data_19498
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19498
_Entry.PDB_ID 2MDP
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 19498
_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 6 6 SER CA C 6 56.008 56.008 56.976 -0.968 19498
2 1 1 . 1 1 7 7 GLY N N 7 109.496 109.496 109.836 -0.340 19498
3 1 1 . 1 1 7 7 GLY CA C 7 46.042 46.042 46.902 -0.860 19498
4 1 1 . 1 1 7 7 GLY H H 7 8.432 8.432 8.729 -0.297 19498
5 1 1 . 1 1 8 8 ASN N N 8 119.432 119.432 119.478 -0.046 19498
6 1 1 . 1 1 8 8 ASN HA H 8 4.685 4.685 4.465 0.220 19498
7 1 1 . 1 1 8 8 ASN CA C 8 53.922 53.922 54.741 -0.819 19498
8 1 1 . 1 1 8 8 ASN CB C 8 37.970 37.970 38.053 -0.083 19498
9 1 1 . 1 1 8 8 ASN H H 8 8.367 8.367 8.619 -0.252 19498
10 1 1 . 1 1 9 9 LEU N N 9 123.537 123.537 119.235 4.302 19498
11 1 1 . 1 1 9 9 LEU HA H 9 3.984 3.984 4.196 -0.212 19498
12 1 1 . 1 1 9 9 LEU CA C 9 56.417 56.417 54.484 1.933 19498
13 1 1 . 1 1 9 9 LEU CB C 9 41.566 41.566 41.242 0.324 19498
14 1 1 . 1 1 9 9 LEU H H 9 7.922 7.922 7.338 0.584 19498
15 1 1 . 1 1 10 10 ALA N N 10 122.287 122.287 123.412 -1.125 19498
16 1 1 . 1 1 10 10 ALA HA H 10 4.127 4.127 3.980 0.147 19498
17 1 1 . 1 1 10 10 ALA CA C 10 55.912 55.912 55.575 0.337 19498
18 1 1 . 1 1 10 10 ALA CB C 10 17.998 17.998 18.040 -0.042 19498
19 1 1 . 1 1 10 10 ALA H H 10 8.064 8.064 7.605 0.459 19498
20 1 1 . 1 1 11 11 ALA N N 11 121.326 121.326 120.099 1.227 19498
21 1 1 . 1 1 11 11 ALA HA H 11 4.207 4.207 4.176 0.031 19498
22 1 1 . 1 1 11 11 ALA CA C 11 54.960 54.960 54.136 0.824 19498
23 1 1 . 1 1 11 11 ALA CB C 11 17.998 17.998 18.379 -0.381 19498
24 1 1 . 1 1 11 11 ALA H H 11 8.143 8.143 8.084 0.059 19498
25 1 1 . 1 1 12 12 PHE N N 12 122.913 122.913 119.478 3.435 19498
26 1 1 . 1 1 12 12 PHE HA H 12 4.411 4.411 4.097 0.314 19498
27 1 1 . 1 1 12 12 PHE CA C 12 61.007 61.007 60.978 0.029 19498
28 1 1 . 1 1 12 12 PHE CB C 12 39.499 39.499 39.189 0.310 19498
29 1 1 . 1 1 12 12 PHE H H 12 7.779 7.779 7.867 -0.088 19498
30 1 1 . 1 1 13 13 LYS N N 13 120.689 120.689 118.493 2.196 19498
31 1 1 . 1 1 13 13 LYS HA H 13 3.861 3.861 3.991 -0.130 19498
32 1 1 . 1 1 13 13 LYS CA C 13 59.099 59.099 58.809 0.290 19498
33 1 1 . 1 1 13 13 LYS CB C 13 31.867 31.867 31.299 0.568 19498
34 1 1 . 1 1 13 13 LYS H H 13 8.614 8.614 8.665 -0.051 19498
35 1 1 . 1 1 14 14 ALA N N 14 122.076 122.076 121.155 0.921 19498
36 1 1 . 1 1 14 14 ALA HA H 14 3.182 3.182 4.145 -0.963 19498
37 1 1 . 1 1 14 14 ALA CA C 14 55.108 55.108 54.630 0.478 19498
38 1 1 . 1 1 14 14 ALA CB C 14 18.120 18.120 17.949 0.171 19498
39 1 1 . 1 1 14 14 ALA H H 14 8.178 8.178 7.517 0.661 19498
40 1 1 . 1 1 15 15 ALA N N 15 121.714 121.714 120.301 1.413 19498
41 1 1 . 1 1 15 15 ALA HA H 15 4.040 4.040 4.064 -0.024 19498
42 1 1 . 1 1 15 15 ALA CA C 15 55.158 55.158 54.691 0.467 19498
43 1 1 . 1 1 15 15 ALA CB C 15 19.042 19.042 18.059 0.983 19498
44 1 1 . 1 1 15 15 ALA H H 15 7.793 7.793 7.697 0.096 19498
45 1 1 . 1 1 16 16 THR N N 16 111.959 111.959 115.193 -3.234 19498
46 1 1 . 1 1 16 16 THR HA H 16 3.705 3.705 3.820 -0.115 19498
47 1 1 . 1 1 16 16 THR CA C 16 66.762 66.762 66.710 0.051 19498
48 1 1 . 1 1 16 16 THR CB C 16 68.213 68.213 68.394 -0.182 19498
49 1 1 . 1 1 16 16 THR H H 16 8.133 8.133 7.646 0.487 19498
50 1 1 . 1 1 17 17 ASN N N 17 121.090 121.090 118.412 2.678 19498
51 1 1 . 1 1 17 17 ASN HA H 17 4.520 4.520 4.473 0.047 19498
52 1 1 . 1 1 17 17 ASN CA C 17 56.191 56.191 55.640 0.551 19498
53 1 1 . 1 1 17 17 ASN CB C 17 38.365 38.365 38.388 -0.023 19498
54 1 1 . 1 1 17 17 ASN H H 17 8.152 8.152 7.672 0.480 19498
55 1 1 . 1 1 18 18 LYS N N 18 119.978 119.978 119.009 0.969 19498
56 1 1 . 1 1 18 18 LYS HA H 18 3.914 3.914 3.982 -0.068 19498
57 1 1 . 1 1 18 18 LYS CA C 18 59.865 59.865 57.722 2.143 19498
58 1 1 . 1 1 18 18 LYS CB C 18 30.999 30.999 31.767 -0.768 19498
59 1 1 . 1 1 18 18 LYS H H 18 7.568 7.568 7.738 -0.170 19498
60 1 1 . 1 1 19 19 LEU N N 19 117.558 117.558 119.675 -2.117 19498
61 1 1 . 1 1 19 19 LEU HA H 19 4.135 4.135 4.042 0.093 19498
62 1 1 . 1 1 19 19 LEU CA C 19 58.001 58.001 57.843 0.158 19498
63 1 1 . 1 1 19 19 LEU CB C 19 40.823 40.823 41.684 -0.862 19498
64 1 1 . 1 1 19 19 LEU H H 19 7.001 7.001 7.506 -0.505 19498
65 1 1 . 1 1 20 20 PHE N N 20 121.123 121.123 119.046 2.077 19498
66 1 1 . 1 1 20 20 PHE HA H 20 4.873 4.873 4.173 0.700 19498
67 1 1 . 1 1 20 20 PHE CA C 20 60.375 60.375 61.307 -0.932 19498
68 1 1 . 1 1 20 20 PHE CB C 20 38.480 38.480 39.271 -0.791 19498
69 1 1 . 1 1 20 20 PHE H H 20 8.193 8.193 7.691 0.502 19498
70 1 1 . 1 1 21 21 GLN N N 21 118.591 118.591 115.592 2.999 19498
71 1 1 . 1 1 21 21 GLN HA H 21 4.208 4.208 4.131 0.077 19498
72 1 1 . 1 1 21 21 GLN CA C 21 58.055 58.055 57.730 0.325 19498
73 1 1 . 1 1 21 21 GLN CB C 21 28.284 28.284 28.169 0.115 19498
74 1 1 . 1 1 21 21 GLN H H 21 7.918 7.918 8.183 -0.265 19498
75 1 1 . 1 1 22 22 LEU N N 22 118.477 118.477 117.882 0.595 19498
76 1 1 . 1 1 22 22 LEU HA H 22 4.534 4.534 4.410 0.124 19498
77 1 1 . 1 1 22 22 LEU CA C 22 54.033 54.033 54.032 0.001 19498
78 1 1 . 1 1 22 22 LEU CB C 22 41.469 41.469 42.719 -1.250 19498
79 1 1 . 1 1 22 22 LEU H H 22 7.561 7.561 7.321 0.240 19498
80 1 1 . 1 1 23 23 ASP N N 23 115.410 115.410 119.490 -4.080 19498
81 1 1 . 1 1 23 23 ASP HA H 23 4.280 4.280 4.107 0.173 19498
82 1 1 . 1 1 23 23 ASP CA C 23 55.494 55.494 55.213 0.281 19498
83 1 1 . 1 1 23 23 ASP CB C 23 39.317 39.317 39.431 -0.114 19498
84 1 1 . 1 1 23 23 ASP H H 23 8.163 8.163 7.729 0.434 19498
85 1 1 . 1 1 24 24 LEU N N 24 116.367 116.367 114.770 1.597 19498
86 1 1 . 1 1 24 24 LEU HA H 24 4.790 4.790 4.878 -0.088 19498
87 1 1 . 1 1 24 24 LEU CA C 24 53.030 53.030 53.252 -0.222 19498
88 1 1 . 1 1 24 24 LEU CB C 24 43.867 43.867 43.860 0.007 19498
89 1 1 . 1 1 24 24 LEU H H 24 7.136 7.136 7.381 -0.245 19498
90 1 1 . 1 1 25 25 ALA N N 25 123.243 123.243 120.397 2.846 19498
91 1 1 . 1 1 25 25 ALA HA H 25 4.480 4.480 4.823 -0.343 19498
92 1 1 . 1 1 25 25 ALA CA C 25 50.890 50.890 51.599 -0.709 19498
93 1 1 . 1 1 25 25 ALA CB C 25 21.655 21.655 22.186 -0.531 19498
94 1 1 . 1 1 25 25 ALA H H 25 8.931 8.931 8.372 0.559 19498
95 1 1 . 1 1 26 26 VAL N N 26 119.587 119.587 122.623 -3.036 19498
96 1 1 . 1 1 26 26 VAL HA H 26 4.889 4.889 5.208 -0.319 19498
97 1 1 . 1 1 26 26 VAL CA C 26 61.278 61.278 61.096 0.182 19498
98 1 1 . 1 1 26 26 VAL CB C 26 33.310 33.310 35.339 -2.029 19498
99 1 1 . 1 1 26 26 VAL H H 26 7.575 7.575 8.374 -0.799 19498
100 1 1 . 1 1 27 27 ILE N N 27 130.377 130.377 123.933 6.444 19498
101 1 1 . 1 1 27 27 ILE HA H 27 4.489 4.489 4.841 -0.352 19498
102 1 1 . 1 1 27 27 ILE CA C 27 60.177 60.177 60.428 -0.251 19498
103 1 1 . 1 1 27 27 ILE CB C 27 40.019 40.019 40.898 -0.879 19498
104 1 1 . 1 1 27 27 ILE H H 27 9.437 9.437 9.155 0.282 19498
105 1 1 . 1 1 28 28 TYR N N 28 126.844 126.844 122.659 4.185 19498
106 1 1 . 1 1 28 28 TYR HA H 28 5.709 5.709 5.559 0.150 19498
107 1 1 . 1 1 28 28 TYR CA C 28 55.486 55.486 55.280 0.206 19498
108 1 1 . 1 1 28 28 TYR CB C 28 42.019 42.019 41.001 1.018 19498
109 1 1 . 1 1 28 28 TYR H H 28 8.531 8.531 8.369 0.162 19498
110 1 1 . 1 1 29 29 ASP N N 29 122.875 122.875 122.555 0.320 19498
111 1 1 . 1 1 29 29 ASP HA H 29 4.966 4.966 4.892 0.074 19498
112 1 1 . 1 1 29 29 ASP CA C 29 53.659 53.659 53.609 0.050 19498
113 1 1 . 1 1 29 29 ASP CB C 29 44.660 44.660 44.140 0.520 19498
114 1 1 . 1 1 29 29 ASP H H 29 8.614 8.614 8.983 -0.369 19498
115 1 1 . 1 1 30 30 ASP N N 30 119.325 119.325 126.510 -7.185 19498
116 1 1 . 1 1 30 30 ASP HA H 30 5.447 5.447 4.859 0.588 19498
117 1 1 . 1 1 30 30 ASP CA C 30 53.501 53.501 54.121 -0.620 19498
118 1 1 . 1 1 30 30 ASP CB C 30 43.921 43.921 43.137 0.784 19498
119 1 1 . 1 1 30 30 ASP H H 30 8.607 8.607 8.630 -0.023 19498
120 1 1 . 1 1 31 31 TRP N N 31 120.552 120.552 123.128 -2.576 19498
121 1 1 . 1 1 31 31 TRP HA H 31 4.615 4.615 4.151 0.464 19498
122 1 1 . 1 1 31 31 TRP CA C 31 58.000 58.000 58.380 -0.380 19498
123 1 1 . 1 1 31 31 TRP CB C 31 31.500 31.500 28.512 2.988 19498
124 1 1 . 1 1 31 31 TRP H H 31 8.673 8.673 8.810 -0.137 19498
125 1 1 . 1 1 32 32 TYR CA C 32 52.400 52.400 57.683 -5.283 19498
126 1 1 . 1 1 32 32 TYR CB C 32 42.350 42.350 39.697 2.653 19498
127 1 1 . 1 1 33 33 ASP CA C 33 52.400 52.400 53.201 -0.801 19498
128 1 1 . 1 1 33 33 ASP CB C 33 42.350 42.350 43.200 -0.850 19498
129 1 1 . 1 1 34 34 ALA N N 34 126.709 126.709 124.210 2.499 19498
130 1 1 . 1 1 34 34 ALA HA H 34 3.845 3.845 4.345 -0.500 19498
131 1 1 . 1 1 34 34 ALA CA C 34 58.599 58.599 52.742 5.857 19498
132 1 1 . 1 1 34 34 ALA CB C 34 18.610 18.610 19.123 -0.513 19498
133 1 1 . 1 1 34 34 ALA H H 34 8.424 8.424 8.352 0.072 19498
134 1 1 . 1 1 35 35 TYR N N 35 117.123 117.123 119.183 -2.060 19498
135 1 1 . 1 1 35 35 TYR HA H 35 4.350 4.350 4.487 -0.137 19498
136 1 1 . 1 1 35 35 TYR CA C 35 60.466 60.466 59.247 1.219 19498
137 1 1 . 1 1 35 35 TYR CB C 35 38.113 38.113 39.323 -1.210 19498
138 1 1 . 1 1 35 35 TYR H H 35 8.334 8.334 8.434 -0.100 19498
139 1 1 . 1 1 36 36 THR N N 36 108.046 108.046 113.083 -5.037 19498
140 1 1 . 1 1 36 36 THR HA H 36 4.018 4.018 4.006 0.012 19498
141 1 1 . 1 1 36 36 THR CA C 36 61.809 61.809 63.061 -1.252 19498
142 1 1 . 1 1 36 36 THR CB C 36 69.926 69.926 69.329 0.597 19498
143 1 1 . 1 1 36 36 THR H H 36 7.563 7.563 7.809 -0.246 19498
144 1 1 . 1 1 37 37 ARG N N 37 118.456 118.456 118.843 -0.387 19498
145 1 1 . 1 1 37 37 ARG CA C 37 57.001 57.001 56.974 0.027 19498
146 1 1 . 1 1 37 37 ARG H H 37 7.952 7.952 8.615 -0.663 19498
147 1 1 . 1 1 40 40 CYS CA C 40 56.316 56.316 57.096 -0.780 19498
148 1 1 . 1 1 40 40 CYS CB C 40 29.999 29.999 31.085 -1.086 19498
149 1 1 . 1 1 41 41 ILE N N 41 121.419 121.419 122.181 -0.762 19498
150 1 1 . 1 1 41 41 ILE HA H 41 4.709 4.709 4.505 0.204 19498
151 1 1 . 1 1 41 41 ILE CA C 41 60.462 60.462 60.031 0.431 19498
152 1 1 . 1 1 41 41 ILE CB C 41 42.309 42.309 38.267 4.042 19498
153 1 1 . 1 1 41 41 ILE H H 41 8.459 8.459 8.397 0.062 19498
154 1 1 . 1 1 42 42 ARG N N 42 127.916 127.916 127.046 0.870 19498
155 1 1 . 1 1 42 42 ARG CA C 42 54.501 54.501 54.933 -0.432 19498
156 1 1 . 1 1 42 42 ARG CB C 42 33.204 33.204 32.510 0.694 19498
157 1 1 . 1 1 42 42 ARG H H 42 9.004 9.004 8.591 0.413 19498
158 1 1 . 1 1 43 43 LEU N N 43 124.715 124.715 125.762 -1.047 19498
159 1 1 . 1 1 43 43 LEU HA H 43 5.538 5.538 4.886 0.652 19498
160 1 1 . 1 1 43 43 LEU CA C 43 53.266 53.266 54.111 -0.845 19498
161 1 1 . 1 1 43 43 LEU CB C 43 46.163 46.163 45.898 0.265 19498
162 1 1 . 1 1 43 43 LEU H H 43 8.757 8.757 9.346 -0.589 19498
163 1 1 . 1 1 44 44 ARG N N 44 123.499 123.499 127.131 -3.632 19498
164 1 1 . 1 1 44 44 ARG HA H 44 5.004 5.004 4.940 0.064 19498
165 1 1 . 1 1 44 44 ARG CA C 44 55.508 55.508 54.717 0.791 19498
166 1 1 . 1 1 44 44 ARG CB C 44 34.543 34.543 34.351 0.192 19498
167 1 1 . 1 1 44 44 ARG H H 44 9.366 9.366 9.340 0.026 19498
168 1 1 . 1 1 45 45 ILE N N 45 122.919 122.919 125.568 -2.649 19498
169 1 1 . 1 1 45 45 ILE HA H 45 5.260 5.260 5.033 0.227 19498
170 1 1 . 1 1 45 45 ILE CA C 45 59.933 59.933 58.839 1.094 19498
