200 1 . 1 1 36 36 PRO C C 36 177.308 177.308 176.031 1.277 25085
201 1 . 1 1 36 36 PRO CA C 36 66.191 66.191 63.535 2.656 25085
202 1 . 1 1 36 36 PRO CB C 36 31.701 31.701 30.989 0.712 25085
203 1 . 1 1 37 37 GLU N N 37 113.735 113.735 117.014 -3.279 25085
204 1 . 1 1 37 37 GLU HA H 37 4.083 4.083 4.491 -0.408 25085
205 1 . 1 1 37 37 GLU C C 37 176.274 176.274 174.676 1.598 25085
206 1 . 1 1 37 37 GLU CA C 37 58.285 58.285 55.850 2.435 25085
207 1 . 1 1 37 37 GLU CB C 37 28.895 28.895 29.996 -1.101 25085
208 1 . 1 1 37 37 GLU H H 37 8.625 8.625 8.437 0.188 25085
209 1 . 1 1 38 38 ALA N N 38 122.325 122.325 121.245 1.080 25085
210 1 . 1 1 38 38 ALA HA H 38 4.484 4.484 4.688 -0.204 25085
211 1 . 1 1 38 38 ALA C C 38 178.043 178.043 175.331 2.713 25085
212 1 . 1 1 38 38 ALA CA C 38 52.385 52.385 51.198 1.187 25085
213 1 . 1 1 38 38 ALA CB C 38 21.151 21.151 21.887 -0.736 25085
214 1 . 1 1 38 38 ALA H H 38 8.160 8.160 7.519 0.641 25085
215 1 . 1 1 39 39 ASP N N 39 123.726 123.726 120.833 2.893 25085
216 1 . 1 1 39 39 ASP HA H 39 4.856 4.856 4.786 0.070 25085
217 1 . 1 1 39 39 ASP C C 39 174.077 174.077 175.084 -1.007 25085
218 1 . 1 1 39 39 ASP CA C 39 53.498 53.498 53.726 -0.228 25085
219 1 . 1 1 39 39 ASP CB C 39 45.176 45.176 42.948 2.228 25085
220 1 . 1 1 39 39 ASP H H 39 9.095 9.095 8.747 0.348 25085
221 1 . 1 1 40 40 LEU N N 40 123.111 123.111 124.551 -1.440 25085
222 1 . 1 1 40 40 LEU HA H 40 4.339 4.339 4.321 0.019 25085
223 1 . 1 1 40 40 LEU C C 40 176.159 176.159 175.445 0.714 25085
224 1 . 1 1 40 40 LEU CA C 40 54.766 54.766 54.289 0.477 25085
225 1 . 1 1 40 40 LEU CB C 40 41.988 41.988 43.255 -1.267 25085
226 1 . 1 1 40 40 LEU H H 40 8.199 8.199 8.398 -0.199 25085
227 1 . 1 1 41 41 ALA N N 41 130.678 130.678 130.048 0.630 25085
228 1 . 1 1 41 41 ALA HA H 41 4.430 4.430 4.704 -0.274 25085
229 1 . 1 1 41 41 ALA CA C 41 49.844 49.844 49.791 0.053 25085
230 1 . 1 1 41 41 ALA CB C 41 18.765 18.765 19.880 -1.115 25085
231 1 . 1 1 41 41 ALA H H 41 8.705 8.705 8.643 0.062 25085
232 1 . 1 1 42 42 PRO HA H 42 4.133 4.133 4.446 -0.313 25085
233 1 . 1 1 42 42 PRO C C 42 178.946 178.946 177.961 0.985 25085
234 1 . 1 1 42 42 PRO CA C 42 62.119 62.119 62.855 -0.736 25085
235 1 . 1 1 42 42 PRO CB C 42 33.383 33.383 31.959 1.424 25085
236 1 . 1 1 43 43 LEU N N 43 124.604 124.604 124.045 0.559 25085
237 1 . 1 1 43 43 LEU HA H 43 3.881 3.881 3.986 -0.105 25085
238 1 . 1 1 43 43 LEU C C 43 176.869 176.869 178.220 -1.351 25085
239 1 . 1 1 43 43 LEU CA C 43 58.639 58.639 58.053 0.586 25085
240 1 . 1 1 43 43 LEU CB C 43 41.848 41.848 41.678 0.170 25085
241 1 . 1 1 43 43 LEU H H 43 8.330 8.330 8.487 -0.157 25085
242 1 . 1 1 44 44 SER N N 44 110.167 110.167 113.350 -3.183 25085
243 1 . 1 1 44 44 SER HA H 44 4.147 4.147 4.185 -0.038 25085
244 1 . 1 1 44 44 SER C C 44 177.107 177.107 176.271 0.837 25085
245 1 . 1 1 44 44 SER CA C 44 61.043 61.043 61.008 0.036 25085
246 1 . 1 1 44 44 SER CB C 44 61.765 61.765 62.911 -1.146 25085
247 1 . 1 1 44 44 SER H H 44 8.553 8.553 8.163 0.390 25085
248 1 . 1 1 45 45 VAL N N 45 123.549 123.549 121.315 2.234 25085
249 1 . 1 1 45 45 VAL HA H 45 3.825 3.825 3.930 -0.105 25085