171 1 1 . 1 1 45 45 ILE CB C 45 39.751 39.751 39.733 0.018 19498
172 1 1 . 1 1 45 45 ILE H H 45 8.938 8.938 9.158 -0.220 19498
173 1 1 . 1 1 46 46 GLU N N 46 126.745 126.745 123.423 3.322 19498
174 1 1 . 1 1 46 46 GLU HA H 46 5.465 5.465 4.870 0.595 19498
175 1 1 . 1 1 46 46 GLU CA C 46 53.707 53.707 55.028 -1.321 19498
176 1 1 . 1 1 46 46 GLU CB C 46 35.276 35.276 32.763 2.513 19498
177 1 1 . 1 1 46 46 GLU H H 46 9.097 9.097 8.201 0.896 19498
178 1 1 . 1 1 47 47 ASP N N 47 117.988 117.988 120.472 -2.484 19498
179 1 1 . 1 1 47 47 ASP HA H 47 4.976 4.976 4.665 0.311 19498
180 1 1 . 1 1 47 47 ASP CA C 47 52.411 52.411 53.092 -0.681 19498
181 1 1 . 1 1 47 47 ASP CB C 47 41.609 41.609 42.613 -1.004 19498
182 1 1 . 1 1 47 47 ASP H H 47 8.209 8.209 8.302 -0.093 19498
183 1 1 . 1 1 48 48 ARG N N 48 117.098 117.098 118.064 -0.966 19498
184 1 1 . 1 1 48 48 ARG HA H 48 4.129 4.129 4.369 -0.240 19498
185 1 1 . 1 1 48 48 ARG CA C 48 58.323 58.323 57.415 0.908 19498
186 1 1 . 1 1 48 48 ARG CB C 48 29.511 29.511 30.340 -0.829 19498
187 1 1 . 1 1 48 48 ARG H H 48 8.872 8.872 8.498 0.374 19498
188 1 1 . 1 1 49 49 SER N N 49 115.006 115.006 115.535 -0.529 19498
189 1 1 . 1 1 49 49 SER HA H 49 4.614 4.614 4.451 0.163 19498
190 1 1 . 1 1 49 49 SER CA C 49 58.411 58.411 60.021 -1.610 19498
191 1 1 . 1 1 49 49 SER CB C 49 63.806 63.806 64.768 -0.962 19498
192 1 1 . 1 1 49 49 SER H H 49 8.142 8.142 8.600 -0.458 19498
193 1 1 . 1 1 50 50 GLY N N 50 109.042 109.042 107.183 1.859 19498
194 1 1 . 1 1 50 50 GLY CA C 50 44.997 44.997 45.292 -0.295 19498
195 1 1 . 1 1 50 50 GLY H H 50 8.035 8.035 7.984 0.051 19498
196 1 1 . 1 1 51 51 ASN N N 51 119.842 119.842 122.245 -2.403 19498
197 1 1 . 1 1 51 51 ASN HA H 51 4.546 4.546 4.617 -0.071 19498
198 1 1 . 1 1 51 51 ASN CA C 51 53.419 53.419 53.703 -0.284 19498
199 1 1 . 1 1 51 51 ASN CB C 51 38.422 38.422 38.181 0.241 19498
200 1 1 . 1 1 51 51 ASN H H 51 8.613 8.613 8.380 0.233 19498
201 1 1 . 1 1 52 52 LEU N N 52 124.085 124.085 120.902 3.183 19498
202 1 1 . 1 1 52 52 LEU HA H 52 4.142 4.142 4.579 -0.437 19498
203 1 1 . 1 1 52 52 LEU CA C 52 56.023 56.023 55.119 0.904 19498
204 1 1 . 1 1 52 52 LEU CB C 52 42.353 42.353 42.590 -0.237 19498
205 1 1 . 1 1 52 52 LEU H H 52 8.631 8.631 8.206 0.425 19498
206 1 1 . 1 1 53 53 ILE N N 53 129.362 129.362 121.818 7.544 19498
207 1 1 . 1 1 53 53 ILE HA H 53 4.137 4.137 4.414 -0.277 19498
208 1 1 . 1 1 53 53 ILE CA C 53 61.800 61.800 62.043 -0.243 19498
209 1 1 . 1 1 53 53 ILE CB C 53 37.256 37.256 38.770 -1.514 19498
210 1 1 . 1 1 53 53 ILE H H 53 9.432 9.432 8.505 0.927 19498
211 1 1 . 1 1 54 54 ASP N N 54 113.575 113.575 117.126 -3.551 19498
212 1 1 . 1 1 54 54 ASP HA H 54 4.847 4.847 4.945 -0.098 19498
213 1 1 . 1 1 54 54 ASP CA C 54 53.586 53.586 54.224 -0.638 19498
214 1 1 . 1 1 54 54 ASP CB C 54 44.500 44.500 44.508 -0.008 19498
215 1 1 . 1 1 54 54 ASP H H 54 7.761 7.761 7.872 -0.111 19498
216 1 1 . 1 1 55 55 THR N N 55 115.783 115.783 115.485 0.298 19498
217 1 1 . 1 1 55 55 THR HA H 55 5.427 5.427 4.977 0.450 19498
218 1 1 . 1 1 55 55 THR CA C 55 59.185 59.185 61.094 -1.909 19498
219 1 1 . 1 1 55 55 THR CB C 55 70.551 70.551 70.697 -0.146 19498
220 1 1 . 1 1 55 55 THR H H 55 10.106 10.106 8.287 1.819 19498
221 1 1 . 1 1 56 56 SER N N 56 119.808 119.808 119.396 0.412 19498
222 1 1 . 1 1 56 56 SER HA H 56 4.135 4.135 4.580 -0.445 19498
223 1 1 . 1 1 56 56 SER CA C 56 58.001 58.001 57.222 0.779 19498
224 1 1 . 1 1 56 56 SER CB C 56 65.039 65.039 64.536 0.503 19498
225 1 1 . 1 1 56 56 SER H H 56 7.872 7.872 9.084 -1.212 19498
226 1 1 . 1 1 57 57 THR N N 57 117.962 117.962 120.866 -2.904 19498
227 1 1 . 1 1 57 57 THR HA H 57 4.964 4.964 4.971 -0.007 19498
228 1 1 . 1 1 57 57 THR CA C 57 61.001 61.001 61.561 -0.560 19498
229 1 1 . 1 1 57 57 THR CB C 57 70.881 70.881 70.022 0.859 19498
230 1 1 . 1 1 57 57 THR H H 57 7.524 7.524 7.946 -0.422 19498
231 1 1 . 1 1 58 58 PHE N N 58 123.853 123.853 127.498 -3.645 19498
232 1 1 . 1 1 58 58 PHE HA H 58 4.603 4.603 4.751 -0.148 19498
233 1 1 . 1 1 58 58 PHE CA C 58 56.648 56.648 57.401 -0.754 19498
234 1 1 . 1 1 58 58 PHE CB C 58 43.583 43.583 41.192 2.391 19498
235 1 1 . 1 1 58 58 PHE H H 58 8.861 8.861 9.330 -0.469 19498
236 1 1 . 1 1 59 59 TYR N N 59 117.898 117.898 120.998 -3.100 19498
237 1 1 . 1 1 59 59 TYR HA H 59 5.328 5.328 4.892 0.436 19498
238 1 1 . 1 1 59 59 TYR CA C 59 56.221 56.221 57.928 -1.707 19498
239 1 1 . 1 1 59 59 TYR CB C 59 42.106 42.106 39.903 2.203 19498
240 1 1 . 1 1 59 59 TYR H H 59 8.328 8.328 8.414 -0.086 19498
241 1 1 . 1 1 60 60 HIS CA C 60 60.065 60.065 55.574 4.491 19498
242 1 1 . 1 1 60 60 HIS CB C 60 34.284 34.284 30.881 3.403 19498
243 1 1 . 1 1 61 61 HIS N N 61 121.880 121.880 119.531 2.349 19498
244 1 1 . 1 1 61 61 HIS CA C 61 58.001 58.001 56.289 1.712 19498
245 1 1 . 1 1 61 61 HIS CB C 61 29.999 29.999 30.675 -0.676 19498
246 1 1 . 1 1 61 61 HIS H H 61 7.734 7.734 7.708 0.026 19498
247 1 1 . 1 1 62 62 ASP N N 62 128.148 128.148 120.231 7.917 19498
248 1 1 . 1 1 62 62 ASP HA H 62 4.870 4.870 4.271 0.599 19498
249 1 1 . 1 1 62 62 ASP CA C 62 53.348 53.348 55.448 -2.100 19498
250 1 1 . 1 1 62 62 ASP CB C 62 42.600 42.600 41.200 1.400 19498
251 1 1 . 1 1 62 62 ASP H H 62 11.492 11.492 7.680 3.812 19498
252 1 1 . 1 1 63 63 GLU N N 63 126.564 126.564 120.294 6.270 19498
253 1 1 . 1 1 63 63 GLU HA H 63 3.795 3.795 3.868 -0.073 19498
254 1 1 . 1 1 63 63 GLU CA C 63 59.863 59.863 59.944 -0.081 19498
255 1 1 . 1 1 63 63 GLU CB C 63 34.007 34.007 29.243 4.764 19498
256 1 1 . 1 1 63 63 GLU H H 63 8.982 8.982 8.767 0.215 19498
257 1 1 . 1 1 64 64 ASP N N 64 117.779 117.779 119.642 -1.863 19498
258 1 1 . 1 1 64 64 ASP HA H 64 4.401 4.401 4.482 -0.081 19498
259 1 1 . 1 1 64 64 ASP CA C 64 57.664 57.664 57.413 0.251 19498
260 1 1 . 1 1 64 64 ASP CB C 64 40.369 40.369 40.501 -0.132 19498
261 1 1 . 1 1 64 64 ASP H H 64 8.272 8.272 8.500 -0.228 19498
262 1 1 . 1 1 65 65 VAL N N 65 121.948 121.948 120.353 1.595 19498
263 1 1 . 1 1 65 65 VAL HA H 65 3.386 3.386 3.929 -0.543 19498
264 1 1 . 1 1 65 65 VAL CA C 65 65.913 65.913 65.144 0.769 19498
265 1 1 . 1 1 65 65 VAL CB C 65 31.465 31.465 31.987 -0.522 19498
266 1 1 . 1 1 65 65 VAL H H 65 7.335 7.335 7.668 -0.333 19498
267 1 1 . 1 1 66 66 LEU N N 66 120.747 120.747 121.712 -0.965 19498
268 1 1 . 1 1 66 66 LEU HA H 66 3.905 3.905 3.967 -0.062 19498
269 1 1 . 1 1 66 66 LEU CA C 66 58.076 58.076 58.131 -0.055 19498
270 1 1 . 1 1 66 66 LEU CB C 66 42.160 42.160 40.469 1.691 19498
271 1 1 . 1 1 66 66 LEU H H 66 8.164 8.164 7.670 0.494 19498
272 1 1 . 1 1 67 67 PHE N N 67 116.553 116.553 117.964 -1.411 19498
273 1 1 . 1 1 67 67 PHE HA H 67 3.900 3.900 3.974 -0.074 19498
274 1 1 . 1 1 67 67 PHE CA C 67 62.849 62.849 62.318 0.531 19498
275 1 1 . 1 1 67 67 PHE CB C 67 38.003 38.003 37.900 0.103 19498
276 1 1 . 1 1 67 67 PHE H H 67 8.350 8.350 8.461 -0.111 19498
277 1 1 . 1 1 68 68 ASN N N 68 121.020 121.020 118.802 2.218 19498
278 1 1 . 1 1 68 68 ASN HA H 68 4.415 4.415 4.424 -0.009 19498
279 1 1 . 1 1 68 68 ASN CA C 68 56.725 56.725 56.638 0.087 19498
280 1 1 . 1 1 68 68 ASN CB C 68 38.071 38.071 38.661 -0.590 19498
281 1 1 . 1 1 68 68 ASN H H 68 8.001 8.001 8.005 -0.004 19498
282 1 1 . 1 1 69 69 MET N N 69 120.402 120.402 119.128 1.274 19498
283 1 1 . 1 1 69 69 MET HA H 69 4.011 4.011 4.102 -0.091 19498
284 1 1 . 1 1 69 69 MET CA C 69 59.605 59.605 59.365 0.240 19498
285 1 1 . 1 1 69 69 MET CB C 69 31.867 31.867 32.470 -0.603 19498
286 1 1 . 1 1 69 69 MET H H 69 8.465 8.465 7.991 0.474 19498
287 1 1 . 1 1 70 70 CYS N N 70 117.496 117.496 117.393 0.103 19498
288 1 1 . 1 1 70 70 CYS CA C 70 63.145 63.145 63.840 -0.695 19498
289 1 1 . 1 1 70 70 CYS CB C 70 27.510 27.510 26.746 0.764 19498
290 1 1 . 1 1 70 70 CYS H H 70 7.616 7.616 7.910 -0.294 19498
291 1 1 . 1 1 71 71 THR N N 71 118.640 118.640 115.265 3.375 19498
292 1 1 . 1 1 71 71 THR HA H 71 4.270 4.270 4.100 0.170 19498
293 1 1 . 1 1 71 71 THR CA C 71 67.980 67.980 66.276 1.704 19498
294 1 1 . 1 1 71 71 THR CB C 71 67.949 67.949 68.548 -0.599 19498
295 1 1 . 1 1 71 71 THR H H 71 8.509 8.509 8.513 -0.004 19498
296 1 1 . 1 1 72 72 ASP HA H 72 4.430 4.430 4.434 -0.004 19498
297 1 1 . 1 1 72 72 ASP CA C 72 57.590 57.590 57.789 -0.199 19498
298 1 1 . 1 1 72 72 ASP CB C 72 40.415 40.415 40.739 -0.324 19498
299 1 1 . 1 1 73 73 TRP N N 73 121.657 121.657 121.377 0.280 19498
300 1 1 . 1 1 73 73 TRP HA H 73 4.407 4.407 4.316 0.091 19498
301 1 1 . 1 1 73 73 TRP CA C 73 62.951 62.951 61.717 1.234 19498
302 1 1 . 1 1 73 73 TRP CB C 73 29.114 29.114 29.734 -0.620 19498
303 1 1 . 1 1 73 73 TRP H H 73 7.780 7.780 7.712 0.068 19498
304 1 1 . 1 1 74 74 LEU N N 74 118.727 118.727 118.795 -0.068 19498
305 1 1 . 1 1 74 74 LEU HA H 74 3.582 3.582 3.520 0.062 19498
306 1 1 . 1 1 74 74 LEU CA C 74 58.184 58.184 57.836 0.348 19498
307 1 1 . 1 1 74 74 LEU CB C 74 37.610 37.610 41.430 -3.820 19498
308 1 1 . 1 1 74 74 LEU H H 74 8.490 8.490 7.694 0.796 19498
309 1 1 . 1 1 75 75 ASN N N 75 117.962 117.962 116.626 1.336 19498
310 1 1 . 1 1 75 75 ASN HA H 75 4.527 4.527 4.088 0.439 19498
311 1 1 . 1 1 75 75 ASN CA C 75 56.501 56.501 55.835 0.666 19498
312 1 1 . 1 1 75 75 ASN CB C 75 37.999 37.999 38.818 -0.819 19498
313 1 1 . 1 1 75 75 ASN H H 75 8.639 8.639 7.602 1.037 19498
314 1 1 . 1 1 76 76 HIS N N 76 120.823 120.823 119.511 1.312 19498
315 1 1 . 1 1 76 76 HIS HA H 76 4.450 4.450 4.109 0.341 19498
316 1 1 . 1 1 76 76 HIS CA C 76 58.737 58.737 59.354 -0.617 19498
317 1 1 . 1 1 76 76 HIS CB C 76 28.007 28.007 29.779 -1.772 19498
318 1 1 . 1 1 76 76 HIS H H 76 8.158 8.158 7.476 0.682 19498
319 1 1 . 1 1 77 77 MET N N 77 118.749 118.749 115.846 2.903 19498
320 1 1 . 1 1 77 77 MET HA H 77 4.071 4.071 3.710 0.361 19498
321 1 1 . 1 1 77 77 MET CA C 77 55.827 55.827 57.558 -1.731 19498
322 1 1 . 1 1 77 77 MET CB C 77 29.541 29.541 31.784 -2.243 19498
323 1 1 . 1 1 77 77 MET H H 77 8.404 8.404 7.103 1.301 19498
324 1 1 . 1 1 78 78 TYR N N 78 120.762 120.762 120.202 0.560 19498
325 1 1 . 1 1 78 78 TYR HA H 78 3.662 3.662 3.960 -0.298 19498
326 1 1 . 1 1 78 78 TYR CA C 78 62.640 62.640 60.147 2.493 19498
327 1 1 . 1 1 78 78 TYR CB C 78 37.545 37.545 37.263 0.282 19498
328 1 1 . 1 1 78 78 TYR H H 78 8.322 8.322 7.190 1.132 19498
329 1 1 . 1 1 79 79 ASP N N 79 116.578 116.578 116.857 -0.279 19498
330 1 1 . 1 1 79 79 ASP HA H 79 4.106 4.106 4.338 -0.232 19498
331 1 1 . 1 1 79 79 ASP CA C 79 57.410 57.410 57.171 0.239 19498
332 1 1 . 1 1 79 79 ASP CB C 79 40.503 40.503 40.912 -0.409 19498
333 1 1 . 1 1 79 79 ASP H H 79 7.460 7.460 7.961 -0.501 19498
334 1 1 . 1 1 80 80 GLN N N 80 116.175 116.175 118.064 -1.889 19498
335 1 1 . 1 1 80 80 GLN HA H 80 4.056 4.056 4.036 0.020 19498
336 1 1 . 1 1 80 80 GLN CA C 80 57.629 57.629 58.439 -0.810 19498
337 1 1 . 1 1 80 80 GLN CB C 80 29.662 29.662 28.584 1.078 19498
338 1 1 . 1 1 80 80 GLN H H 80 7.552 7.552 7.717 -0.165 19498
339 1 1 . 1 1 81 81 LEU N N 81 118.398 118.398 116.888 1.510 19498
340 1 1 . 1 1 81 81 LEU HA H 81 4.233 4.233 4.253 -0.020 19498
341 1 1 . 1 1 81 81 LEU CA C 81 55.461 55.461 56.086 -0.625 19498
342 1 1 . 1 1 81 81 LEU CB C 81 42.406 42.406 41.645 0.761 19498
343 1 1 . 1 1 81 81 LEU H H 81 7.957 7.957 7.914 0.043 19498
344 1 1 . 1 1 82 82 LYS N N 82 119.114 119.114 118.870 0.244 19498
345 1 1 . 1 1 82 82 LYS HA H 82 3.841 3.841 4.179 -0.338 19498
346 1 1 . 1 1 82 82 LYS CA C 82 58.510 58.510 58.280 0.230 19498
347 1 1 . 1 1 82 82 LYS CB C 82 30.922 30.922 32.616 -1.694 19498
348 1 1 . 1 1 82 82 LYS H H 82 7.664 7.664 7.500 0.164 19498
349 1 1 . 1 1 83 83 ASP N N 83 118.655 118.655 119.636 -0.981 19498
350 1 1 . 1 1 83 83 ASP HA H 83 4.819 4.819 4.642 0.177 19498
351 1 1 . 1 1 83 83 ASP CA C 83 53.886 53.886 55.249 -1.363 19498
352 1 1 . 1 1 83 83 ASP CB C 83 40.986 40.986 41.815 -0.828 19498
353 1 1 . 1 1 83 83 ASP H H 83 7.862 7.862 7.938 -0.076 19498
354 1 1 . 1 1 84 84 TRP N N 84 121.757 121.757 121.015 0.742 19498
355 1 1 . 1 1 84 84 TRP CA C 84 58.462 58.462 57.284 1.178 19498
356 1 1 . 1 1 84 84 TRP CB C 84 28.934 28.934 29.617 -0.683 19498
357 1 1 . 1 1 84 84 TRP H H 84 7.925 7.925 7.659 0.266 19498
358 1 2 . 1 1 6 6 SER CA C 6 56.008 56.008 57.706 -1.698 19498
359 1 2 . 1 1 7 7 GLY N N 7 109.496 109.496 108.818 0.678 19498
360 1 2 . 1 1 7 7 GLY CA C 7 46.042 46.042 45.759 0.283 19498
361 1 2 . 1 1 7 7 GLY H H 7 8.432 8.432 8.430 0.002 19498
362 1 2 . 1 1 8 8 ASN N N 8 119.432 119.432 117.647 1.785 19498
363 1 2 . 1 1 8 8 ASN HA H 8 4.685 4.685 4.643 0.042 19498
364 1 2 . 1 1 8 8 ASN CA C 8 53.922 53.922 52.695 1.227 19498
365 1 2 . 1 1 8 8 ASN CB C 8 37.970 37.970 38.831 -0.861 19498
366 1 2 . 1 1 8 8 ASN H H 8 8.367 8.367 7.882 0.485 19498
367 1 2 . 1 1 9 9 LEU N N 9 123.537 123.537 120.296 3.241 19498
368 1 2 . 1 1 9 9 LEU HA H 9 3.984 3.984 4.577 -0.593 19498
369 1 2 . 1 1 9 9 LEU CA C 9 56.417 56.417 54.494 1.923 19498
370 1 2 . 1 1 9 9 LEU CB C 9 41.566 41.566 41.610 -0.044 19498
371 1 2 . 1 1 9 9 LEU H H 9 7.922 7.922 7.729 0.193 19498
372 1 2 . 1 1 10 10 ALA N N 10 122.287 122.287 124.059 -1.772 19498
373 1 2 . 1 1 10 10 ALA HA H 10 4.127 4.127 3.952 0.175 19498
374 1 2 . 1 1 10 10 ALA CA C 10 55.912 55.912 55.108 0.804 19498
375 1 2 . 1 1 10 10 ALA CB C 10 17.998 17.998 18.366 -0.368 19498
376 1 2 . 1 1 10 10 ALA H H 10 8.064 8.064 8.045 0.019 19498
377 1 2 . 1 1 11 11 ALA N N 11 121.326 121.326 119.652 1.674 19498
378 1 2 . 1 1 11 11 ALA HA H 11 4.207 4.207 4.234 -0.027 19498
379 1 2 . 1 1 11 11 ALA CA C 11 54.960 54.960 53.864 1.096 19498
380 1 2 . 1 1 11 11 ALA CB C 11 17.998 17.998 18.424 -0.426 19498
381 1 2 . 1 1 11 11 ALA H H 11 8.143 8.143 8.244 -0.101 19498
382 1 2 . 1 1 12 12 PHE N N 12 122.913 122.913 119.506 3.407 19498
383 1 2 . 1 1 12 12 PHE HA H 12 4.411 4.411 4.206 0.205 19498
384 1 2 . 1 1 12 12 PHE CA C 12 61.007 61.007 60.877 0.130 19498
385 1 2 . 1 1 12 12 PHE CB C 12 39.499 39.499 39.278 0.221 19498
386 1 2 . 1 1 12 12 PHE H H 12 7.779 7.779 8.121 -0.342 19498
387 1 2 . 1 1 13 13 LYS N N 13 120.689 120.689 118.400 2.289 19498
388 1 2 . 1 1 13 13 LYS HA H 13 3.861 3.861 4.150 -0.289 19498
389 1 2 . 1 1 13 13 LYS CA C 13 59.099 59.099 58.735 0.364 19498
390 1 2 . 1 1 13 13 LYS CB C 13 31.867 31.867 31.607 0.260 19498
391 1 2 . 1 1 13 13 LYS H H 13 8.614 8.614 8.464 0.150 19498
392 1 2 . 1 1 14 14 ALA N N 14 122.076 122.076 120.756 1.320 19498
393 1 2 . 1 1 14 14 ALA HA H 14 3.182 3.182 4.106 -0.924 19498
394 1 2 . 1 1 14 14 ALA CA C 14 55.108 55.108 54.924 0.184 19498
395 1 2 . 1 1 14 14 ALA CB C 14 18.120 18.120 18.070 0.050 19498
396 1 2 . 1 1 14 14 ALA H H 14 8.178 8.178 8.019 0.159 19498
397 1 2 . 1 1 15 15 ALA N N 15 121.714 121.714 119.906 1.808 19498
398 1 2 . 1 1 15 15 ALA HA H 15 4.040 4.040 4.068 -0.028 19498
399 1 2 . 1 1 15 15 ALA CA C 15 55.158 55.158 54.132 1.026 19498
400 1 2 . 1 1 15 15 ALA CB C 15 19.042 19.042 18.156 0.886 19498
401 1 2 . 1 1 15 15 ALA H H 15 7.793 7.793 7.409 0.384 19498
402 1 2 . 1 1 16 16 THR N N 16 111.959 111.959 115.966 -4.007 19498
403 1 2 . 1 1 16 16 THR HA H 16 3.705 3.705 3.830 -0.125 19498
404 1 2 . 1 1 16 16 THR CA C 16 66.762 66.762 67.450 -0.688 19498
405 1 2 . 1 1 16 16 THR CB C 16 68.213 68.213 68.525 -0.312 19498
406 1 2 . 1 1 16 16 THR H H 16 8.133 8.133 7.674 0.459 19498
407 1 2 . 1 1 17 17 ASN N N 17 121.090 121.090 119.043 2.047 19498
408 1 2 . 1 1 17 17 ASN HA H 17 4.520 4.520 4.461 0.059 19498
409 1 2 . 1 1 17 17 ASN CA C 17 56.191 56.191 56.177 0.014 19498
410 1 2 . 1 1 17 17 ASN CB C 17 38.365 38.365 38.661 -0.296 19498
411 1 2 . 1 1 17 17 ASN H H 17 8.152 8.152 7.728 0.424 19498
412 1 2 . 1 1 18 18 LYS N N 18 119.978 119.978 119.463 0.515 19498
413 1 2 . 1 1 18 18 LYS HA H 18 3.914 3.914 4.210 -0.296 19498
414 1 2 . 1 1 18 18 LYS CA C 18 59.865 59.865 58.898 0.967 19498
415 1 2 . 1 1 18 18 LYS CB C 18 30.999 30.999 31.450 -0.451 19498
416 1 2 . 1 1 18 18 LYS H H 18 7.568 7.568 7.922 -0.354 19498
417 1 2 . 1 1 19 19 LEU N N 19 117.558 117.558 119.911 -2.353 19498
418 1 2 . 1 1 19 19 LEU HA H 19 4.135 4.135 4.328 -0.193 19498
419 1 2 . 1 1 19 19 LEU CA C 19 58.001 58.001 58.583 -0.582 19498
420 1 2 . 1 1 19 19 LEU CB C 19 40.823 40.823 42.003 -1.180 19498
421 1 2 . 1 1 19 19 LEU H H 19 7.001 7.001 7.532 -0.531 19498
422 1 2 . 1 1 20 20 PHE N N 20 121.123 121.123 119.335 1.788 19498
423 1 2 . 1 1 20 20 PHE HA H 20 4.873 4.873 4.160 0.713 19498
424 1 2 . 1 1 20 20 PHE CA C 20 60.375 60.375 61.259 -0.884 19498
425 1 2 . 1 1 20 20 PHE CB C 20 38.480 38.480 38.963 -0.483 19498
426 1 2 . 1 1 20 20 PHE H H 20 8.193 8.193 7.659 0.534 19498
427 1 2 . 1 1 21 21 GLN N N 21 118.591 118.591 119.181 -0.590 19498
428 1 2 . 1 1 21 21 GLN HA H 21 4.208 4.208 3.980 0.228 19498
429 1 2 . 1 1 21 21 GLN CA C 21 58.055 58.055 58.658 -0.603 19498
430 1 2 . 1 1 21 21 GLN CB C 21 28.284 28.284 28.885 -0.601 19498
431 1 2 . 1 1 21 21 GLN H H 21 7.918 7.918 7.753 0.165 19498
432 1 2 . 1 1 22 22 LEU N N 22 118.477 118.477 117.996 0.481 19498
433 1 2 . 1 1 22 22 LEU HA H 22 4.534 4.534 4.458 0.076 19498
434 1 2 . 1 1 22 22 LEU CA C 22 54.033 54.033 54.769 -0.736 19498
435 1 2 . 1 1 22 22 LEU CB C 22 41.469 41.469 41.517 -0.048 19498
436 1 2 . 1 1 22 22 LEU H H 22 7.561 7.561 7.814 -0.253 19498
437 1 2 . 1 1 23 23 ASP N N 23 115.410 115.410 118.053 -2.643 19498
438 1 2 . 1 1 23 23 ASP HA H 23 4.280 4.280 4.050 0.230 19498
439 1 2 . 1 1 23 23 ASP CA C 23 55.494 55.494 55.303 0.191 19498
440 1 2 . 1 1 23 23 ASP CB C 23 39.317 39.317 39.334 -0.017 19498
441 1 2 . 1 1 23 23 ASP H H 23 8.163 8.163 7.648 0.515 19498
442 1 2 . 1 1 24 24 LEU N N 24 116.367 116.367 116.272 0.095 19498
443 1 2 . 1 1 24 24 LEU HA H 24 4.790 4.790 4.868 -0.078 19498
444 1 2 . 1 1 24 24 LEU CA C 24 53.030 53.030 53.302 -0.272 19498
445 1 2 . 1 1 24 24 LEU CB C 24 43.867 43.867 44.231 -0.364 19498
446 1 2 . 1 1 24 24 LEU H H 24 7.136 7.136 7.856 -0.720 19498
447 1 2 . 1 1 25 25 ALA N N 25 123.243 123.243 120.314 2.929 19498
448 1 2 . 1 1 25 25 ALA HA H 25 4.480 4.480 4.750 -0.270 19498
449 1 2 . 1 1 25 25 ALA CA C 25 50.890 50.890 51.793 -0.903 19498
450 1 2 . 1 1 25 25 ALA CB C 25 21.655 21.655 21.880 -0.225 19498
451 1 2 . 1 1 25 25 ALA H H 25 8.931 8.931 8.206 0.725 19498
452 1 2 . 1 1 26 26 VAL N N 26 119.587 119.587 120.194 -0.607 19498
453 1 2 . 1 1 26 26 VAL HA H 26 4.889 4.889 4.699 0.190 19498
454 1 2 . 1 1 26 26 VAL CA C 26 61.278 61.278 61.007 0.271 19498
455 1 2 . 1 1 26 26 VAL CB C 26 33.310 33.310 35.483 -2.173 19498
456 1 2 . 1 1 26 26 VAL H H 26 7.575 7.575 8.381 -0.806 19498
457 1 2 . 1 1 27 27 ILE N N 27 130.377 130.377 122.766 7.611 19498
458 1 2 . 1 1 27 27 ILE HA H 27 4.489 4.489 4.795 -0.306 19498
459 1 2 . 1 1 27 27 ILE CA C 27 60.177 60.177 60.406 -0.229 19498
460 1 2 . 1 1 27 27 ILE CB C 27 40.019 40.019 40.823 -0.804 19498
461 1 2 . 1 1 27 27 ILE H H 27 9.437 9.437 8.091 1.346 19498
462 1 2 . 1 1 28 28 TYR N N 28 126.844 126.844 122.284 4.560 19498
463 1 2 . 1 1 28 28 TYR HA H 28 5.709 5.709 5.673 0.036 19498
464 1 2 . 1 1 28 28 TYR CA C 28 55.486 55.486 55.188 0.298 19498
465 1 2 . 1 1 28 28 TYR CB C 28 42.019 42.019 40.317 1.702 19498
466 1 2 . 1 1 28 28 TYR H H 28 8.531 8.531 8.208 0.323 19498
467 1 2 . 1 1 29 29 ASP N N 29 122.875 122.875 124.914 -2.039 19498
468 1 2 . 1 1 29 29 ASP HA H 29 4.966 4.966 4.691 0.275 19498
469 1 2 . 1 1 29 29 ASP CA C 29 53.659 53.659 53.820 -0.161 19498
470 1 2 . 1 1 29 29 ASP CB C 29 44.660 44.660 44.277 0.383 19498
471 1 2 . 1 1 29 29 ASP H H 29 8.614 8.614 8.883 -0.269 19498
472 1 2 . 1 1 30 30 ASP N N 30 119.325 119.325 119.471 -0.146 19498
473 1 2 . 1 1 30 30 ASP HA H 30 5.447 5.447 4.996 0.451 19498
474 1 2 . 1 1 30 30 ASP CA C 30 53.501 53.501 53.373 0.127 19498
475 1 2 . 1 1 30 30 ASP CB C 30 43.921 43.921 42.594 1.327 19498
476 1 2 . 1 1 30 30 ASP H H 30 8.607 8.607 7.773 0.834 19498
477 1 2 . 1 1 31 31 TRP N N 31 120.552 120.552 123.819 -3.267 19498
478 1 2 . 1 1 31 31 TRP HA H 31 4.615 4.615 4.869 -0.254 19498
479 1 2 . 1 1 31 31 TRP CA C 31 58.000 58.000 57.597 0.403 19498
480 1 2 . 1 1 31 31 TRP CB C 31 31.500 31.500 32.203 -0.703 19498
481 1 2 . 1 1 31 31 TRP H H 31 8.673 8.673 8.443 0.230 19498
482 1 2 . 1 1 32 32 TYR CA C 32 52.400 52.400 57.991 -5.591 19498
483 1 2 . 1 1 32 32 TYR CB C 32 42.350 42.350 37.812 4.537 19498
484 1 2 . 1 1 33 33 ASP CA C 33 52.400 52.400 53.783 -1.383 19498
485 1 2 . 1 1 33 33 ASP CB C 33 42.350 42.350 41.620 0.730 19498
486 1 2 . 1 1 34 34 ALA N N 34 126.709 126.709 123.972 2.737 19498
487 1 2 . 1 1 34 34 ALA HA H 34 3.845 3.845 4.183 -0.338 19498
488 1 2 . 1 1 34 34 ALA CA C 34 58.599 58.599 52.452 6.147 19498
489 1 2 . 1 1 34 34 ALA CB C 34 18.610 18.610 18.122 0.488 19498
490 1 2 . 1 1 34 34 ALA H H 34 8.424 8.424 7.880 0.544 19498
491 1 2 . 1 1 35 35 TYR N N 35 117.123 117.123 127.310 -10.187 19498
492 1 2 . 1 1 35 35 TYR HA H 35 4.350 4.350 4.015 0.335 19498
493 1 2 . 1 1 35 35 TYR CA C 35 60.466 60.466 61.043 -0.577 19498
494 1 2 . 1 1 35 35 TYR CB C 35 38.113 38.113 38.392 -0.279 19498
495 1 2 . 1 1 35 35 TYR H H 35 8.334 8.334 8.393 -0.059 19498
496 1 2 . 1 1 36 36 THR N N 36 108.046 108.046 113.797 -5.751 19498
497 1 2 . 1 1 36 36 THR HA H 36 4.018 4.018 4.287 -0.269 19498
498 1 2 . 1 1 36 36 THR CA C 36 61.809 61.809 63.000 -1.191 19498
499 1 2 . 1 1 36 36 THR CB C 36 69.926 69.926 68.689 1.236 19498
500 1 2 . 1 1 36 36 THR H H 36 7.563 7.563 8.299 -0.736 19498
501 1 2 . 1 1 37 37 ARG N N 37 118.456 118.456 120.461 -2.005 19498
502 1 2 . 1 1 37 37 ARG CA C 37 57.001 57.001 54.498 2.503 19498
503 1 2 . 1 1 37 37 ARG H H 37 7.952 7.952 7.195 0.757 19498
504 1 2 . 1 1 40 40 CYS CA C 40 56.316 56.316 58.201 -1.885 19498
505 1 2 . 1 1 40 40 CYS CB C 40 29.999 29.999 30.588 -0.589 19498
506 1 2 . 1 1 41 41 ILE N N 41 121.419 121.419 121.979 -0.560 19498
507 1 2 . 1 1 41 41 ILE HA H 41 4.709 4.709 4.508 0.201 19498
508 1 2 . 1 1 41 41 ILE CA C 41 60.462 60.462 60.922 -0.460 19498
509 1 2 . 1 1 41 41 ILE CB C 41 42.309 42.309 38.575 3.734 19498
510 1 2 . 1 1 41 41 ILE H H 41 8.459 8.459 7.739 0.720 19498
511 1 2 . 1 1 42 42 ARG N N 42 127.916 127.916 127.106 0.810 19498