250 1 . 1 1 45 45 VAL C C 45 178.328 178.328 177.166 1.162 25085
251 1 . 1 1 45 45 VAL CA C 45 65.576 65.576 65.026 0.550 25085
252 1 . 1 1 45 45 VAL CB C 45 31.889 31.889 31.581 0.308 25085
253 1 . 1 1 45 45 VAL H H 45 7.181 7.181 8.175 -0.994 25085
254 1 . 1 1 46 46 LEU N N 46 120.336 120.336 121.101 -0.765 25085
255 1 . 1 1 46 46 LEU HA H 46 3.826 3.826 4.052 -0.226 25085
256 1 . 1 1 46 46 LEU C C 46 179.996 179.996 178.307 1.689 25085
257 1 . 1 1 46 46 LEU CA C 46 57.602 57.602 58.102 -0.500 25085
258 1 . 1 1 46 46 LEU CB C 46 41.691 41.691 41.974 -0.282 25085
259 1 . 1 1 46 46 LEU H H 46 8.040 8.040 7.908 0.131 25085
260 1 . 1 1 47 47 GLU N N 47 115.713 115.713 117.807 -2.094 25085
261 1 . 1 1 47 47 GLU HA H 47 3.820 3.820 4.015 -0.195 25085
262 1 . 1 1 47 47 GLU C C 47 177.029 177.029 178.219 -1.190 25085
263 1 . 1 1 47 47 GLU CA C 47 59.317 59.317 58.843 0.474 25085
264 1 . 1 1 47 47 GLU CB C 47 30.526 30.526 29.774 0.751 25085
265 1 . 1 1 47 47 GLU H H 47 8.567 8.567 7.888 0.679 25085
266 1 . 1 1 48 48 GLN N N 48 116.740 116.740 116.864 -0.123 25085
267 1 . 1 1 48 48 GLN HA H 48 4.281 4.281 4.248 0.032 25085
268 1 . 1 1 48 48 GLN C C 48 177.605 177.605 177.630 -0.025 25085
269 1 . 1 1 48 48 GLN CA C 48 57.827 57.827 57.317 0.510 25085
270 1 . 1 1 48 48 GLN CB C 48 29.985 29.985 29.185 0.800 25085
271 1 . 1 1 48 48 GLN H H 48 7.472 7.472 7.736 -0.264 25085
272 1 . 1 1 49 49 SER N N 49 111.004 111.004 115.083 -4.079 25085
273 1 . 1 1 49 49 SER HA H 49 4.648 4.648 4.372 0.276 25085
274 1 . 1 1 49 49 SER C C 49 174.859 174.859 174.871 -0.012 25085
275 1 . 1 1 49 49 SER CA C 49 58.406 58.406 59.336 -0.930 25085
276 1 . 1 1 49 49 SER CB C 49 64.758 64.758 64.524 0.234 25085
277 1 . 1 1 49 49 SER H H 49 8.657 8.657 8.151 0.506 25085
278 1 . 1 1 50 50 GLY N N 50 110.839 110.839 109.716 1.123 25085
279 1 . 1 1 50 50 GLY C C 50 172.398 172.398 173.258 -0.860 25085
280 1 . 1 1 50 50 GLY CA C 50 44.444 44.444 44.989 -0.545 25085
281 1 . 1 1 50 50 GLY H H 50 7.846 7.846 7.819 0.027 25085
282 1 . 1 1 51 51 LEU N N 51 121.009 121.009 123.996 -2.987 25085
283 1 . 1 1 51 51 LEU HA H 51 4.244 4.244 4.801 -0.557 25085
284 1 . 1 1 51 51 LEU CA C 51 52.593 52.593 51.437 1.156 25085
285 1 . 1 1 51 51 LEU CB C 51 43.381 43.381 43.456 -0.075 25085
286 1 . 1 1 51 51 LEU H H 51 8.647 8.647 7.911 0.736 25085
287 1 . 1 1 52 52 PRO HA H 52 4.349 4.349 4.494 -0.145 25085
288 1 . 1 1 52 52 PRO C C 52 177.247 177.247 177.426 -0.179 25085
289 1 . 1 1 52 52 PRO CA C 52 62.980 62.980 63.047 -0.067 25085
290 1 . 1 1 52 52 PRO CB C 52 32.423 32.423 30.270 2.153 25085
291 1 . 1 1 53 53 ALA N N 53 126.595 126.595 125.622 0.973 25085
292 1 . 1 1 53 53 ALA HA H 53 3.870 3.870 3.955 -0.085 25085
293 1 . 1 1 53 53 ALA C C 53 180.484 180.484 179.249 1.236 25085
294 1 . 1 1 53 53 ALA CA C 53 55.829 55.829 55.073 0.756 25085
295 1 . 1 1 53 53 ALA CB C 53 18.248 18.248 18.510 -0.262 25085
296 1 . 1 1 53 53 ALA H H 53 8.643 8.643 8.585 0.058 25085
297 1 . 1 1 54 54 LYS N N 54 113.898 113.898 118.698 -4.800 25085
298 1 . 1 1 54 54 LYS HA H 54 4.167 4.167 4.115 0.052 25085
299 1 . 1 1 54 54 LYS C C 54 176.704 176.704 178.573 -1.869 25085
300 1 . 1 1 54 54 LYS CA C 54 57.893 57.893 58.604 -0.711 25085
301 1 . 1 1 54 54 LYS CB C 54 31.892 31.892 32.120 -0.228 25085
302 1 . 1 1 54 54 LYS H H 54 8.442 8.442 8.110 0.332 25085
303 1 . 1 1 55 55 LEU N N 55 117.932 117.932 119.090 -1.158 25085
304 1 . 1 1 55 55 LEU HA H 55 4.308 4.308 4.304 0.004 25085
305 1 . 1 1 55 55 LEU C C 55 174.589 174.589 177.904 -3.315 25085
306 1 . 1 1 55 55 LEU CA C 55 54.003 54.003 56.565 -2.562 25085
307 1 . 1 1 55 55 LEU CB C 55 41.649 41.649 42.273 -0.624 25085
308 1 . 1 1 55 55 LEU H H 55 7.805 7.805 8.444 -0.639 25085
309 1 . 1 1 56 56 ARG N N 56 116.873 116.873 117.138 -0.264 25085
310 1 . 1 1 56 56 ARG HA H 56 4.006 4.006 4.443 -0.437 25085
311 1 . 1 1 56 56 ARG C C 56 175.542 175.542 175.712 -0.170 25085
312 1 . 1 1 56 56 ARG CA C 56 57.428 57.428 56.056 1.373 25085
313 1 . 1 1 56 56 ARG CB C 56 29.651 29.651 30.704 -1.053 25085
314 1 . 1 1 56 56 ARG H H 56 6.971 6.971 8.038 -1.067 25085
315 1 . 1 1 57 57 HIS N N 57 122.622 122.622 116.880 5.742 25085
316 1 . 1 1 57 57 HIS HA H 57 4.596 4.596 4.601 -0.005 25085
317 1 . 1 1 57 57 HIS C C 57 173.855 173.855 173.198 0.657 25085
318 1 . 1 1 57 57 HIS CA C 57 55.780 55.780 56.154 -0.374 25085
319 1 . 1 1 57 57 HIS CB C 57 33.878 33.878 31.269 2.609 25085
320 1 . 1 1 57 57 HIS H H 57 7.281 7.281 7.485 -0.204 25085
321 1 . 1 1 58 58 GLU N N 58 120.479 120.479 118.589 1.890 25085
322 1 . 1 1 58 58 GLU HA H 58 4.052 4.052 4.430 -0.378 25085
323 1 . 1 1 58 58 GLU C C 58 176.762 176.762 175.063 1.699 25085
324 1 . 1 1 58 58 GLU CA C 58 59.634 59.634 56.728 2.906 25085
325 1 . 1 1 58 58 GLU CB C 58 29.931 29.931 31.631 -1.700 25085
326 1 . 1 1 58 58 GLU H H 58 7.626 7.626 8.502 -0.876 25085
327 1 . 1 1 59 59 GLN N N 59 118.110 118.110 118.676 -0.566 25085
328 1 . 1 1 59 59 GLN HA H 59 5.479 5.479 5.242 0.237 25085
329 1 . 1 1 59 59 GLN C C 59 174.322 174.322 175.019 -0.697 25085
330 1 . 1 1 59 59 GLN CA C 59 55.486 55.486 54.985 0.501 25085
331 1 . 1 1 59 59 GLN CB C 59 33.151 33.151 31.475 1.676 25085
332 1 . 1 1 59 59 GLN H H 59 8.560 8.560 8.099 0.461 25085
333 1 . 1 1 60 60 ILE N N 60 122.789 122.789 122.821 -0.032 25085
334 1 . 1 1 60 60 ILE HA H 60 4.531 4.531 4.744 -0.213 25085
335 1 . 1 1 60 60 ILE C C 60 173.352 173.352 174.513 -1.161 25085
336 1 . 1 1 60 60 ILE CA C 60 59.794 59.794 60.137 -0.343 25085
337 1 . 1 1 60 60 ILE CB C 60 43.188 43.188 41.412 1.776 25085
338 1 . 1 1 60 60 ILE H H 60 8.735 8.735 8.104 0.631 25085
339 1 . 1 1 61 61 ILE N N 61 125.871 125.871 121.644 4.227 25085
340 1 . 1 1 61 61 ILE HA H 61 5.002 5.002 4.869 0.133 25085
341 1 . 1 1 61 61 ILE C C 61 175.195 175.195 174.409 0.786 25085
342 1 . 1 1 61 61 ILE CA C 61 58.419 58.419 59.808 -1.389 25085
343 1 . 1 1 61 61 ILE CB C 61 40.270 40.270 41.354 -1.084 25085
344 1 . 1 1 61 61 ILE H H 61 9.057 9.057 8.828 0.229 25085
345 1 . 1 1 62 62 PHE N N 62 123.742 123.742 124.164 -0.422 25085
346 1 . 1 1 62 62 PHE HA H 62 5.810 5.810 5.654 0.156 25085
347 1 . 1 1 62 62 PHE C C 62 176.135 176.135 174.846 1.289 25085
348 1 . 1 1 62 62 PHE CA C 62 56.960 56.960 56.007 0.953 25085
349 1 . 1 1 62 62 PHE CB C 62 43.352 43.352 42.559 0.793 25085
350 1 . 1 1 62 62 PHE H H 62 8.977 8.977 8.427 0.550 25085