512 1 2 . 1 1 42 42 ARG CA C 42 54.501 54.501 54.478 0.023 19498
513 1 2 . 1 1 42 42 ARG CB C 42 33.204 33.204 32.334 0.870 19498
514 1 2 . 1 1 42 42 ARG H H 42 9.004 9.004 9.055 -0.051 19498
515 1 2 . 1 1 43 43 LEU N N 43 124.715 124.715 126.119 -1.404 19498
516 1 2 . 1 1 43 43 LEU HA H 43 5.538 5.538 5.200 0.338 19498
517 1 2 . 1 1 43 43 LEU CA C 43 53.266 53.266 54.344 -1.078 19498
518 1 2 . 1 1 43 43 LEU CB C 43 46.163 46.163 43.553 2.610 19498
519 1 2 . 1 1 43 43 LEU H H 43 8.757 8.757 9.094 -0.337 19498
520 1 2 . 1 1 44 44 ARG N N 44 123.499 123.499 125.472 -1.973 19498
521 1 2 . 1 1 44 44 ARG HA H 44 5.004 5.004 5.046 -0.042 19498
522 1 2 . 1 1 44 44 ARG CA C 44 55.508 55.508 54.951 0.557 19498
523 1 2 . 1 1 44 44 ARG CB C 44 34.543 34.543 33.514 1.028 19498
524 1 2 . 1 1 44 44 ARG H H 44 9.366 9.366 8.695 0.671 19498
525 1 2 . 1 1 45 45 ILE N N 45 122.919 122.919 127.122 -4.203 19498
526 1 2 . 1 1 45 45 ILE HA H 45 5.260 5.260 4.604 0.656 19498
527 1 2 . 1 1 45 45 ILE CA C 45 59.933 59.933 58.913 1.020 19498
528 1 2 . 1 1 45 45 ILE CB C 45 39.751 39.751 39.571 0.180 19498
529 1 2 . 1 1 45 45 ILE H H 45 8.938 8.938 8.527 0.411 19498
530 1 2 . 1 1 46 46 GLU N N 46 126.745 126.745 125.914 0.831 19498
531 1 2 . 1 1 46 46 GLU HA H 46 5.465 5.465 4.542 0.923 19498
532 1 2 . 1 1 46 46 GLU CA C 46 53.707 53.707 55.420 -1.714 19498
533 1 2 . 1 1 46 46 GLU CB C 46 35.276 35.276 32.989 2.288 19498
534 1 2 . 1 1 46 46 GLU H H 46 9.097 9.097 8.657 0.440 19498
535 1 2 . 1 1 47 47 ASP N N 47 117.988 117.988 125.052 -7.064 19498
536 1 2 . 1 1 47 47 ASP HA H 47 4.976 4.976 4.793 0.183 19498
537 1 2 . 1 1 47 47 ASP CA C 47 52.411 52.411 53.544 -1.133 19498
538 1 2 . 1 1 47 47 ASP CB C 47 41.609 41.609 42.998 -1.389 19498
539 1 2 . 1 1 47 47 ASP H H 47 8.209 8.209 8.645 -0.436 19498
540 1 2 . 1 1 48 48 ARG N N 48 117.098 117.098 120.461 -3.363 19498
541 1 2 . 1 1 48 48 ARG HA H 48 4.129 4.129 4.290 -0.161 19498
542 1 2 . 1 1 48 48 ARG CA C 48 58.323 58.323 56.801 1.522 19498
543 1 2 . 1 1 48 48 ARG CB C 48 29.511 29.511 29.568 -0.057 19498
544 1 2 . 1 1 48 48 ARG H H 48 8.872 8.872 8.628 0.244 19498
545 1 2 . 1 1 49 49 SER N N 49 115.006 115.006 113.448 1.558 19498
546 1 2 . 1 1 49 49 SER HA H 49 4.614 4.614 4.602 0.012 19498
547 1 2 . 1 1 49 49 SER CA C 49 58.411 58.411 57.126 1.285 19498
548 1 2 . 1 1 49 49 SER CB C 49 63.806 63.806 65.326 -1.520 19498
549 1 2 . 1 1 49 49 SER H H 49 8.142 8.142 7.783 0.359 19498
550 1 2 . 1 1 50 50 GLY N N 50 109.042 109.042 109.949 -0.907 19498
551 1 2 . 1 1 50 50 GLY CA C 50 44.997 44.997 45.729 -0.732 19498
552 1 2 . 1 1 50 50 GLY H H 50 8.035 8.035 8.748 -0.713 19498
553 1 2 . 1 1 51 51 ASN N N 51 119.842 119.842 120.315 -0.473 19498
554 1 2 . 1 1 51 51 ASN HA H 51 4.546 4.546 4.832 -0.286 19498
555 1 2 . 1 1 51 51 ASN CA C 51 53.419 53.419 52.551 0.868 19498
556 1 2 . 1 1 51 51 ASN CB C 51 38.422 38.422 39.593 -1.171 19498
557 1 2 . 1 1 51 51 ASN H H 51 8.613 8.613 8.332 0.281 19498
558 1 2 . 1 1 52 52 LEU N N 52 124.085 124.085 118.045 6.040 19498
559 1 2 . 1 1 52 52 LEU HA H 52 4.142 4.142 3.993 0.149 19498
560 1 2 . 1 1 52 52 LEU CA C 52 56.023 56.023 55.521 0.502 19498
561 1 2 . 1 1 52 52 LEU CB C 52 42.353 42.353 40.093 2.260 19498
562 1 2 . 1 1 52 52 LEU H H 52 8.631 8.631 7.577 1.054 19498
563 1 2 . 1 1 53 53 ILE N N 53 129.362 129.362 122.466 6.896 19498
564 1 2 . 1 1 53 53 ILE HA H 53 4.137 4.137 4.017 0.120 19498
565 1 2 . 1 1 53 53 ILE CA C 53 61.800 61.800 62.036 -0.236 19498
566 1 2 . 1 1 53 53 ILE CB C 53 37.256 37.256 38.144 -0.888 19498
567 1 2 . 1 1 53 53 ILE H H 53 9.432 9.432 8.442 0.990 19498
568 1 2 . 1 1 54 54 ASP N N 54 113.575 113.575 115.585 -2.010 19498
569 1 2 . 1 1 54 54 ASP HA H 54 4.847 4.847 4.897 -0.050 19498
570 1 2 . 1 1 54 54 ASP CA C 54 53.586 53.586 54.180 -0.594 19498
571 1 2 . 1 1 54 54 ASP CB C 54 44.500 44.500 43.619 0.881 19498
572 1 2 . 1 1 54 54 ASP H H 54 7.761 7.761 8.157 -0.396 19498
573 1 2 . 1 1 55 55 THR N N 55 115.783 115.783 113.161 2.622 19498
574 1 2 . 1 1 55 55 THR HA H 55 5.427 5.427 5.345 0.082 19498
575 1 2 . 1 1 55 55 THR CA C 55 59.185 59.185 60.822 -1.637 19498
576 1 2 . 1 1 55 55 THR CB C 55 70.551 70.551 71.953 -1.402 19498
577 1 2 . 1 1 55 55 THR H H 55 10.106 10.106 8.249 1.857 19498
578 1 2 . 1 1 56 56 SER N N 56 119.808 119.808 119.647 0.161 19498
579 1 2 . 1 1 56 56 SER HA H 56 4.135 4.135 4.455 -0.320 19498
580 1 2 . 1 1 56 56 SER CA C 56 58.001 58.001 57.599 0.402 19498
581 1 2 . 1 1 56 56 SER CB C 56 65.039 65.039 66.170 -1.131 19498
582 1 2 . 1 1 56 56 SER H H 56 7.872 7.872 9.068 -1.196 19498
583 1 2 . 1 1 57 57 THR N N 57 117.962 117.962 120.380 -2.418 19498
584 1 2 . 1 1 57 57 THR HA H 57 4.964 4.964 4.870 0.094 19498
585 1 2 . 1 1 57 57 THR CA C 57 61.001 61.001 61.779 -0.778 19498
586 1 2 . 1 1 57 57 THR CB C 57 70.881 70.881 70.082 0.799 19498
587 1 2 . 1 1 57 57 THR H H 57 7.524 7.524 8.091 -0.567 19498
588 1 2 . 1 1 58 58 PHE N N 58 123.853 123.853 127.060 -3.207 19498
589 1 2 . 1 1 58 58 PHE HA H 58 4.603 4.603 4.632 -0.029 19498
590 1 2 . 1 1 58 58 PHE CA C 58 56.648 56.648 57.249 -0.601 19498
591 1 2 . 1 1 58 58 PHE CB C 58 43.583 43.583 41.340 2.243 19498
592 1 2 . 1 1 58 58 PHE H H 58 8.861 8.861 9.270 -0.409 19498
593 1 2 . 1 1 59 59 TYR N N 59 117.898 117.898 120.564 -2.666 19498
594 1 2 . 1 1 59 59 TYR HA H 59 5.328 5.328 5.011 0.317 19498
595 1 2 . 1 1 59 59 TYR CA C 59 56.221 56.221 57.843 -1.622 19498
596 1 2 . 1 1 59 59 TYR CB C 59 42.106 42.106 39.509 2.597 19498
597 1 2 . 1 1 59 59 TYR H H 59 8.328 8.328 8.361 -0.033 19498
598 1 2 . 1 1 60 60 HIS CA C 60 60.065 60.065 56.324 3.741 19498
599 1 2 . 1 1 60 60 HIS CB C 60 34.284 34.284 30.505 3.780 19498
600 1 2 . 1 1 61 61 HIS N N 61 121.880 121.880 120.980 0.900 19498
601 1 2 . 1 1 61 61 HIS CA C 61 58.001 58.001 56.350 1.651 19498
602 1 2 . 1 1 61 61 HIS CB C 61 29.999 29.999 30.632 -0.633 19498
603 1 2 . 1 1 61 61 HIS H H 61 7.734 7.734 8.746 -1.012 19498
604 1 2 . 1 1 62 62 ASP N N 62 128.148 128.148 120.207 7.941 19498
605 1 2 . 1 1 62 62 ASP HA H 62 4.870 4.870 4.356 0.514 19498
606 1 2 . 1 1 62 62 ASP CA C 62 53.348 53.348 55.381 -2.033 19498
607 1 2 . 1 1 62 62 ASP CB C 62 42.600 42.600 41.886 0.714 19498
608 1 2 . 1 1 62 62 ASP H H 62 11.492 11.492 7.892 3.600 19498
609 1 2 . 1 1 63 63 GLU N N 63 126.564 126.564 120.042 6.522 19498
610 1 2 . 1 1 63 63 GLU HA H 63 3.795 3.795 4.101 -0.306 19498
611 1 2 . 1 1 63 63 GLU CA C 63 59.863 59.863 58.627 1.236 19498
612 1 2 . 1 1 63 63 GLU CB C 63 34.007 34.007 29.862 4.145 19498
613 1 2 . 1 1 63 63 GLU H H 63 8.982 8.982 8.770 0.212 19498
614 1 2 . 1 1 64 64 ASP N N 64 117.779 117.779 121.243 -3.464 19498
615 1 2 . 1 1 64 64 ASP HA H 64 4.401 4.401 4.383 0.018 19498
616 1 2 . 1 1 64 64 ASP CA C 64 57.664 57.664 57.623 0.041 19498
617 1 2 . 1 1 64 64 ASP CB C 64 40.369 40.369 40.932 -0.563 19498
618 1 2 . 1 1 64 64 ASP H H 64 8.272 8.272 8.039 0.233 19498
619 1 2 . 1 1 65 65 VAL N N 65 121.948 121.948 120.327 1.621 19498
620 1 2 . 1 1 65 65 VAL HA H 65 3.386 3.386 3.785 -0.399 19498
621 1 2 . 1 1 65 65 VAL CA C 65 65.913 65.913 65.415 0.498 19498
622 1 2 . 1 1 65 65 VAL CB C 65 31.465 31.465 31.998 -0.533 19498
623 1 2 . 1 1 65 65 VAL H H 65 7.335 7.335 7.490 -0.155 19498
624 1 2 . 1 1 66 66 LEU N N 66 120.747 120.747 121.406 -0.659 19498
625 1 2 . 1 1 66 66 LEU HA H 66 3.905 3.905 3.947 -0.042 19498
626 1 2 . 1 1 66 66 LEU CA C 66 58.076 58.076 57.874 0.202 19498
627 1 2 . 1 1 66 66 LEU CB C 66 42.160 42.160 40.815 1.345 19498
628 1 2 . 1 1 66 66 LEU H H 66 8.164 8.164 7.551 0.613 19498
629 1 2 . 1 1 67 67 PHE N N 67 116.553 116.553 118.221 -1.668 19498
630 1 2 . 1 1 67 67 PHE HA H 67 3.900 3.900 4.076 -0.176 19498
631 1 2 . 1 1 67 67 PHE CA C 67 62.849 62.849 62.770 0.079 19498
632 1 2 . 1 1 67 67 PHE CB C 67 38.003 38.003 38.291 -0.288 19498
633 1 2 . 1 1 67 67 PHE H H 67 8.350 8.350 8.692 -0.342 19498
634 1 2 . 1 1 68 68 ASN N N 68 121.020 121.020 118.466 2.554 19498
635 1 2 . 1 1 68 68 ASN HA H 68 4.415 4.415 4.451 -0.036 19498
636 1 2 . 1 1 68 68 ASN CA C 68 56.725 56.725 56.152 0.573 19498
637 1 2 . 1 1 68 68 ASN CB C 68 38.071 38.071 38.399 -0.328 19498
638 1 2 . 1 1 68 68 ASN H H 68 8.001 8.001 7.991 0.010 19498
639 1 2 . 1 1 69 69 MET N N 69 120.402 120.402 119.181 1.221 19498
640 1 2 . 1 1 69 69 MET HA H 69 4.011 4.011 4.078 -0.067 19498
641 1 2 . 1 1 69 69 MET CA C 69 59.605 59.605 59.581 0.024 19498
642 1 2 . 1 1 69 69 MET CB C 69 31.867 31.867 32.547 -0.680 19498
643 1 2 . 1 1 69 69 MET H H 69 8.465 8.465 8.091 0.374 19498
644 1 2 . 1 1 70 70 CYS N N 70 117.496 117.496 117.965 -0.469 19498
645 1 2 . 1 1 70 70 CYS CA C 70 63.145 63.145 64.455 -1.310 19498
646 1 2 . 1 1 70 70 CYS CB C 70 27.510 27.510 26.801 0.709 19498
647 1 2 . 1 1 70 70 CYS H H 70 7.616 7.616 7.797 -0.181 19498
648 1 2 . 1 1 71 71 THR N N 71 118.640 118.640 115.083 3.557 19498
649 1 2 . 1 1 71 71 THR HA H 71 4.270 4.270 3.887 0.383 19498
650 1 2 . 1 1 71 71 THR CA C 71 67.980 67.980 66.530 1.450 19498
651 1 2 . 1 1 71 71 THR CB C 71 67.949 67.949 68.451 -0.502 19498
652 1 2 . 1 1 71 71 THR H H 71 8.509 8.509 8.055 0.454 19498
653 1 2 . 1 1 72 72 ASP HA H 72 4.430 4.430 4.389 0.041 19498
654 1 2 . 1 1 72 72 ASP CA C 72 57.590 57.590 57.559 0.031 19498
655 1 2 . 1 1 72 72 ASP CB C 72 40.415 40.415 40.743 -0.328 19498
656 1 2 . 1 1 73 73 TRP N N 73 121.657 121.657 121.696 -0.039 19498
657 1 2 . 1 1 73 73 TRP HA H 73 4.407 4.407 4.252 0.155 19498
658 1 2 . 1 1 73 73 TRP CA C 73 62.951 62.951 61.598 1.353 19498
659 1 2 . 1 1 73 73 TRP CB C 73 29.114 29.114 29.593 -0.479 19498
660 1 2 . 1 1 73 73 TRP H H 73 7.780 7.780 7.953 -0.173 19498
661 1 2 . 1 1 74 74 LEU N N 74 118.727 118.727 118.593 0.134 19498
662 1 2 . 1 1 74 74 LEU HA H 74 3.582 3.582 3.786 -0.204 19498
663 1 2 . 1 1 74 74 LEU CA C 74 58.184 58.184 58.309 -0.125 19498
664 1 2 . 1 1 74 74 LEU CB C 74 37.610 37.610 41.667 -4.057 19498
665 1 2 . 1 1 74 74 LEU H H 74 8.490 8.490 8.250 0.240 19498
666 1 2 . 1 1 75 75 ASN N N 75 117.962 117.962 116.157 1.805 19498
667 1 2 . 1 1 75 75 ASN HA H 75 4.527 4.527 4.504 0.023 19498
668 1 2 . 1 1 75 75 ASN CA C 75 56.501 56.501 56.009 0.492 19498
669 1 2 . 1 1 75 75 ASN CB C 75 37.999 37.999 38.620 -0.621 19498
670 1 2 . 1 1 75 75 ASN H H 75 8.639 8.639 7.809 0.830 19498
671 1 2 . 1 1 76 76 HIS N N 76 120.823 120.823 118.830 1.993 19498
672 1 2 . 1 1 76 76 HIS HA H 76 4.450 4.450 4.194 0.256 19498
673 1 2 . 1 1 76 76 HIS CA C 76 58.737 58.737 59.244 -0.507 19498
674 1 2 . 1 1 76 76 HIS CB C 76 28.007 28.007 29.860 -1.853 19498
675 1 2 . 1 1 76 76 HIS H H 76 8.158 8.158 7.807 0.351 19498
676 1 2 . 1 1 77 77 MET N N 77 118.749 118.749 115.207 3.542 19498
677 1 2 . 1 1 77 77 MET HA H 77 4.071 4.071 3.767 0.304 19498
678 1 2 . 1 1 77 77 MET CA C 77 55.827 55.827 57.463 -1.636 19498
679 1 2 . 1 1 77 77 MET CB C 77 29.541 29.541 31.831 -2.290 19498
680 1 2 . 1 1 77 77 MET H H 77 8.404 8.404 7.195 1.209 19498
681 1 2 . 1 1 78 78 TYR N N 78 120.762 120.762 119.909 0.853 19498
682 1 2 . 1 1 78 78 TYR HA H 78 3.662 3.662 3.969 -0.307 19498
683 1 2 . 1 1 78 78 TYR CA C 78 62.640 62.640 62.459 0.181 19498
684 1 2 . 1 1 78 78 TYR CB C 78 37.545 37.545 37.548 -0.003 19498
685 1 2 . 1 1 78 78 TYR H H 78 8.322 8.322 7.657 0.665 19498
686 1 2 . 1 1 79 79 ASP N N 79 116.578 116.578 118.049 -1.471 19498
687 1 2 . 1 1 79 79 ASP HA H 79 4.106 4.106 4.310 -0.204 19498
688 1 2 . 1 1 79 79 ASP CA C 79 57.410 57.410 57.708 -0.298 19498
689 1 2 . 1 1 79 79 ASP CB C 79 40.503 40.503 40.106 0.397 19498
690 1 2 . 1 1 79 79 ASP H H 79 7.460 7.460 8.242 -0.782 19498
691 1 2 . 1 1 80 80 GLN N N 80 116.175 116.175 119.663 -3.488 19498
692 1 2 . 1 1 80 80 GLN HA H 80 4.056 4.056 4.097 -0.041 19498
693 1 2 . 1 1 80 80 GLN CA C 80 57.629 57.629 58.368 -0.739 19498
694 1 2 . 1 1 80 80 GLN CB C 80 29.662 29.662 28.627 1.036 19498
695 1 2 . 1 1 80 80 GLN H H 80 7.552 7.552 7.722 -0.170 19498
696 1 2 . 1 1 81 81 LEU N N 81 118.398 118.398 118.704 -0.306 19498
697 1 2 . 1 1 81 81 LEU HA H 81 4.233 4.233 4.050 0.183 19498
698 1 2 . 1 1 81 81 LEU CA C 81 55.461 55.461 57.395 -1.934 19498
699 1 2 . 1 1 81 81 LEU CB C 81 42.406 42.406 41.975 0.430 19498
700 1 2 . 1 1 81 81 LEU H H 81 7.957 7.957 7.684 0.273 19498
701 1 2 . 1 1 82 82 LYS N N 82 119.114 119.114 118.904 0.210 19498
702 1 2 . 1 1 82 82 LYS HA H 82 3.841 3.841 4.032 -0.191 19498
703 1 2 . 1 1 82 82 LYS CA C 82 58.510 58.510 59.799 -1.289 19498
704 1 2 . 1 1 82 82 LYS CB C 82 30.922 30.922 32.408 -1.486 19498
705 1 2 . 1 1 82 82 LYS H H 82 7.664 7.664 7.885 -0.221 19498
706 1 2 . 1 1 83 83 ASP N N 83 118.655 118.655 116.376 2.279 19498
707 1 2 . 1 1 83 83 ASP HA H 83 4.819 4.819 4.726 0.093 19498
708 1 2 . 1 1 83 83 ASP CA C 83 53.886 53.886 54.229 -0.343 19498
709 1 2 . 1 1 83 83 ASP CB C 83 40.986 40.986 40.915 0.071 19498
710 1 2 . 1 1 83 83 ASP H H 83 7.862 7.862 7.712 0.150 19498
711 1 2 . 1 1 84 84 TRP N N 84 121.757 121.757 122.251 -0.494 19498
712 1 2 . 1 1 84 84 TRP CA C 84 58.462 58.462 57.136 1.326 19498
713 1 2 . 1 1 84 84 TRP CB C 84 28.934 28.934 30.362 -1.428 19498
714 1 2 . 1 1 84 84 TRP H H 84 7.925 7.925 7.463 0.462 19498
715 1 3 . 1 1 6 6 SER CA C 6 56.008 56.008 57.570 -1.562 19498
716 1 3 . 1 1 7 7 GLY N N 7 109.496 109.496 108.471 1.025 19498
717 1 3 . 1 1 7 7 GLY CA C 7 46.042 46.042 46.216 -0.174 19498
718 1 3 . 1 1 7 7 GLY H H 7 8.432 8.432 8.587 -0.155 19498
719 1 3 . 1 1 8 8 ASN N N 8 119.432 119.432 117.173 2.259 19498
720 1 3 . 1 1 8 8 ASN HA H 8 4.685 4.685 4.767 -0.082 19498
721 1 3 . 1 1 8 8 ASN CA C 8 53.922 53.922 53.540 0.382 19498
722 1 3 . 1 1 8 8 ASN CB C 8 37.970 37.970 38.804 -0.834 19498
723 1 3 . 1 1 8 8 ASN H H 8 8.367 8.367 8.222 0.145 19498
724 1 3 . 1 1 9 9 LEU N N 9 123.537 123.537 119.001 4.536 19498
725 1 3 . 1 1 9 9 LEU HA H 9 3.984 3.984 4.649 -0.664 19498
726 1 3 . 1 1 9 9 LEU CA C 9 56.417 56.417 54.425 1.992 19498
727 1 3 . 1 1 9 9 LEU CB C 9 41.566 41.566 42.436 -0.870 19498
728 1 3 . 1 1 9 9 LEU H H 9 7.922 7.922 7.115 0.807 19498
729 1 3 . 1 1 10 10 ALA N N 10 122.287 122.287 124.212 -1.925 19498
730 1 3 . 1 1 10 10 ALA HA H 10 4.127 4.127 4.076 0.051 19498
731 1 3 . 1 1 10 10 ALA CA C 10 55.912 55.912 55.539 0.372 19498
732 1 3 . 1 1 10 10 ALA CB C 10 17.998 17.998 18.318 -0.320 19498
733 1 3 . 1 1 10 10 ALA H H 10 8.064 8.064 7.803 0.261 19498
734 1 3 . 1 1 11 11 ALA N N 11 121.326 121.326 119.741 1.585 19498
735 1 3 . 1 1 11 11 ALA HA H 11 4.207 4.207 4.217 -0.010 19498
736 1 3 . 1 1 11 11 ALA CA C 11 54.960 54.960 54.120 0.840 19498
737 1 3 . 1 1 11 11 ALA CB C 11 17.998 17.998 18.481 -0.483 19498
738 1 3 . 1 1 11 11 ALA H H 11 8.143 8.143 8.204 -0.061 19498
739 1 3 . 1 1 12 12 PHE N N 12 122.913 122.913 119.161 3.752 19498
740 1 3 . 1 1 12 12 PHE HA H 12 4.411 4.411 4.199 0.212 19498
741 1 3 . 1 1 12 12 PHE CA C 12 61.007 61.007 61.385 -0.378 19498
742 1 3 . 1 1 12 12 PHE CB C 12 39.499 39.499 39.274 0.225 19498
743 1 3 . 1 1 12 12 PHE H H 12 7.779 7.779 8.275 -0.496 19498
744 1 3 . 1 1 13 13 LYS N N 13 120.689 120.689 117.664 3.025 19498
745 1 3 . 1 1 13 13 LYS HA H 13 3.861 3.861 4.067 -0.206 19498
746 1 3 . 1 1 13 13 LYS CA C 13 59.099 59.099 58.391 0.708 19498
747 1 3 . 1 1 13 13 LYS CB C 13 31.867 31.867 31.689 0.178 19498
748 1 3 . 1 1 13 13 LYS H H 13 8.614 8.614 8.025 0.589 19498
749 1 3 . 1 1 14 14 ALA N N 14 122.076 122.076 121.394 0.682 19498
750 1 3 . 1 1 14 14 ALA HA H 14 3.182 3.182 4.185 -1.003 19498
751 1 3 . 1 1 14 14 ALA CA C 14 55.108 55.108 54.868 0.240 19498
752 1 3 . 1 1 14 14 ALA CB C 14 18.120 18.120 18.094 0.026 19498
753 1 3 . 1 1 14 14 ALA H H 14 8.178 8.178 7.581 0.597 19498
754 1 3 . 1 1 15 15 ALA N N 15 121.714 121.714 120.368 1.346 19498
755 1 3 . 1 1 15 15 ALA HA H 15 4.040 4.040 4.004 0.036 19498
756 1 3 . 1 1 15 15 ALA CA C 15 55.158 55.158 54.707 0.451 19498
757 1 3 . 1 1 15 15 ALA CB C 15 19.042 19.042 18.458 0.584 19498
758 1 3 . 1 1 15 15 ALA H H 15 7.793 7.793 7.915 -0.122 19498
759 1 3 . 1 1 16 16 THR N N 16 111.959 111.959 115.526 -3.567 19498
760 1 3 . 1 1 16 16 THR HA H 16 3.705 3.705 3.780 -0.075 19498
761 1 3 . 1 1 16 16 THR CA C 16 66.762 66.762 67.037 -0.275 19498
762 1 3 . 1 1 16 16 THR CB C 16 68.213 68.213 68.551 -0.338 19498
763 1 3 . 1 1 16 16 THR H H 16 8.133 8.133 7.519 0.614 19498
764 1 3 . 1 1 17 17 ASN N N 17 121.090 121.090 118.861 2.229 19498
765 1 3 . 1 1 17 17 ASN HA H 17 4.520 4.520 4.770 -0.250 19498
766 1 3 . 1 1 17 17 ASN CA C 17 56.191 56.191 56.096 0.095 19498
767 1 3 . 1 1 17 17 ASN CB C 17 38.365 38.365 38.575 -0.210 19498
768 1 3 . 1 1 17 17 ASN H H 17 8.152 8.152 7.977 0.175 19498
769 1 3 . 1 1 18 18 LYS N N 18 119.978 119.978 118.758 1.220 19498
770 1 3 . 1 1 18 18 LYS HA H 18 3.914 3.914 4.028 -0.114 19498
771 1 3 . 1 1 18 18 LYS CA C 18 59.865 59.865 57.952 1.913 19498
772 1 3 . 1 1 18 18 LYS CB C 18 30.999 30.999 31.588 -0.589 19498
773 1 3 . 1 1 18 18 LYS H H 18 7.568 7.568 7.432 0.136 19498
774 1 3 . 1 1 19 19 LEU N N 19 117.558 117.558 119.182 -1.624 19498
775 1 3 . 1 1 19 19 LEU HA H 19 4.135 4.135 4.091 0.044 19498
776 1 3 . 1 1 19 19 LEU CA C 19 58.001 58.001 57.710 0.291 19498
777 1 3 . 1 1 19 19 LEU CB C 19 40.823 40.823 41.428 -0.605 19498
778 1 3 . 1 1 19 19 LEU H H 19 7.001 7.001 7.508 -0.507 19498
779 1 3 . 1 1 20 20 PHE N N 20 121.123 121.123 115.942 5.181 19498
780 1 3 . 1 1 20 20 PHE HA H 20 4.873 4.873 4.180 0.693 19498
781 1 3 . 1 1 20 20 PHE CA C 20 60.375 60.375 61.459 -1.084 19498
782 1 3 . 1 1 20 20 PHE CB C 20 38.480 38.480 38.085 0.395 19498
783 1 3 . 1 1 20 20 PHE H H 20 8.193 8.193 7.453 0.740 19498
784 1 3 . 1 1 21 21 GLN N N 21 118.591 118.591 116.526 2.065 19498
785 1 3 . 1 1 21 21 GLN HA H 21 4.208 4.208 4.191 0.017 19498
786 1 3 . 1 1 21 21 GLN CA C 21 58.055 58.055 58.130 -0.075 19498
787 1 3 . 1 1 21 21 GLN CB C 21 28.284 28.284 28.761 -0.476 19498
788 1 3 . 1 1 21 21 GLN H H 21 7.918 7.918 7.799 0.119 19498
789 1 3 . 1 1 22 22 LEU N N 22 118.477 118.477 118.950 -0.473 19498
790 1 3 . 1 1 22 22 LEU HA H 22 4.534 4.534 4.509 0.025 19498
791 1 3 . 1 1 22 22 LEU CA C 22 54.033 54.033 54.677 -0.644 19498
792 1 3 . 1 1 22 22 LEU CB C 22 41.469 41.469 43.870 -2.401 19498
793 1 3 . 1 1 22 22 LEU H H 22 7.561 7.561 7.448 0.113 19498
794 1 3 . 1 1 23 23 ASP N N 23 115.410 115.410 115.805 -0.395 19498
795 1 3 . 1 1 23 23 ASP HA H 23 4.280 4.280 4.237 0.043 19498
796 1 3 . 1 1 23 23 ASP CA C 23 55.494 55.494 55.761 -0.267 19498
797 1 3 . 1 1 23 23 ASP CB C 23 39.317 39.317 38.406 0.911 19498
798 1 3 . 1 1 23 23 ASP H H 23 8.163 8.163 7.931 0.232 19498
799 1 3 . 1 1 24 24 LEU N N 24 116.367 116.367 118.537 -2.170 19498
800 1 3 . 1 1 24 24 LEU HA H 24 4.790 4.790 4.598 0.192 19498
801 1 3 . 1 1 24 24 LEU CA C 24 53.030 53.030 53.554 -0.524 19498
802 1 3 . 1 1 24 24 LEU CB C 24 43.867 43.867 44.212 -0.345 19498
803 1 3 . 1 1 24 24 LEU H H 24 7.136 7.136 7.929 -0.793 19498
804 1 3 . 1 1 25 25 ALA N N 25 123.243 123.243 121.759 1.484 19498
805 1 3 . 1 1 25 25 ALA HA H 25 4.480 4.480 4.521 -0.041 19498
806 1 3 . 1 1 25 25 ALA CA C 25 50.890 50.890 51.334 -0.444 19498
807 1 3 . 1 1 25 25 ALA CB C 25 21.655 21.655 21.649 0.006 19498
808 1 3 . 1 1 25 25 ALA H H 25 8.931 8.931 7.995 0.936 19498
809 1 3 . 1 1 26 26 VAL N N 26 119.587 119.587 120.145 -0.558 19498
810 1 3 . 1 1 26 26 VAL HA H 26 4.889 4.889 4.584 0.305 19498
811 1 3 . 1 1 26 26 VAL CA C 26 61.278 61.278 61.504 -0.226 19498
812 1 3 . 1 1 26 26 VAL CB C 26 33.310 33.310 35.390 -2.080 19498
813 1 3 . 1 1 26 26 VAL H H 26 7.575 7.575 8.220 -0.645 19498
814 1 3 . 1 1 27 27 ILE N N 27 130.377 130.377 124.821 5.556 19498
815 1 3 . 1 1 27 27 ILE HA H 27 4.489 4.489 4.737 -0.248 19498
816 1 3 . 1 1 27 27 ILE CA C 27 60.177 60.177 60.314 -0.137 19498
817 1 3 . 1 1 27 27 ILE CB C 27 40.019 40.019 40.496 -0.477 19498
818 1 3 . 1 1 27 27 ILE H H 27 9.437 9.437 8.984 0.453 19498
819 1 3 . 1 1 28 28 TYR N N 28 126.844 126.844 121.715 5.129 19498
820 1 3 . 1 1 28 28 TYR HA H 28 5.709 5.709 5.560 0.149 19498
821 1 3 . 1 1 28 28 TYR CA C 28 55.486 55.486 54.974 0.512 19498
822 1 3 . 1 1 28 28 TYR CB C 28 42.019 42.019 39.816 2.203 19498
823 1 3 . 1 1 28 28 TYR H H 28 8.531 8.531 8.088 0.443 19498
824 1 3 . 1 1 29 29 ASP N N 29 122.875 122.875 122.522 0.353 19498
825 1 3 . 1 1 29 29 ASP HA H 29 4.966 4.966 4.534 0.432 19498
826 1 3 . 1 1 29 29 ASP CA C 29 53.659 53.659 54.467 -0.808 19498
827 1 3 . 1 1 29 29 ASP CB C 29 44.660 44.660 41.905 2.755 19498
828 1 3 . 1 1 29 29 ASP H H 29 8.614 8.614 8.550 0.064 19498
829 1 3 . 1 1 30 30 ASP N N 30 119.325 119.325 118.784 0.541 19498
830 1 3 . 1 1 30 30 ASP HA H 30 5.447 5.447 4.819 0.628 19498
831 1 3 . 1 1 30 30 ASP CA C 30 53.501 53.501 53.567 -0.066 19498
832 1 3 . 1 1 30 30 ASP CB C 30 43.921 43.921 42.942 0.979 19498
833 1 3 . 1 1 30 30 ASP H H 30 8.607 8.607 8.176 0.431 19498
834 1 3 . 1 1 31 31 TRP N N 31 120.552 120.552 121.772 -1.220 19498
835 1 3 . 1 1 31 31 TRP HA H 31 4.615 4.615 4.830 -0.215 19498
836 1 3 . 1 1 31 31 TRP CA C 31 58.000 58.000 56.688 1.312 19498
837 1 3 . 1 1 31 31 TRP CB C 31 31.500 31.500 30.114 1.386 19498
838 1 3 . 1 1 31 31 TRP H H 31 8.673 8.673 8.418 0.255 19498
839 1 3 . 1 1 32 32 TYR CA C 32 52.400 52.400 57.170 -4.770 19498
840 1 3 . 1 1 32 32 TYR CB C 32 42.350 42.350 38.828 3.522 19498
841 1 3 . 1 1 33 33 ASP CA C 33 52.400 52.400 54.710 -2.310 19498
842 1 3 . 1 1 33 33 ASP CB C 33 42.350 42.350 40.916 1.433 19498
843 1 3 . 1 1 34 34 ALA N N 34 126.709 126.709 123.548 3.161 19498
844 1 3 . 1 1 34 34 ALA HA H 34 3.845 3.845 3.937 -0.092 19498
845 1 3 . 1 1 34 34 ALA CA C 34 58.599 58.599 52.453 6.146 19498
846 1 3 . 1 1 34 34 ALA CB C 34 18.610 18.610 17.814 0.796 19498
847 1 3 . 1 1 34 34 ALA H H 34 8.424 8.424 8.349 0.075 19498
848 1 3 . 1 1 35 35 TYR N N 35 117.123 117.123 115.470 1.653 19498
849 1 3 . 1 1 35 35 TYR HA H 35 4.350 4.350 4.617 -0.267 19498
850 1 3 . 1 1 35 35 TYR CA C 35 60.466 60.466 57.463 3.003 19498
851 1 3 . 1 1 35 35 TYR CB C 35 38.113 38.113 38.574 -0.461 19498
852 1 3 . 1 1 35 35 TYR H H 35 8.334 8.334 8.021 0.313 19498