351 1 . 1 1 63 63 HIS N N 63 116.939 116.939 117.226 -0.287 25085
352 1 . 1 1 63 63 HIS HA H 63 5.979 5.979 5.161 0.818 25085
353 1 . 1 1 63 63 HIS C C 63 171.108 171.108 173.413 -2.305 25085
354 1 . 1 1 63 63 HIS CA C 63 54.115 54.115 54.379 -0.264 25085
355 1 . 1 1 63 63 HIS CB C 63 36.861 36.861 31.894 4.967 25085
356 1 . 1 1 63 63 HIS H H 63 9.298 9.298 8.596 0.702 25085
357 1 . 1 1 64 64 CYS N N 64 119.251 119.251 122.037 -2.787 25085
358 1 . 1 1 64 64 CYS HA H 64 5.044 5.044 4.983 0.061 25085
359 1 . 1 1 64 64 CYS C C 64 177.438 177.438 175.777 1.661 25085
360 1 . 1 1 64 64 CYS CA C 64 56.886 56.886 56.385 0.501 25085
361 1 . 1 1 64 64 CYS CB C 64 29.425 29.425 31.689 -2.264 25085
362 1 . 1 1 64 64 CYS H H 64 8.156 8.156 8.613 -0.457 25085
363 1 . 1 1 65 65 GLN N N 65 125.627 125.627 124.459 1.168 25085
364 1 . 1 1 65 65 GLN HA H 65 4.220 4.220 3.948 0.272 25085
365 1 . 1 1 65 65 GLN C C 65 174.440 174.440 175.875 -1.435 25085
366 1 . 1 1 65 65 GLN CA C 65 59.788 59.788 59.583 0.205 25085
367 1 . 1 1 65 65 GLN CB C 65 29.370 29.370 28.475 0.895 25085
368 1 . 1 1 65 65 GLN H H 65 8.937 8.937 9.056 -0.119 25085
369 1 . 1 1 66 66 ALA N N 66 118.880 118.880 116.430 2.450 25085
370 1 . 1 1 66 66 ALA HA H 66 5.115 5.115 4.825 0.290 25085
371 1 . 1 1 66 66 ALA C C 66 177.625 177.625 177.106 0.519 25085
372 1 . 1 1 66 66 ALA CA C 66 50.744 50.744 51.902 -1.158 25085
373 1 . 1 1 66 66 ALA CB C 66 20.658 20.658 20.145 0.513 25085
374 1 . 1 1 66 66 ALA H H 66 9.024 9.024 7.765 1.259 25085
375 1 . 1 1 67 67 GLY N N 67 112.878 112.878 106.651 6.227 25085
376 1 . 1 1 67 67 GLY C C 67 174.810 174.810 175.581 -0.771 25085
377 1 . 1 1 67 67 GLY CA C 67 45.642 45.642 46.031 -0.389 25085
378 1 . 1 1 67 67 GLY H H 67 8.845 8.845 8.052 0.793 25085
379 1 . 1 1 68 68 LYS N N 68 120.133 120.133 121.023 -0.890 25085
380 1 . 1 1 68 68 LYS HA H 68 4.158 4.158 4.064 0.094 25085
381 1 . 1 1 68 68 LYS C C 68 177.939 177.939 178.293 -0.354 25085
382 1 . 1 1 68 68 LYS CA C 68 58.811 58.811 58.566 0.245 25085
383 1 . 1 1 68 68 LYS CB C 68 32.796 32.796 32.390 0.406 25085
384 1 . 1 1 68 68 LYS H H 68 7.936 7.936 8.231 -0.295 25085
385 1 . 1 1 69 69 ARG N N 69 125.804 125.804 118.363 7.441 25085
386 1 . 1 1 69 69 ARG HA H 69 4.217 4.217 4.194 0.023 25085
387 1 . 1 1 69 69 ARG C C 69 180.944 180.944 178.234 2.710 25085
388 1 . 1 1 69 69 ARG CA C 69 60.010 60.010 59.195 0.815 25085
389 1 . 1 1 69 69 ARG CB C 69 30.974 30.974 29.743 1.231 25085
390 1 . 1 1 69 69 ARG H H 69 8.981 8.981 8.184 0.797 25085
391 1 . 1 1 70 70 THR N N 70 116.681 116.681 115.886 0.795 25085
392 1 . 1 1 70 70 THR HA H 70 3.607 3.607 3.983 -0.376 25085
393 1 . 1 1 70 70 THR C C 70 176.434 176.434 176.521 -0.087 25085
394 1 . 1 1 70 70 THR CA C 70 65.914 65.914 66.829 -0.915 25085
395 1 . 1 1 70 70 THR CB C 70 68.169 68.169 68.312 -0.143 25085
396 1 . 1 1 70 70 THR H H 70 10.382 10.382 8.147 2.235 25085
397 1 . 1 1 71 71 SER N N 71 113.046 113.046 116.047 -3.001 25085
398 1 . 1 1 71 71 SER HA H 71 3.993 3.993 4.207 -0.214 25085
399 1 . 1 1 71 71 SER C C 71 177.594 177.594 175.852 1.742 25085
400 1 . 1 1 71 71 SER CA C 71 62.500 62.500 61.298 1.202 25085
401 1 . 1 1 71 71 SER H H 71 7.346 7.346 7.969 -0.623 25085
402 1 . 1 1 72 72 ASN N N 72 117.540 117.540 118.785 -1.245 25085
403 1 . 1 1 72 72 ASN HA H 72 4.598 4.598 4.660 -0.062 25085
404 1 . 1 1 72 72 ASN C C 72 175.595 175.595 176.890 -1.295 25085
405 1 . 1 1 72 72 ASN CA C 72 55.147 55.147 55.533 -0.387 25085
406 1 . 1 1 72 72 ASN CB C 72 38.821 38.821 39.007 -0.186 25085
407 1 . 1 1 72 72 ASN H H 72 8.078 8.078 7.694 0.384 25085
408 1 . 1 1 73 73 ASN N N 73 114.869 114.869 118.200 -3.331 25085
409 1 . 1 1 73 73 ASN HA H 73 5.159 5.159 4.651 0.508 25085
410 1 . 1 1 73 73 ASN C C 73 174.375 174.375 176.433 -2.058 25085
411 1 . 1 1 73 73 ASN CA C 73 52.976 52.976 54.128 -1.153 25085
412 1 . 1 1 73 73 ASN CB C 73 39.862 39.862 38.938 0.924 25085
413 1 . 1 1 73 73 ASN H H 73 7.290 7.290 8.405 -1.115 25085
414 1 . 1 1 74 74 ALA N N 74 124.647 124.647 122.604 2.043 25085
415 1 . 1 1 74 74 ALA HA H 74 3.721 3.721 3.786 -0.065 25085
416 1 . 1 1 74 74 ALA C C 74 177.908 177.908 178.620 -0.712 25085
417 1 . 1 1 74 74 ALA CA C 74 57.085 57.085 55.325 1.760 25085
418 1 . 1 1 74 74 ALA CB C 74 19.427 19.427 18.249 1.178 25085
419 1 . 1 1 74 74 ALA H H 74 7.105 7.105 8.507 -1.402 25085
420 1 . 1 1 75 75 ASP N N 75 114.917 114.917 116.590 -1.673 25085
421 1 . 1 1 75 75 ASP HA H 75 4.250 4.250 4.440 -0.190 25085
422 1 . 1 1 75 75 ASP C C 75 179.100 179.100 178.287 0.813 25085
423 1 . 1 1 75 75 ASP CA C 75 57.236 57.236 56.854 0.382 25085
424 1 . 1 1 75 75 ASP CB C 75 39.783 39.783 40.492 -0.709 25085
425 1 . 1 1 75 75 ASP H H 75 8.403 8.403 8.087 0.316 25085
426 1 . 1 1 76 76 LYS N N 76 121.888 121.888 119.420 2.468 25085
427 1 . 1 1 76 76 LYS HA H 76 4.053 4.053 4.175 -0.122 25085
428 1 . 1 1 76 76 LYS C C 76 178.832 178.832 178.874 -0.043 25085
429 1 . 1 1 76 76 LYS CA C 76 58.864 58.864 57.791 1.073 25085
430 1 . 1 1 76 76 LYS CB C 76 32.423 32.423 32.398 0.025 25085
431 1 . 1 1 76 76 LYS H H 76 7.652 7.652 7.875 -0.223 25085
432 1 . 1 1 77 77 LEU N N 77 118.644 118.644 120.422 -1.778 25085
433 1 . 1 1 77 77 LEU HA H 77 3.557 3.557 3.905 -0.347 25085
434 1 . 1 1 77 77 LEU C C 77 178.068 178.068 178.390 -0.322 25085
435 1 . 1 1 77 77 LEU CA C 77 57.692 57.692 57.622 0.070 25085
436 1 . 1 1 77 77 LEU CB C 77 40.077 40.077 41.216 -1.139 25085
437 1 . 1 1 77 77 LEU H H 77 8.146 8.146 8.060 0.086 25085
438 1 . 1 1 78 78 ALA N N 78 119.668 119.668 120.552 -0.884 25085
439 1 . 1 1 78 78 ALA HA H 78 3.990 3.990 3.874 0.116 25085
440 1 . 1 1 78 78 ALA C C 78 179.542 179.542 178.729 0.813 25085
441 1 . 1 1 78 78 ALA CA C 78 54.937 54.937 54.703 0.233 25085
442 1 . 1 1 78 78 ALA CB C 78 18.080 18.080 18.164 -0.084 25085
443 1 . 1 1 78 78 ALA H H 78 8.136 8.136 7.803 0.333 25085
444 1 . 1 1 79 79 ALA N N 79 118.918 118.918 119.887 -0.969 25085
445 1 . 1 1 79 79 ALA HA H 79 4.139 4.139 4.112 0.027 25085
446 1 . 1 1 79 79 ALA C C 79 180.800 180.800 179.492 1.308 25085
447 1 . 1 1 79 79 ALA CA C 79 54.571 54.571 54.347 0.224 25085
448 1 . 1 1 79 79 ALA CB C 79 18.268 18.268 18.635 -0.367 25085
449 1 . 1 1 79 79 ALA H H 79 7.319 7.319 7.573 -0.254 25085
450 1 . 1 1 80 80 ILE N N 80 118.438 118.438 117.455 0.983 25085