853 1 3 . 1 1 36 36 THR N N 36 108.046 108.046 111.793 -3.747 19498
854 1 3 . 1 1 36 36 THR HA H 36 4.018 4.018 4.053 -0.035 19498
855 1 3 . 1 1 36 36 THR CA C 36 61.809 61.809 62.000 -0.191 19498
856 1 3 . 1 1 36 36 THR CB C 36 69.926 69.926 66.765 3.161 19498
857 1 3 . 1 1 36 36 THR H H 36 7.563 7.563 7.970 -0.407 19498
858 1 3 . 1 1 37 37 ARG N N 37 118.456 118.456 116.516 1.940 19498
859 1 3 . 1 1 37 37 ARG CA C 37 57.001 57.001 56.603 0.398 19498
860 1 3 . 1 1 37 37 ARG H H 37 7.952 7.952 8.480 -0.528 19498
861 1 3 . 1 1 40 40 CYS CA C 40 56.316 56.316 57.830 -1.514 19498
862 1 3 . 1 1 40 40 CYS CB C 40 29.999 29.999 31.653 -1.654 19498
863 1 3 . 1 1 41 41 ILE N N 41 121.419 121.419 121.369 0.050 19498
864 1 3 . 1 1 41 41 ILE HA H 41 4.709 4.709 4.596 0.113 19498
865 1 3 . 1 1 41 41 ILE CA C 41 60.462 60.462 61.089 -0.627 19498
866 1 3 . 1 1 41 41 ILE CB C 41 42.309 42.309 42.464 -0.155 19498
867 1 3 . 1 1 41 41 ILE H H 41 8.459 8.459 8.976 -0.517 19498
868 1 3 . 1 1 42 42 ARG N N 42 127.916 127.916 126.685 1.231 19498
869 1 3 . 1 1 42 42 ARG CA C 42 54.501 54.501 54.773 -0.272 19498
870 1 3 . 1 1 42 42 ARG CB C 42 33.204 33.204 34.184 -0.980 19498
871 1 3 . 1 1 42 42 ARG H H 42 9.004 9.004 8.829 0.175 19498
872 1 3 . 1 1 43 43 LEU N N 43 124.715 124.715 126.320 -1.605 19498
873 1 3 . 1 1 43 43 LEU HA H 43 5.538 5.538 4.772 0.766 19498
874 1 3 . 1 1 43 43 LEU CA C 43 53.266 53.266 54.474 -1.208 19498
875 1 3 . 1 1 43 43 LEU CB C 43 46.163 46.163 43.276 2.887 19498
876 1 3 . 1 1 43 43 LEU H H 43 8.757 8.757 9.182 -0.425 19498
877 1 3 . 1 1 44 44 ARG N N 44 123.499 123.499 126.135 -2.636 19498
878 1 3 . 1 1 44 44 ARG HA H 44 5.004 5.004 4.876 0.128 19498
879 1 3 . 1 1 44 44 ARG CA C 44 55.508 55.508 54.945 0.563 19498
880 1 3 . 1 1 44 44 ARG CB C 44 34.543 34.543 33.294 1.249 19498
881 1 3 . 1 1 44 44 ARG H H 44 9.366 9.366 9.230 0.136 19498
882 1 3 . 1 1 45 45 ILE N N 45 122.919 122.919 127.388 -4.469 19498
883 1 3 . 1 1 45 45 ILE HA H 45 5.260 5.260 4.587 0.673 19498
884 1 3 . 1 1 45 45 ILE CA C 45 59.933 59.933 58.773 1.160 19498
885 1 3 . 1 1 45 45 ILE CB C 45 39.751 39.751 39.413 0.338 19498
886 1 3 . 1 1 45 45 ILE H H 45 8.938 8.938 8.999 -0.061 19498
887 1 3 . 1 1 46 46 GLU N N 46 126.745 126.745 125.222 1.523 19498
888 1 3 . 1 1 46 46 GLU HA H 46 5.465 5.465 4.846 0.619 19498
889 1 3 . 1 1 46 46 GLU CA C 46 53.707 53.707 54.205 -0.497 19498
890 1 3 . 1 1 46 46 GLU CB C 46 35.276 35.276 33.612 1.664 19498
891 1 3 . 1 1 46 46 GLU H H 46 9.097 9.097 8.592 0.505 19498
892 1 3 . 1 1 47 47 ASP N N 47 117.988 117.988 120.297 -2.309 19498
893 1 3 . 1 1 47 47 ASP HA H 47 4.976 4.976 4.798 0.178 19498
894 1 3 . 1 1 47 47 ASP CA C 47 52.411 52.411 52.558 -0.147 19498
895 1 3 . 1 1 47 47 ASP CB C 47 41.609 41.609 43.026 -1.417 19498
896 1 3 . 1 1 47 47 ASP H H 47 8.209 8.209 8.764 -0.555 19498
897 1 3 . 1 1 48 48 ARG N N 48 117.098 117.098 123.225 -6.127 19498
898 1 3 . 1 1 48 48 ARG HA H 48 4.129 4.129 4.330 -0.201 19498
899 1 3 . 1 1 48 48 ARG CA C 48 58.323 58.323 58.082 0.241 19498
900 1 3 . 1 1 48 48 ARG CB C 48 29.511 29.511 29.492 0.019 19498
901 1 3 . 1 1 48 48 ARG H H 48 8.872 8.872 8.706 0.166 19498
902 1 3 . 1 1 49 49 SER N N 49 115.006 115.006 112.982 2.024 19498
903 1 3 . 1 1 49 49 SER HA H 49 4.614 4.614 4.619 -0.005 19498
904 1 3 . 1 1 49 49 SER CA C 49 58.411 58.411 57.974 0.437 19498
905 1 3 . 1 1 49 49 SER CB C 49 63.806 63.806 63.819 -0.013 19498
906 1 3 . 1 1 49 49 SER H H 49 8.142 8.142 8.080 0.062 19498
907 1 3 . 1 1 50 50 GLY N N 50 109.042 109.042 110.135 -1.093 19498
908 1 3 . 1 1 50 50 GLY CA C 50 44.997 44.997 45.109 -0.112 19498
909 1 3 . 1 1 50 50 GLY H H 50 8.035 8.035 7.900 0.135 19498
910 1 3 . 1 1 51 51 ASN N N 51 119.842 119.842 119.058 0.784 19498
911 1 3 . 1 1 51 51 ASN HA H 51 4.546 4.546 4.768 -0.222 19498
912 1 3 . 1 1 51 51 ASN CA C 51 53.419 53.419 53.427 -0.008 19498
913 1 3 . 1 1 51 51 ASN CB C 51 38.422 38.422 39.619 -1.197 19498
914 1 3 . 1 1 51 51 ASN H H 51 8.613 8.613 8.108 0.505 19498
915 1 3 . 1 1 52 52 LEU N N 52 124.085 124.085 120.484 3.601 19498
916 1 3 . 1 1 52 52 LEU HA H 52 4.142 4.142 4.568 -0.426 19498
917 1 3 . 1 1 52 52 LEU CA C 52 56.023 56.023 54.198 1.825 19498
918 1 3 . 1 1 52 52 LEU CB C 52 42.353 42.353 44.777 -2.424 19498
919 1 3 . 1 1 52 52 LEU H H 52 8.631 8.631 8.253 0.378 19498
920 1 3 . 1 1 53 53 ILE N N 53 129.362 129.362 123.631 5.731 19498
921 1 3 . 1 1 53 53 ILE HA H 53 4.137 4.137 4.402 -0.265 19498
922 1 3 . 1 1 53 53 ILE CA C 53 61.800 61.800 61.687 0.113 19498
923 1 3 . 1 1 53 53 ILE CB C 53 37.256 37.256 39.088 -1.832 19498
924 1 3 . 1 1 53 53 ILE H H 53 9.432 9.432 8.578 0.854 19498
925 1 3 . 1 1 54 54 ASP N N 54 113.575 113.575 116.335 -2.760 19498
926 1 3 . 1 1 54 54 ASP HA H 54 4.847 4.847 4.931 -0.084 19498
927 1 3 . 1 1 54 54 ASP CA C 54 53.586 53.586 54.239 -0.653 19498
928 1 3 . 1 1 54 54 ASP CB C 54 44.500 44.500 43.990 0.509 19498
929 1 3 . 1 1 54 54 ASP H H 54 7.761 7.761 7.861 -0.100 19498
930 1 3 . 1 1 55 55 THR N N 55 115.783 115.783 116.234 -0.451 19498
931 1 3 . 1 1 55 55 THR HA H 55 5.427 5.427 5.432 -0.005 19498
932 1 3 . 1 1 55 55 THR CA C 55 59.185 59.185 61.130 -1.945 19498
933 1 3 . 1 1 55 55 THR CB C 55 70.551 70.551 70.189 0.362 19498
934 1 3 . 1 1 55 55 THR H H 55 10.106 10.106 8.288 1.818 19498
935 1 3 . 1 1 56 56 SER N N 56 119.808 119.808 120.552 -0.744 19498
936 1 3 . 1 1 56 56 SER HA H 56 4.135 4.135 4.572 -0.437 19498
937 1 3 . 1 1 56 56 SER CA C 56 58.001 58.001 57.915 0.086 19498
938 1 3 . 1 1 56 56 SER CB C 56 65.039 65.039 64.307 0.732 19498
939 1 3 . 1 1 56 56 SER H H 56 7.872 7.872 8.899 -1.027 19498
940 1 3 . 1 1 57 57 THR N N 57 117.962 117.962 120.585 -2.623 19498
941 1 3 . 1 1 57 57 THR HA H 57 4.964 4.964 4.902 0.062 19498
942 1 3 . 1 1 57 57 THR CA C 57 61.001 61.001 61.648 -0.647 19498
943 1 3 . 1 1 57 57 THR CB C 57 70.881 70.881 70.061 0.820 19498
944 1 3 . 1 1 57 57 THR H H 57 7.524 7.524 7.906 -0.382 19498
945 1 3 . 1 1 58 58 PHE N N 58 123.853 123.853 126.462 -2.609 19498
946 1 3 . 1 1 58 58 PHE HA H 58 4.603 4.603 4.774 -0.171 19498
947 1 3 . 1 1 58 58 PHE CA C 58 56.648 56.648 57.177 -0.529 19498
948 1 3 . 1 1 58 58 PHE CB C 58 43.583 43.583 42.427 1.156 19498
949 1 3 . 1 1 58 58 PHE H H 58 8.861 8.861 9.335 -0.474 19498
950 1 3 . 1 1 59 59 TYR N N 59 117.898 117.898 119.825 -1.927 19498
951 1 3 . 1 1 59 59 TYR HA H 59 5.328 5.328 4.971 0.357 19498
952 1 3 . 1 1 59 59 TYR CA C 59 56.221 56.221 56.569 -0.348 19498
953 1 3 . 1 1 59 59 TYR CB C 59 42.106 42.106 40.278 1.828 19498
954 1 3 . 1 1 59 59 TYR H H 59 8.328 8.328 8.422 -0.094 19498
955 1 3 . 1 1 60 60 HIS CA C 60 60.065 60.065 56.441 3.623 19498
956 1 3 . 1 1 60 60 HIS CB C 60 34.284 34.284 32.546 1.738 19498
957 1 3 . 1 1 61 61 HIS N N 61 121.880 121.880 126.713 -4.833 19498
958 1 3 . 1 1 61 61 HIS CA C 61 58.001 58.001 56.539 1.462 19498
959 1 3 . 1 1 61 61 HIS CB C 61 29.999 29.999 28.873 1.126 19498
960 1 3 . 1 1 61 61 HIS H H 61 7.734 7.734 8.350 -0.616 19498
961 1 3 . 1 1 62 62 ASP N N 62 128.148 128.148 126.169 1.979 19498
962 1 3 . 1 1 62 62 ASP HA H 62 4.870 4.870 4.824 0.046 19498
963 1 3 . 1 1 62 62 ASP CA C 62 53.348 53.348 53.913 -0.565 19498
964 1 3 . 1 1 62 62 ASP CB C 62 42.600 42.600 43.861 -1.261 19498
965 1 3 . 1 1 62 62 ASP H H 62 11.492 11.492 8.072 3.420 19498
966 1 3 . 1 1 63 63 GLU N N 63 126.564 126.564 125.237 1.327 19498
967 1 3 . 1 1 63 63 GLU HA H 63 3.795 3.795 3.969 -0.174 19498
968 1 3 . 1 1 63 63 GLU CA C 63 59.863 59.863 59.816 0.046 19498
969 1 3 . 1 1 63 63 GLU CB C 63 34.007 34.007 30.007 4.000 19498
970 1 3 . 1 1 63 63 GLU H H 63 8.982 8.982 8.782 0.200 19498
971 1 3 . 1 1 64 64 ASP N N 64 117.779 117.779 120.242 -2.463 19498
972 1 3 . 1 1 64 64 ASP HA H 64 4.401 4.401 4.494 -0.093 19498
973 1 3 . 1 1 64 64 ASP CA C 64 57.664 57.664 57.670 -0.007 19498
974 1 3 . 1 1 64 64 ASP CB C 64 40.369 40.369 40.704 -0.335 19498
975 1 3 . 1 1 64 64 ASP H H 64 8.272 8.272 7.780 0.492 19498
976 1 3 . 1 1 65 65 VAL N N 65 121.948 121.948 120.409 1.539 19498
977 1 3 . 1 1 65 65 VAL HA H 65 3.386 3.386 3.615 -0.229 19498
978 1 3 . 1 1 65 65 VAL CA C 65 65.913 65.913 66.098 -0.185 19498
979 1 3 . 1 1 65 65 VAL CB C 65 31.465 31.465 31.639 -0.174 19498
980 1 3 . 1 1 65 65 VAL H H 65 7.335 7.335 8.892 -1.557 19498
981 1 3 . 1 1 66 66 LEU N N 66 120.747 120.747 121.218 -0.471 19498
982 1 3 . 1 1 66 66 LEU HA H 66 3.905 3.905 3.905 -0.000 19498
983 1 3 . 1 1 66 66 LEU CA C 66 58.076 58.076 58.147 -0.071 19498
984 1 3 . 1 1 66 66 LEU CB C 66 42.160 42.160 40.887 1.273 19498
985 1 3 . 1 1 66 66 LEU H H 66 8.164 8.164 7.798 0.366 19498
986 1 3 . 1 1 67 67 PHE N N 67 116.553 116.553 117.381 -0.828 19498
987 1 3 . 1 1 67 67 PHE HA H 67 3.900 3.900 4.092 -0.192 19498
988 1 3 . 1 1 67 67 PHE CA C 67 62.849 62.849 62.459 0.390 19498
989 1 3 . 1 1 67 67 PHE CB C 67 38.003 38.003 38.102 -0.099 19498
990 1 3 . 1 1 67 67 PHE H H 67 8.350 8.350 7.633 0.717 19498
991 1 3 . 1 1 68 68 ASN N N 68 121.020 121.020 118.488 2.532 19498
992 1 3 . 1 1 68 68 ASN HA H 68 4.415 4.415 4.439 -0.024 19498
993 1 3 . 1 1 68 68 ASN CA C 68 56.725 56.725 56.470 0.255 19498
994 1 3 . 1 1 68 68 ASN CB C 68 38.071 38.071 38.607 -0.536 19498
995 1 3 . 1 1 68 68 ASN H H 68 8.001 8.001 7.764 0.237 19498
996 1 3 . 1 1 69 69 MET N N 69 120.402 120.402 118.994 1.408 19498
997 1 3 . 1 1 69 69 MET HA H 69 4.011 4.011 3.956 0.055 19498
998 1 3 . 1 1 69 69 MET CA C 69 59.605 59.605 59.533 0.072 19498
999 1 3 . 1 1 69 69 MET CB C 69 31.867 31.867 32.380 -0.513 19498
1000 1 3 . 1 1 69 69 MET H H 69 8.465 8.465 8.039 0.426 19498
1001 1 3 . 1 1 70 70 CYS N N 70 117.496 117.496 117.068 0.428 19498
1002 1 3 . 1 1 70 70 CYS CA C 70 63.145 63.145 63.697 -0.552 19498
1003 1 3 . 1 1 70 70 CYS CB C 70 27.510 27.510 27.267 0.243 19498
1004 1 3 . 1 1 70 70 CYS H H 70 7.616 7.616 7.757 -0.141 19498
1005 1 3 . 1 1 71 71 THR N N 71 118.640 118.640 114.772 3.868 19498
1006 1 3 . 1 1 71 71 THR HA H 71 4.270 4.270 4.197 0.073 19498
1007 1 3 . 1 1 71 71 THR CA C 71 67.980 67.980 65.641 2.339 19498
1008 1 3 . 1 1 71 71 THR CB C 71 67.949 67.949 68.699 -0.750 19498
1009 1 3 . 1 1 71 71 THR H H 71 8.509 8.509 8.253 0.256 19498
1010 1 3 . 1 1 72 72 ASP HA H 72 4.430 4.430 4.491 -0.061 19498
1011 1 3 . 1 1 72 72 ASP CA C 72 57.590 57.590 57.745 -0.155 19498
1012 1 3 . 1 1 72 72 ASP CB C 72 40.415 40.415 40.766 -0.351 19498
1013 1 3 . 1 1 73 73 TRP N N 73 121.657 121.657 121.149 0.508 19498
1014 1 3 . 1 1 73 73 TRP HA H 73 4.407 4.407 4.354 0.053 19498
1015 1 3 . 1 1 73 73 TRP CA C 73 62.951 62.951 61.688 1.263 19498
1016 1 3 . 1 1 73 73 TRP CB C 73 29.114 29.114 29.720 -0.606 19498
1017 1 3 . 1 1 73 73 TRP H H 73 7.780 7.780 7.621 0.159 19498
1018 1 3 . 1 1 74 74 LEU N N 74 118.727 118.727 117.175 1.552 19498
1019 1 3 . 1 1 74 74 LEU HA H 74 3.582 3.582 3.729 -0.147 19498
1020 1 3 . 1 1 74 74 LEU CA C 74 58.184 58.184 57.715 0.469 19498
1021 1 3 . 1 1 74 74 LEU CB C 74 37.610 37.610 41.469 -3.859 19498
1022 1 3 . 1 1 74 74 LEU H H 74 8.490 8.490 7.594 0.896 19498