451 1 . 1 1 80 80 ILE HA H 80 3.801 3.801 3.914 -0.113 25085
452 1 . 1 1 80 80 ILE C C 80 177.302 177.302 176.595 0.707 25085
453 1 . 1 1 80 80 ILE CA C 80 64.252 64.252 62.936 1.316 25085
454 1 . 1 1 80 80 ILE CB C 80 39.115 39.115 37.936 1.180 25085
455 1 . 1 1 80 80 ILE H H 80 8.227 8.227 7.580 0.646 25085
456 1 . 1 1 81 81 ALA N N 81 117.917 117.917 120.194 -2.277 25085
457 1 . 1 1 81 81 ALA HA H 81 4.466 4.466 4.376 0.090 25085
458 1 . 1 1 81 81 ALA C C 81 176.153 176.153 176.701 -0.548 25085
459 1 . 1 1 81 81 ALA CA C 81 51.404 51.404 51.550 -0.146 25085
460 1 . 1 1 81 81 ALA CB C 81 20.200 20.200 19.239 0.961 25085
461 1 . 1 1 81 81 ALA H H 81 7.913 7.913 8.043 -0.130 25085
462 1 . 1 1 82 82 ALA N N 82 124.086 124.086 122.421 1.665 25085
463 1 . 1 1 82 82 ALA HA H 82 4.457 4.457 4.092 0.365 25085
464 1 . 1 1 82 82 ALA CA C 82 52.276 52.276 52.236 0.040 25085
465 1 . 1 1 82 82 ALA CB C 82 17.243 17.243 16.861 0.382 25085
466 1 . 1 1 82 82 ALA H H 82 7.223 7.223 7.494 -0.271 25085
467 1 . 1 1 83 83 PRO HA H 83 4.692 4.692 4.281 0.411 25085
468 1 . 1 1 83 83 PRO C C 83 175.169 175.169 175.793 -0.624 25085
469 1 . 1 1 83 83 PRO CA C 83 63.767 63.767 63.628 0.139 25085
470 1 . 1 1 83 83 PRO CB C 83 32.624 32.624 30.360 2.264 25085
471 1 . 1 1 84 84 ALA N N 84 127.741 127.741 122.916 4.825 25085
472 1 . 1 1 84 84 ALA HA H 84 4.138 4.138 4.357 -0.219 25085
473 1 . 1 1 84 84 ALA C C 84 176.494 176.494 176.800 -0.305 25085
474 1 . 1 1 84 84 ALA CA C 84 53.432 53.432 51.544 1.888 25085
475 1 . 1 1 84 84 ALA CB C 84 19.719 19.719 20.470 -0.751 25085
476 1 . 1 1 84 84 ALA H H 84 8.528 8.528 7.916 0.612 25085
477 1 . 1 1 85 85 GLU N N 85 121.634 121.634 119.331 2.303 25085
478 1 . 1 1 85 85 GLU HA H 85 4.228 4.228 4.476 -0.248 25085
479 1 . 1 1 85 85 GLU C C 85 175.094 175.094 174.743 0.351 25085
480 1 . 1 1 85 85 GLU CA C 85 56.444 56.444 55.338 1.106 25085
481 1 . 1 1 85 85 GLU CB C 85 30.803 30.803 29.779 1.024 25085
482 1 . 1 1 85 85 GLU H H 85 8.166 8.166 8.313 -0.147 25085
483 1 . 1 1 86 86 ILE N N 86 122.543 122.543 122.017 0.525 25085
484 1 . 1 1 86 86 ILE HA H 86 5.269 5.269 4.830 0.439 25085
485 1 . 1 1 86 86 ILE C C 86 174.463 174.463 174.642 -0.179 25085
486 1 . 1 1 86 86 ILE CA C 86 59.329 59.329 59.927 -0.598 25085
487 1 . 1 1 86 86 ILE CB C 86 40.546 40.546 40.240 0.306 25085
488 1 . 1 1 86 86 ILE H H 86 7.925 7.925 7.959 -0.034 25085
489 1 . 1 1 87 87 PHE N N 87 122.457 122.457 123.424 -0.967 25085
490 1 . 1 1 87 87 PHE HA H 87 5.428 5.428 5.748 -0.320 25085
491 1 . 1 1 87 87 PHE C C 87 174.450 174.450 174.992 -0.542 25085
492 1 . 1 1 87 87 PHE CA C 87 55.029 55.029 55.863 -0.834 25085
493 1 . 1 1 87 87 PHE CB C 87 43.626 43.626 43.299 0.327 25085
494 1 . 1 1 87 87 PHE H H 87 9.050 9.050 8.339 0.711 25085
495 1 . 1 1 88 88 LEU N N 88 119.959 119.959 119.544 0.415 25085
496 1 . 1 1 88 88 LEU HA H 88 5.358 5.358 4.971 0.387 25085
497 1 . 1 1 88 88 LEU C C 88 176.627 176.627 175.029 1.598 25085
498 1 . 1 1 88 88 LEU CA C 88 52.654 52.654 53.778 -1.124 25085
499 1 . 1 1 88 88 LEU CB C 88 43.094 43.094 46.204 -3.110 25085
500 1 . 1 1 88 88 LEU H H 88 8.824 8.824 8.790 0.034 25085