1023 1 3 . 1 1 75 75 ASN N N 75 117.962 117.962 117.254 0.708 19498
1024 1 3 . 1 1 75 75 ASN HA H 75 4.527 4.527 4.768 -0.241 19498
1025 1 3 . 1 1 75 75 ASN CA C 75 56.501 56.501 55.832 0.669 19498
1026 1 3 . 1 1 75 75 ASN CB C 75 37.999 37.999 38.075 -0.076 19498
1027 1 3 . 1 1 75 75 ASN H H 75 8.639 8.639 8.004 0.635 19498
1028 1 3 . 1 1 76 76 HIS N N 76 120.823 120.823 118.403 2.420 19498
1029 1 3 . 1 1 76 76 HIS HA H 76 4.450 4.450 4.345 0.105 19498
1030 1 3 . 1 1 76 76 HIS CA C 76 58.737 58.737 58.953 -0.216 19498
1031 1 3 . 1 1 76 76 HIS CB C 76 28.007 28.007 29.519 -1.512 19498
1032 1 3 . 1 1 76 76 HIS H H 76 8.158 8.158 7.742 0.416 19498
1033 1 3 . 1 1 77 77 MET N N 77 118.749 118.749 116.377 2.372 19498
1034 1 3 . 1 1 77 77 MET HA H 77 4.071 4.071 3.656 0.415 19498
1035 1 3 . 1 1 77 77 MET CA C 77 55.827 55.827 57.228 -1.401 19498
1036 1 3 . 1 1 77 77 MET CB C 77 29.541 29.541 31.703 -2.162 19498
1037 1 3 . 1 1 77 77 MET H H 77 8.404 8.404 6.985 1.419 19498
1038 1 3 . 1 1 78 78 TYR N N 78 120.762 120.762 119.978 0.784 19498
1039 1 3 . 1 1 78 78 TYR HA H 78 3.662 3.662 3.946 -0.284 19498
1040 1 3 . 1 1 78 78 TYR CA C 78 62.640 62.640 62.097 0.543 19498
1041 1 3 . 1 1 78 78 TYR CB C 78 37.545 37.545 37.767 -0.222 19498
1042 1 3 . 1 1 78 78 TYR H H 78 8.322 8.322 7.441 0.881 19498
1043 1 3 . 1 1 79 79 ASP N N 79 116.578 116.578 117.006 -0.428 19498
1044 1 3 . 1 1 79 79 ASP HA H 79 4.106 4.106 4.400 -0.294 19498
1045 1 3 . 1 1 79 79 ASP CA C 79 57.410 57.410 57.260 0.150 19498
1046 1 3 . 1 1 79 79 ASP CB C 79 40.503 40.503 40.897 -0.394 19498
1047 1 3 . 1 1 79 79 ASP H H 79 7.460 7.460 8.194 -0.734 19498
1048 1 3 . 1 1 80 80 GLN N N 80 116.175 116.175 118.645 -2.470 19498
1049 1 3 . 1 1 80 80 GLN HA H 80 4.056 4.056 4.009 0.047 19498
1050 1 3 . 1 1 80 80 GLN CA C 80 57.629 57.629 58.625 -0.996 19498
1051 1 3 . 1 1 80 80 GLN CB C 80 29.662 29.662 28.335 1.327 19498
1052 1 3 . 1 1 80 80 GLN H H 80 7.552 7.552 7.870 -0.318 19498
1053 1 3 . 1 1 81 81 LEU N N 81 118.398 118.398 119.859 -1.461 19498
1054 1 3 . 1 1 81 81 LEU HA H 81 4.233 4.233 4.090 0.143 19498
1055 1 3 . 1 1 81 81 LEU CA C 81 55.461 55.461 57.595 -2.134 19498
1056 1 3 . 1 1 81 81 LEU CB C 81 42.406 42.406 41.632 0.774 19498
1057 1 3 . 1 1 81 81 LEU H H 81 7.957 7.957 7.595 0.362 19498
1058 1 3 . 1 1 82 82 LYS N N 82 119.114 119.114 118.429 0.685 19498
1059 1 3 . 1 1 82 82 LYS HA H 82 3.841 3.841 4.000 -0.159 19498
1060 1 3 . 1 1 82 82 LYS CA C 82 58.510 58.510 59.359 -0.849 19498
1061 1 3 . 1 1 82 82 LYS CB C 82 30.922 30.922 31.913 -0.991 19498
1062 1 3 . 1 1 82 82 LYS H H 82 7.664 7.664 7.775 -0.111 19498
1063 1 3 . 1 1 83 83 ASP N N 83 118.655 118.655 119.401 -0.746 19498
1064 1 3 . 1 1 83 83 ASP HA H 83 4.819 4.819 4.503 0.316 19498
1065 1 3 . 1 1 83 83 ASP CA C 83 53.886 53.886 56.767 -2.881 19498
1066 1 3 . 1 1 83 83 ASP CB C 83 40.986 40.986 41.510 -0.524 19498
1067 1 3 . 1 1 83 83 ASP H H 83 7.862 7.862 7.924 -0.062 19498
1068 1 3 . 1 1 84 84 TRP N N 84 121.757 121.757 120.762 0.995 19498
1069 1 3 . 1 1 84 84 TRP CA C 84 58.462 58.462 55.808 2.654 19498
1070 1 3 . 1 1 84 84 TRP CB C 84 28.934 28.934 30.011 -1.077 19498
1071 1 3 . 1 1 84 84 TRP H H 84 7.925 7.925 7.758 0.167 19498
1072 1 4 . 1 1 6 6 SER CA C 6 56.008 56.008 58.040 -2.032 19498
1073 1 4 . 1 1 7 7 GLY N N 7 109.496 109.496 109.007 0.489 19498
1074 1 4 . 1 1 7 7 GLY CA C 7 46.042 46.042 44.633 1.409 19498
1075 1 4 . 1 1 7 7 GLY H H 7 8.432 8.432 8.444 -0.012 19498
1076 1 4 . 1 1 8 8 ASN N N 8 119.432 119.432 119.638 -0.206 19498
1077 1 4 . 1 1 8 8 ASN HA H 8 4.685 4.685 4.612 0.073 19498
1078 1 4 . 1 1 8 8 ASN CA C 8 53.922 53.922 53.806 0.116 19498
1079 1 4 . 1 1 8 8 ASN CB C 8 37.970 37.970 37.822 0.149 19498
1080 1 4 . 1 1 8 8 ASN H H 8 8.367 8.367 8.284 0.083 19498
1081 1 4 . 1 1 9 9 LEU N N 9 123.537 123.537 122.863 0.674 19498
1082 1 4 . 1 1 9 9 LEU HA H 9 3.984 3.984 4.110 -0.126 19498
1083 1 4 . 1 1 9 9 LEU CA C 9 56.417 56.417 56.997 -0.580 19498
1084 1 4 . 1 1 9 9 LEU CB C 9 41.566 41.566 41.409 0.157 19498
1085 1 4 . 1 1 9 9 LEU H H 9 7.922 7.922 8.336 -0.414 19498
1086 1 4 . 1 1 10 10 ALA N N 10 122.287 122.287 122.027 0.260 19498
1087 1 4 . 1 1 10 10 ALA HA H 10 4.127 4.127 3.937 0.190 19498
1088 1 4 . 1 1 10 10 ALA CA C 10 55.912 55.912 55.031 0.881 19498
1089 1 4 . 1 1 10 10 ALA CB C 10 17.998 17.998 17.857 0.141 19498
1090 1 4 . 1 1 10 10 ALA H H 10 8.064 8.064 8.285 -0.221 19498
1091 1 4 . 1 1 11 11 ALA N N 11 121.326 121.326 120.969 0.357 19498
1092 1 4 . 1 1 11 11 ALA HA H 11 4.207 4.207 4.065 0.142 19498
1093 1 4 . 1 1 11 11 ALA CA C 11 54.960 54.960 54.301 0.659 19498
1094 1 4 . 1 1 11 11 ALA CB C 11 17.998 17.998 18.427 -0.429 19498
1095 1 4 . 1 1 11 11 ALA H H 11 8.143 8.143 7.567 0.576 19498
1096 1 4 . 1 1 12 12 PHE N N 12 122.913 122.913 119.745 3.168 19498
1097 1 4 . 1 1 12 12 PHE HA H 12 4.411 4.411 4.069 0.342 19498
1098 1 4 . 1 1 12 12 PHE CA C 12 61.007 61.007 61.150 -0.143 19498
1099 1 4 . 1 1 12 12 PHE CB C 12 39.499 39.499 39.104 0.395 19498
1100 1 4 . 1 1 12 12 PHE H H 12 7.779 7.779 7.658 0.121 19498
1101 1 4 . 1 1 13 13 LYS N N 13 120.689 120.689 118.788 1.901 19498
1102 1 4 . 1 1 13 13 LYS HA H 13 3.861 3.861 3.917 -0.056 19498
1103 1 4 . 1 1 13 13 LYS CA C 13 59.099 59.099 59.235 -0.136 19498
1104 1 4 . 1 1 13 13 LYS CB C 13 31.867 31.867 32.261 -0.394 19498
1105 1 4 . 1 1 13 13 LYS H H 13 8.614 8.614 8.747 -0.133 19498
1106 1 4 . 1 1 14 14 ALA N N 14 122.076 122.076 120.982 1.094 19498
1107 1 4 . 1 1 14 14 ALA HA H 14 3.182 3.182 4.102 -0.920 19498
1108 1 4 . 1 1 14 14 ALA CA C 14 55.108 55.108 54.526 0.582 19498
1109 1 4 . 1 1 14 14 ALA CB C 14 18.120 18.120 18.057 0.063 19498
1110 1 4 . 1 1 14 14 ALA H H 14 8.178 8.178 7.643 0.535 19498
1111 1 4 . 1 1 15 15 ALA N N 15 121.714 121.714 119.939 1.775 19498
1112 1 4 . 1 1 15 15 ALA HA H 15 4.040 4.040 4.000 0.040 19498
1113 1 4 . 1 1 15 15 ALA CA C 15 55.158 55.158 54.426 0.732 19498
1114 1 4 . 1 1 15 15 ALA CB C 15 19.042 19.042 18.284 0.758 19498
1115 1 4 . 1 1 15 15 ALA H H 15 7.793 7.793 7.483 0.310 19498
1116 1 4 . 1 1 16 16 THR N N 16 111.959 111.959 114.759 -2.800 19498
1117 1 4 . 1 1 16 16 THR HA H 16 3.705 3.705 3.860 -0.155 19498
1118 1 4 . 1 1 16 16 THR CA C 16 66.762 66.762 67.384 -0.622 19498
1119 1 4 . 1 1 16 16 THR CB C 16 68.213 68.213 68.504 -0.291 19498
1120 1 4 . 1 1 16 16 THR H H 16 8.133 8.133 7.934 0.199 19498
1121 1 4 . 1 1 17 17 ASN N N 17 121.090 121.090 118.210 2.880 19498
1122 1 4 . 1 1 17 17 ASN HA H 17 4.520 4.520 4.576 -0.056 19498
1123 1 4 . 1 1 17 17 ASN CA C 17 56.191 56.191 55.758 0.433 19498
1124 1 4 . 1 1 17 17 ASN CB C 17 38.365 38.365 38.299 0.066 19498
1125 1 4 . 1 1 17 17 ASN H H 17 8.152 8.152 8.317 -0.165 19498
1126 1 4 . 1 1 18 18 LYS N N 18 119.978 119.978 119.741 0.237 19498
1127 1 4 . 1 1 18 18 LYS HA H 18 3.914 3.914 4.122 -0.208 19498
1128 1 4 . 1 1 18 18 LYS CA C 18 59.865 59.865 58.978 0.887 19498
1129 1 4 . 1 1 18 18 LYS CB C 18 30.999 30.999 32.402 -1.403 19498
1130 1 4 . 1 1 18 18 LYS H H 18 7.568 7.568 7.469 0.099 19498
1131 1 4 . 1 1 19 19 LEU N N 19 117.558 117.558 118.834 -1.276 19498
1132 1 4 . 1 1 19 19 LEU HA H 19 4.135 4.135 4.148 -0.013 19498
1133 1 4 . 1 1 19 19 LEU CA C 19 58.001 58.001 57.761 0.240 19498
1134 1 4 . 1 1 19 19 LEU CB C 19 40.823 40.823 42.116 -1.293 19498
1135 1 4 . 1 1 19 19 LEU H H 19 7.001 7.001 7.841 -0.840 19498
1136 1 4 . 1 1 20 20 PHE N N 20 121.123 121.123 120.653 0.470 19498
1137 1 4 . 1 1 20 20 PHE HA H 20 4.873 4.873 4.245 0.628 19498
1138 1 4 . 1 1 20 20 PHE CA C 20 60.375 60.375 60.881 -0.506 19498
1139 1 4 . 1 1 20 20 PHE CB C 20 38.480 38.480 39.176 -0.696 19498
1140 1 4 . 1 1 20 20 PHE H H 20 8.193 8.193 8.066 0.127 19498
1141 1 4 . 1 1 21 21 GLN N N 21 118.591 118.591 117.297 1.294 19498
1142 1 4 . 1 1 21 21 GLN HA H 21 4.208 4.208 3.990 0.218 19498
1143 1 4 . 1 1 21 21 GLN CA C 21 58.055 58.055 58.136 -0.081 19498
1144 1 4 . 1 1 21 21 GLN CB C 21 28.284 28.284 28.784 -0.499 19498
1145 1 4 . 1 1 21 21 GLN H H 21 7.918 7.918 7.976 -0.058 19498
1146 1 4 . 1 1 22 22 LEU N N 22 118.477 118.477 118.797 -0.320 19498
1147 1 4 . 1 1 22 22 LEU HA H 22 4.534 4.534 4.469 0.065 19498
1148 1 4 . 1 1 22 22 LEU CA C 22 54.033 54.033 54.624 -0.591 19498
1149 1 4 . 1 1 22 22 LEU CB C 22 41.469 41.469 43.287 -1.818 19498
1150 1 4 . 1 1 22 22 LEU H H 22 7.561 7.561 7.447 0.114 19498
1151 1 4 . 1 1 23 23 ASP N N 23 115.410 115.410 117.699 -2.289 19498
1152 1 4 . 1 1 23 23 ASP HA H 23 4.280 4.280 4.076 0.204 19498
1153 1 4 . 1 1 23 23 ASP CA C 23 55.494 55.494 55.408 0.086 19498
1154 1 4 . 1 1 23 23 ASP CB C 23 39.317 39.317 38.555 0.762 19498
1155 1 4 . 1 1 23 23 ASP H H 23 8.163 8.163 7.769 0.394 19498
1156 1 4 . 1 1 24 24 LEU N N 24 116.367 116.367 114.751 1.616 19498
1157 1 4 . 1 1 24 24 LEU HA H 24 4.790 4.790 4.816 -0.026 19498
1158 1 4 . 1 1 24 24 LEU CA C 24 53.030 53.030 53.186 -0.156 19498
1159 1 4 . 1 1 24 24 LEU CB C 24 43.867 43.867 43.656 0.211 19498
1160 1 4 . 1 1 24 24 LEU H H 24 7.136 7.136 7.338 -0.202 19498
1161 1 4 . 1 1 25 25 ALA N N 25 123.243 123.243 121.825 1.418 19498
1162 1 4 . 1 1 25 25 ALA HA H 25 4.480 4.480 4.964 -0.484 19498
1163 1 4 . 1 1 25 25 ALA CA C 25 50.890 50.890 51.270 -0.380 19498
1164 1 4 . 1 1 25 25 ALA CB C 25 21.655 21.655 20.824 0.831 19498
1165 1 4 . 1 1 25 25 ALA H H 25 8.931 8.931 8.454 0.477 19498
1166 1 4 . 1 1 26 26 VAL N N 26 119.587 119.587 120.172 -0.585 19498
1167 1 4 . 1 1 26 26 VAL HA H 26 4.889 4.889 4.682 0.207 19498
1168 1 4 . 1 1 26 26 VAL CA C 26 61.278 61.278 61.400 -0.122 19498
1169 1 4 . 1 1 26 26 VAL CB C 26 33.310 33.310 34.223 -0.913 19498
1170 1 4 . 1 1 26 26 VAL H H 26 7.575 7.575 8.336 -0.761 19498
1171 1 4 . 1 1 27 27 ILE N N 27 130.377 130.377 123.557 6.820 19498
1172 1 4 . 1 1 27 27 ILE HA H 27 4.489 4.489 4.710 -0.221 19498
1173 1 4 . 1 1 27 27 ILE CA C 27 60.177 60.177 60.519 -0.342 19498
1174 1 4 . 1 1 27 27 ILE CB C 27 40.019 40.019 40.598 -0.579 19498
1175 1 4 . 1 1 27 27 ILE H H 27 9.437 9.437 8.701 0.736 19498
1176 1 4 . 1 1 28 28 TYR N N 28 126.844 126.844 122.224 4.620 19498
1177 1 4 . 1 1 28 28 TYR HA H 28 5.709 5.709 5.792 -0.083 19498
1178 1 4 . 1 1 28 28 TYR CA C 28 55.486 55.486 55.499 -0.013 19498
1179 1 4 . 1 1 28 28 TYR CB C 28 42.019 42.019 41.339 0.680 19498
1180 1 4 . 1 1 28 28 TYR H H 28 8.531 8.531 7.952 0.579 19498
1181 1 4 . 1 1 29 29 ASP N N 29 122.875 122.875 121.342 1.533 19498
1182 1 4 . 1 1 29 29 ASP HA H 29 4.966 4.966 4.859 0.107 19498
1183 1 4 . 1 1 29 29 ASP CA C 29 53.659 53.659 54.108 -0.449 19498
1184 1 4 . 1 1 29 29 ASP CB C 29 44.660 44.660 45.496 -0.836 19498
1185 1 4 . 1 1 29 29 ASP H H 29 8.614 8.614 8.494 0.120 19498
1186 1 4 . 1 1 30 30 ASP N N 30 119.325 119.325 121.399 -2.074 19498
1187 1 4 . 1 1 30 30 ASP HA H 30 5.447 5.447 4.878 0.569 19498
1188 1 4 . 1 1 30 30 ASP CA C 30 53.501 53.501 54.097 -0.596 19498
1189 1 4 . 1 1 30 30 ASP CB C 30 43.921 43.921 42.401 1.520 19498
1190 1 4 . 1 1 30 30 ASP H H 30 8.607 8.607 8.281 0.326 19498