501 1 . 1 1 89 89 LEU N N 89 124.096 124.096 125.831 -1.735 25085
502 1 . 1 1 89 89 LEU HA H 89 4.432 4.432 4.835 -0.403 25085
503 1 . 1 1 89 89 LEU C C 89 176.693 176.693 175.896 0.797 25085
504 1 . 1 1 89 89 LEU CA C 89 55.385 55.385 53.939 1.446 25085
505 1 . 1 1 89 89 LEU CB C 89 43.537 43.537 42.745 0.792 25085
506 1 . 1 1 89 89 LEU H H 89 8.293 8.293 8.289 0.004 25085
507 1 . 1 1 90 90 GLU N N 90 102.942 102.942 127.745 -24.803 25085
508 1 . 1 1 90 90 GLU HA H 90 3.895 3.895 4.105 -0.210 25085
509 1 . 1 1 90 90 GLU C C 90 175.199 175.199 176.834 -1.635 25085
510 1 . 1 1 90 90 GLU CA C 90 58.586 58.586 58.512 0.074 25085
511 1 . 1 1 90 90 GLU CB C 90 30.831 30.831 30.492 0.339 25085
512 1 . 1 1 90 90 GLU H H 90 9.394 9.394 8.399 0.995 25085
513 1 . 1 1 91 91 ASP N N 91 120.515 120.515 120.853 -0.338 25085
514 1 . 1 1 91 91 ASP HA H 91 4.184 4.184 4.331 -0.147 25085
515 1 . 1 1 91 91 ASP C C 91 176.159 176.159 176.071 0.088 25085
516 1 . 1 1 91 91 ASP CA C 91 55.814 55.814 56.233 -0.419 25085
517 1 . 1 1 91 91 ASP CB C 91 39.033 39.033 40.562 -1.528 25085
518 1 . 1 1 91 91 ASP H H 91 9.210 9.210 8.857 0.353 25085
519 1 . 1 1 92 92 GLY N N 92 104.313 104.313 106.133 -1.820 25085
520 1 . 1 1 92 92 GLY C C 92 172.980 172.980 174.877 -1.897 25085
521 1 . 1 1 92 92 GLY CA C 92 46.946 46.946 44.619 2.327 25085
522 1 . 1 1 92 92 GLY H H 92 7.902 7.902 7.765 0.137 25085
523 1 . 1 1 93 93 ILE N N 93 121.445 121.445 122.607 -1.162 25085
524 1 . 1 1 93 93 ILE HA H 93 3.902 3.902 3.843 0.059 25085
525 1 . 1 1 93 93 ILE C C 93 176.528 176.528 176.592 -0.064 25085
526 1 . 1 1 93 93 ILE CA C 93 63.908 63.908 64.090 -0.182 25085
527 1 . 1 1 93 93 ILE CB C 93 38.416 38.416 37.996 0.421 25085
528 1 . 1 1 93 93 ILE H H 93 8.129 8.129 8.301 -0.172 25085
529 1 . 1 1 94 94 ASP N N 94 126.304 126.304 120.191 6.113 25085
530 1 . 1 1 94 94 ASP HA H 94 4.436 4.436 4.360 0.076 25085
531 1 . 1 1 94 94 ASP C C 94 180.174 180.174 178.574 1.600 25085
532 1 . 1 1 94 94 ASP CA C 94 58.351 58.351 57.825 0.526 25085
533 1 . 1 1 94 94 ASP CB C 94 39.223 39.223 40.366 -1.143 25085
534 1 . 1 1 94 94 ASP H H 94 9.161 9.161 8.179 0.982 25085
535 1 . 1 1 95 95 GLY N N 95 110.690 110.690 107.361 3.329 25085
536 1 . 1 1 95 95 GLY C C 95 176.108 176.108 175.762 0.346 25085
537 1 . 1 1 95 95 GLY CA C 95 46.873 46.873 46.531 0.342 25085
538 1 . 1 1 95 95 GLY H H 95 8.080 8.080 8.333 -0.253 25085
539 1 . 1 1 96 96 TRP N N 96 126.965 126.965 123.625 3.340 25085
540 1 . 1 1 96 96 TRP HA H 96 3.795 3.795 4.281 -0.486 25085
541 1 . 1 1 96 96 TRP C C 96 177.058 177.058 177.378 -0.320 25085
542 1 . 1 1 96 96 TRP CA C 96 61.633 61.633 60.877 0.756 25085
543 1 . 1 1 96 96 TRP CB C 96 29.512 29.512 29.464 0.048 25085
544 1 . 1 1 96 96 TRP H H 96 8.007 8.007 7.657 0.350 25085
545 1 . 1 1 97 97 LYS N N 97 116.604 116.604 119.100 -2.496 25085
546 1 . 1 1 97 97 LYS HA H 97 4.090 4.090 4.244 -0.154 25085
547 1 . 1 1 97 97 LYS C C 97 182.010 182.010 179.502 2.508 25085
548 1 . 1 1 97 97 LYS CA C 97 59.776 59.776 59.041 0.735 25085
549 1 . 1 1 97 97 LYS CB C 97 32.208 32.208 32.501 -0.293 25085
550 1 . 1 1 97 97 LYS H H 97 8.696 8.696 8.215 0.481 25085
551 1 . 1 1 98 98 ARG N N 98 122.491 122.491 119.471 3.020 25085
552 1 . 1 1 98 98 ARG HA H 98 4.050 4.050 4.135 -0.085 25085
553 1 . 1 1 98 98 ARG C C 98 177.666 177.666 177.925 -0.259 25085
554 1 . 1 1 98 98 ARG CA C 98 59.509 59.509 58.149 1.360 25085
555 1 . 1 1 98 98 ARG CB C 98 30.471 30.471 30.167 0.304 25085
556 1 . 1 1 98 98 ARG H H 98 8.280 8.280 7.755 0.525 25085
557 1 . 1 1 99 99 ALA N N 99 119.546 119.546 119.180 0.366 25085
558 1 . 1 1 99 99 ALA HA H 99 4.276 4.276 4.154 0.122 25085
559 1 . 1 1 99 99 ALA C C 99 176.800 176.800 177.606 -0.806 25085
560 1 . 1 1 99 99 ALA CA C 99 52.254 52.254 52.900 -0.646 25085
561 1 . 1 1 99 99 ALA CB C 99 18.270 18.270 18.947 -0.677 25085
562 1 . 1 1 99 99 ALA H H 99 7.519 7.519 8.040 -0.521 25085
563 1 . 1 1 100 100 GLY N N 100 106.339 106.339 105.189 1.151 25085
564 1 . 1 1 100 100 GLY C C 100 174.232 174.232 173.797 0.435 25085
565 1 . 1 1 100 100 GLY CA C 100 45.050 45.050 44.887 0.163 25085
566 1 . 1 1 100 100 GLY H H 100 7.926 7.926 7.525 0.401 25085
567 1 . 1 1 101 101 LEU N N 101 122.181 122.181 120.986 1.195 25085
568 1 . 1 1 101 101 LEU HA H 101 4.286 4.286 4.541 -0.255 25085
569 1 . 1 1 101 101 LEU CA C 101 53.183 53.183 50.953 2.230 25085
570 1 . 1 1 101 101 LEU CB C 101 37.320 37.320 42.437 -5.117 25085
571 1 . 1 1 101 101 LEU H H 101 6.976 6.976 7.309 -0.333 25085
572 1 . 1 1 102 102 PRO HA H 102 4.476 4.476 4.428 0.048 25085
573 1 . 1 1 102 102 PRO C C 102 177.424 177.424 176.192 1.232 25085
574 1 . 1 1 102 102 PRO CA C 102 64.014 64.014 63.199 0.815 25085
575 1 . 1 1 102 102 PRO CB C 102 33.200 33.200 31.996 1.204 25085
576 1 . 1 1 103 103 VAL N N 103 110.512 110.512 116.180 -5.668 25085
577 1 . 1 1 103 103 VAL HA H 103 4.643 4.643 4.384 0.259 25085
578 1 . 1 1 103 103 VAL C C 103 174.297 174.297 174.588 -0.291 25085
579 1 . 1 1 103 103 VAL CA C 103 59.693 59.693 59.831 -0.138 25085
580 1 . 1 1 103 103 VAL CB C 103 35.980 35.980 34.387 1.593 25085
581 1 . 1 1 103 103 VAL H H 103 8.073 8.073 7.984 0.088 25085
582 1 . 1 1 104 104 ALA N N 104 125.898 125.898 125.186 0.712 25085
583 1 . 1 1 104 104 ALA HA H 104 4.550 4.550 4.729 -0.179 25085
584 1 . 1 1 104 104 ALA C C 104 176.190 176.190 175.283 0.907 25085
585 1 . 1 1 104 104 ALA CA C 104 50.699 50.699 50.862 -0.163 25085
586 1 . 1 1 104 104 ALA CB C 104 19.534 19.534 21.135 -1.601 25085
587 1 . 1 1 104 104 ALA H H 104 8.996 8.996 8.151 0.845 25085
588 1 . 1 1 105 105 VAL N N 105 119.534 119.534 123.132 -3.598 25085
589 1 . 1 1 105 105 VAL HA H 105 4.615 4.615 4.115 0.500 25085
590 1 . 1 1 105 105 VAL C C 105 175.576 175.576 175.407 0.169 25085
591 1 . 1 1 105 105 VAL CA C 105 60.234 60.234 61.092 -0.858 25085
592 1 . 1 1 105 105 VAL CB C 105 34.683 34.683 33.091 1.592 25085
593 1 . 1 1 105 105 VAL H H 105 8.276 8.276 8.384 -0.108 25085
594 1 . 1 1 106 106 ASN N N 106 123.346 123.346 126.372 -3.026 25085
595 1 . 1 1 106 106 ASN HA H 106 4.748 4.748 4.659 0.089 25085
596 1 . 1 1 106 106 ASN C C 106 173.877 173.877 174.621 -0.744 25085
597 1 . 1 1 106 106 ASN CA C 106 53.465 53.465 53.349 0.117 25085
598 1 . 1 1 106 106 ASN CB C 106 39.424 39.424 38.616 0.807 25085
599 1 . 1 1 106 106 ASN H H 106 8.190 8.190 8.286 -0.096 25085
stop_
save_