1191 1 4 . 1 1 31 31 TRP N N 31 120.552 120.552 126.820 -6.268 19498
1192 1 4 . 1 1 31 31 TRP HA H 31 4.615 4.615 4.986 -0.371 19498
1193 1 4 . 1 1 31 31 TRP CA C 31 58.000 58.000 56.655 1.345 19498
1194 1 4 . 1 1 31 31 TRP CB C 31 31.500 31.500 30.673 0.827 19498
1195 1 4 . 1 1 31 31 TRP H H 31 8.673 8.673 8.655 0.018 19498
1196 1 4 . 1 1 32 32 TYR CA C 32 52.400 52.400 56.644 -4.244 19498
1197 1 4 . 1 1 32 32 TYR CB C 32 42.350 42.350 39.280 3.070 19498
1198 1 4 . 1 1 33 33 ASP CA C 33 52.400 52.400 55.117 -2.717 19498
1199 1 4 . 1 1 33 33 ASP CB C 33 42.350 42.350 41.099 1.251 19498
1200 1 4 . 1 1 34 34 ALA N N 34 126.709 126.709 119.553 7.156 19498
1201 1 4 . 1 1 34 34 ALA HA H 34 3.845 3.845 4.580 -0.735 19498
1202 1 4 . 1 1 34 34 ALA CA C 34 58.599 58.599 51.368 7.231 19498
1203 1 4 . 1 1 34 34 ALA CB C 34 18.610 18.610 20.822 -2.212 19498
1204 1 4 . 1 1 34 34 ALA H H 34 8.424 8.424 7.436 0.988 19498
1205 1 4 . 1 1 35 35 TYR N N 35 117.123 117.123 116.816 0.307 19498
1206 1 4 . 1 1 35 35 TYR HA H 35 4.350 4.350 4.761 -0.411 19498
1207 1 4 . 1 1 35 35 TYR CA C 35 60.466 60.466 58.424 2.042 19498
1208 1 4 . 1 1 35 35 TYR CB C 35 38.113 38.113 38.825 -0.712 19498
1209 1 4 . 1 1 35 35 TYR H H 35 8.334 8.334 8.249 0.085 19498
1210 1 4 . 1 1 36 36 THR N N 36 108.046 108.046 111.636 -3.590 19498
1211 1 4 . 1 1 36 36 THR HA H 36 4.018 4.018 4.335 -0.317 19498
1212 1 4 . 1 1 36 36 THR CA C 36 61.809 61.809 62.176 -0.367 19498
1213 1 4 . 1 1 36 36 THR CB C 36 69.926 69.926 68.652 1.274 19498
1214 1 4 . 1 1 36 36 THR H H 36 7.563 7.563 7.802 -0.239 19498
1215 1 4 . 1 1 37 37 ARG N N 37 118.456 118.456 122.081 -3.625 19498
1216 1 4 . 1 1 37 37 ARG CA C 37 57.001 57.001 55.269 1.732 19498
1217 1 4 . 1 1 37 37 ARG H H 37 7.952 7.952 7.521 0.431 19498
1218 1 4 . 1 1 40 40 CYS CA C 40 56.316 56.316 56.872 -0.556 19498
1219 1 4 . 1 1 40 40 CYS CB C 40 29.999 29.999 31.488 -1.489 19498
1220 1 4 . 1 1 41 41 ILE N N 41 121.419 121.419 122.766 -1.347 19498
1221 1 4 . 1 1 41 41 ILE HA H 41 4.709 4.709 4.391 0.318 19498
1222 1 4 . 1 1 41 41 ILE CA C 41 60.462 60.462 60.890 -0.428 19498
1223 1 4 . 1 1 41 41 ILE CB C 41 42.309 42.309 41.056 1.253 19498
1224 1 4 . 1 1 41 41 ILE H H 41 8.459 8.459 8.351 0.108 19498
1225 1 4 . 1 1 42 42 ARG N N 42 127.916 127.916 126.634 1.282 19498
1226 1 4 . 1 1 42 42 ARG CA C 42 54.501 54.501 54.845 -0.344 19498
1227 1 4 . 1 1 42 42 ARG CB C 42 33.204 33.204 32.935 0.269 19498
1228 1 4 . 1 1 42 42 ARG H H 42 9.004 9.004 8.556 0.448 19498
1229 1 4 . 1 1 43 43 LEU N N 43 124.715 124.715 125.472 -0.757 19498
1230 1 4 . 1 1 43 43 LEU HA H 43 5.538 5.538 4.854 0.684 19498
1231 1 4 . 1 1 43 43 LEU CA C 43 53.266 53.266 54.065 -0.799 19498
1232 1 4 . 1 1 43 43 LEU CB C 43 46.163 46.163 45.390 0.773 19498
1233 1 4 . 1 1 43 43 LEU H H 43 8.757 8.757 9.052 -0.295 19498
1234 1 4 . 1 1 44 44 ARG N N 44 123.499 123.499 127.460 -3.961 19498
1235 1 4 . 1 1 44 44 ARG HA H 44 5.004 5.004 4.886 0.118 19498
1236 1 4 . 1 1 44 44 ARG CA C 44 55.508 55.508 54.689 0.819 19498
1237 1 4 . 1 1 44 44 ARG CB C 44 34.543 34.543 33.660 0.883 19498
1238 1 4 . 1 1 44 44 ARG H H 44 9.366 9.366 9.320 0.046 19498
1239 1 4 . 1 1 45 45 ILE N N 45 122.919 122.919 126.445 -3.526 19498
1240 1 4 . 1 1 45 45 ILE HA H 45 5.260 5.260 4.721 0.539 19498
1241 1 4 . 1 1 45 45 ILE CA C 45 59.933 59.933 59.117 0.816 19498
1242 1 4 . 1 1 45 45 ILE CB C 45 39.751 39.751 39.512 0.239 19498
1243 1 4 . 1 1 45 45 ILE H H 45 8.938 8.938 8.797 0.141 19498
1244 1 4 . 1 1 46 46 GLU N N 46 126.745 126.745 124.682 2.063 19498
1245 1 4 . 1 1 46 46 GLU HA H 46 5.465 5.465 4.901 0.564 19498
1246 1 4 . 1 1 46 46 GLU CA C 46 53.707 53.707 55.109 -1.402 19498
1247 1 4 . 1 1 46 46 GLU CB C 46 35.276 35.276 34.418 0.858 19498
1248 1 4 . 1 1 46 46 GLU H H 46 9.097 9.097 8.426 0.671 19498
1249 1 4 . 1 1 47 47 ASP N N 47 117.988 117.988 120.927 -2.939 19498
1250 1 4 . 1 1 47 47 ASP HA H 47 4.976 4.976 4.552 0.424 19498
1251 1 4 . 1 1 47 47 ASP CA C 47 52.411 52.411 54.492 -2.081 19498
1252 1 4 . 1 1 47 47 ASP CB C 47 41.609 41.609 41.920 -0.311 19498
1253 1 4 . 1 1 47 47 ASP H H 47 8.209 8.209 8.784 -0.575 19498
1254 1 4 . 1 1 48 48 ARG N N 48 117.098 117.098 119.217 -2.119 19498
1255 1 4 . 1 1 48 48 ARG HA H 48 4.129 4.129 4.366 -0.237 19498
1256 1 4 . 1 1 48 48 ARG CA C 48 58.323 58.323 57.535 0.788 19498
1257 1 4 . 1 1 48 48 ARG CB C 48 29.511 29.511 30.545 -1.034 19498
1258 1 4 . 1 1 48 48 ARG H H 48 8.872 8.872 8.528 0.344 19498
1259 1 4 . 1 1 49 49 SER N N 49 115.006 115.006 114.649 0.357 19498
1260 1 4 . 1 1 49 49 SER HA H 49 4.614 4.614 4.517 0.097 19498
1261 1 4 . 1 1 49 49 SER CA C 49 58.411 58.411 59.566 -1.155 19498
1262 1 4 . 1 1 49 49 SER CB C 49 63.806 63.806 64.182 -0.376 19498
1263 1 4 . 1 1 49 49 SER H H 49 8.142 8.142 8.525 -0.383 19498
1264 1 4 . 1 1 50 50 GLY N N 50 109.042 109.042 109.405 -0.363 19498
1265 1 4 . 1 1 50 50 GLY CA C 50 44.997 44.997 45.443 -0.445 19498
1266 1 4 . 1 1 50 50 GLY H H 50 8.035 8.035 8.088 -0.053 19498
1267 1 4 . 1 1 51 51 ASN N N 51 119.842 119.842 120.616 -0.774 19498
1268 1 4 . 1 1 51 51 ASN HA H 51 4.546 4.546 4.926 -0.380 19498
1269 1 4 . 1 1 51 51 ASN CA C 51 53.419 53.419 53.217 0.202 19498
1270 1 4 . 1 1 51 51 ASN CB C 51 38.422 38.422 40.538 -2.116 19498
1271 1 4 . 1 1 51 51 ASN H H 51 8.613 8.613 8.129 0.484 19498
1272 1 4 . 1 1 52 52 LEU N N 52 124.085 124.085 121.839 2.246 19498
1273 1 4 . 1 1 52 52 LEU HA H 52 4.142 4.142 4.567 -0.425 19498
1274 1 4 . 1 1 52 52 LEU CA C 52 56.023 56.023 55.655 0.368 19498
1275 1 4 . 1 1 52 52 LEU CB C 52 42.353 42.353 42.583 -0.230 19498
1276 1 4 . 1 1 52 52 LEU H H 52 8.631 8.631 8.560 0.071 19498
1277 1 4 . 1 1 53 53 ILE N N 53 129.362 129.362 122.241 7.121 19498
1278 1 4 . 1 1 53 53 ILE HA H 53 4.137 4.137 4.337 -0.200 19498
1279 1 4 . 1 1 53 53 ILE CA C 53 61.800 61.800 61.160 0.640 19498
1280 1 4 . 1 1 53 53 ILE CB C 53 37.256 37.256 38.957 -1.701 19498
1281 1 4 . 1 1 53 53 ILE H H 53 9.432 9.432 8.488 0.944 19498
1282 1 4 . 1 1 54 54 ASP N N 54 113.575 113.575 117.361 -3.786 19498
1283 1 4 . 1 1 54 54 ASP HA H 54 4.847 4.847 4.984 -0.137 19498
1284 1 4 . 1 1 54 54 ASP CA C 54 53.586 53.586 54.378 -0.792 19498
1285 1 4 . 1 1 54 54 ASP CB C 54 44.500 44.500 44.112 0.388 19498
1286 1 4 . 1 1 54 54 ASP H H 54 7.761 7.761 8.073 -0.312 19498
1287 1 4 . 1 1 55 55 THR N N 55 115.783 115.783 114.288 1.495 19498
1288 1 4 . 1 1 55 55 THR HA H 55 5.427 5.427 4.869 0.558 19498
1289 1 4 . 1 1 55 55 THR CA C 55 59.185 59.185 61.149 -1.964 19498
1290 1 4 . 1 1 55 55 THR CB C 55 70.551 70.551 71.597 -1.046 19498
1291 1 4 . 1 1 55 55 THR H H 55 10.106 10.106 8.361 1.745 19498
1292 1 4 . 1 1 56 56 SER N N 56 119.808 119.808 119.599 0.209 19498
1293 1 4 . 1 1 56 56 SER HA H 56 4.135 4.135 4.578 -0.443 19498
1294 1 4 . 1 1 56 56 SER CA C 56 58.001 58.001 56.558 1.443 19498
1295 1 4 . 1 1 56 56 SER CB C 56 65.039 65.039 64.259 0.780 19498
1296 1 4 . 1 1 56 56 SER H H 56 7.872 7.872 8.820 -0.948 19498
1297 1 4 . 1 1 57 57 THR N N 57 117.962 117.962 122.141 -4.179 19498
1298 1 4 . 1 1 57 57 THR HA H 57 4.964 4.964 4.510 0.454 19498
1299 1 4 . 1 1 57 57 THR CA C 57 61.001 61.001 62.008 -1.007 19498
1300 1 4 . 1 1 57 57 THR CB C 57 70.881 70.881 70.170 0.711 19498
1301 1 4 . 1 1 57 57 THR H H 57 7.524 7.524 8.317 -0.793 19498
1302 1 4 . 1 1 58 58 PHE N N 58 123.853 123.853 128.121 -4.268 19498
1303 1 4 . 1 1 58 58 PHE HA H 58 4.603 4.603 4.678 -0.075 19498
1304 1 4 . 1 1 58 58 PHE CA C 58 56.648 56.648 57.398 -0.750 19498
1305 1 4 . 1 1 58 58 PHE CB C 58 43.583 43.583 39.815 3.768 19498
1306 1 4 . 1 1 58 58 PHE H H 58 8.861 8.861 9.262 -0.401 19498
1307 1 4 . 1 1 59 59 TYR N N 59 117.898 117.898 121.844 -3.946 19498
1308 1 4 . 1 1 59 59 TYR HA H 59 5.328 5.328 5.021 0.307 19498
1309 1 4 . 1 1 59 59 TYR CA C 59 56.221 56.221 57.663 -1.442 19498
1310 1 4 . 1 1 59 59 TYR CB C 59 42.106 42.106 39.311 2.795 19498
1311 1 4 . 1 1 59 59 TYR H H 59 8.328 8.328 8.584 -0.256 19498
1312 1 4 . 1 1 60 60 HIS CA C 60 60.065 60.065 56.861 3.204 19498
1313 1 4 . 1 1 60 60 HIS CB C 60 34.284 34.284 30.220 4.064 19498
1314 1 4 . 1 1 61 61 HIS N N 61 121.880 121.880 120.007 1.873 19498
1315 1 4 . 1 1 61 61 HIS CA C 61 58.001 58.001 54.839 3.162 19498
1316 1 4 . 1 1 61 61 HIS CB C 61 29.999 29.999 32.025 -2.026 19498
1317 1 4 . 1 1 61 61 HIS H H 61 7.734 7.734 8.322 -0.588 19498
1318 1 4 . 1 1 62 62 ASP N N 62 128.148 128.148 120.478 7.670 19498
1319 1 4 . 1 1 62 62 ASP HA H 62 4.870 4.870 4.363 0.507 19498
1320 1 4 . 1 1 62 62 ASP CA C 62 53.348 53.348 54.580 -1.232 19498
1321 1 4 . 1 1 62 62 ASP CB C 62 42.600 42.600 42.076 0.524 19498
1322 1 4 . 1 1 62 62 ASP H H 62 11.492 11.492 7.936 3.556 19498
1323 1 4 . 1 1 63 63 GLU N N 63 126.564 126.564 120.347 6.217 19498
1324 1 4 . 1 1 63 63 GLU HA H 63 3.795 3.795 3.870 -0.075 19498
1325 1 4 . 1 1 63 63 GLU CA C 63 59.863 59.863 59.017 0.846 19498
1326 1 4 . 1 1 63 63 GLU CB C 63 34.007 34.007 29.570 4.437 19498
1327 1 4 . 1 1 63 63 GLU H H 63 8.982 8.982 8.733 0.249 19498
1328 1 4 . 1 1 64 64 ASP N N 64 117.779 117.779 120.684 -2.905 19498
1329 1 4 . 1 1 64 64 ASP HA H 64 4.401 4.401 4.365 0.036 19498
1330 1 4 . 1 1 64 64 ASP CA C 64 57.664 57.664 57.588 0.076 19498
1331 1 4 . 1 1 64 64 ASP CB C 64 40.369 40.369 40.856 -0.487 19498
1332 1 4 . 1 1 64 64 ASP H H 64 8.272 8.272 8.029 0.243 19498
1333 1 4 . 1 1 65 65 VAL N N 65 121.948 121.948 120.298 1.650 19498
1334 1 4 . 1 1 65 65 VAL HA H 65 3.386 3.386 3.874 -0.488 19498
1335 1 4 . 1 1 65 65 VAL CA C 65 65.913 65.913 65.864 0.049 19498
1336 1 4 . 1 1 65 65 VAL CB C 65 31.465 31.465 31.859 -0.394 19498
1337 1 4 . 1 1 65 65 VAL H H 65 7.335 7.335 7.476 -0.141 19498
1338 1 4 . 1 1 66 66 LEU N N 66 120.747 120.747 121.693 -0.946 19498
1339 1 4 . 1 1 66 66 LEU HA H 66 3.905 3.905 3.938 -0.033 19498
1340 1 4 . 1 1 66 66 LEU CA C 66 58.076 58.076 58.148 -0.072 19498
1341 1 4 . 1 1 66 66 LEU CB C 66 42.160 42.160 40.700 1.460 19498
1342 1 4 . 1 1 66 66 LEU H H 66 8.164 8.164 8.149 0.015 19498
1343 1 4 . 1 1 67 67 PHE N N 67 116.553 116.553 117.464 -0.911 19498
1344 1 4 . 1 1 67 67 PHE HA H 67 3.900 3.900 4.023 -0.123 19498
1345 1 4 . 1 1 67 67 PHE CA C 67 62.849 62.849 62.218 0.631 19498
1346 1 4 . 1 1 67 67 PHE CB C 67 38.003 38.003 37.798 0.205 19498
1347 1 4 . 1 1 67 67 PHE H H 67 8.350 8.350 8.026 0.324 19498
1348 1 4 . 1 1 68 68 ASN N N 68 121.020 121.020 118.784 2.236 19498
1349 1 4 . 1 1 68 68 ASN HA H 68 4.415 4.415 4.463 -0.048 19498
1350 1 4 . 1 1 68 68 ASN CA C 68 56.725 56.725 56.206 0.519 19498
1351 1 4 . 1 1 68 68 ASN CB C 68 38.071 38.071 38.377 -0.306 19498
1352 1 4 . 1 1 68 68 ASN H H 68 8.001 8.001 7.797 0.204 19498
1353 1 4 . 1 1 69 69 MET N N 69 120.402 120.402 118.019 2.383 19498
1354 1 4 . 1 1 69 69 MET HA H 69 4.011 4.011 4.207 -0.196 19498
1355 1 4 . 1 1 69 69 MET CA C 69 59.605 59.605 59.132 0.473 19498
1356 1 4 . 1 1 69 69 MET CB C 69 31.867 31.867 32.737 -0.870 19498
1357 1 4 . 1 1 69 69 MET H H 69 8.465 8.465 8.128 0.337 19498
1358 1 4 . 1 1 70 70 CYS N N 70 117.496 117.496 116.054 1.442 19498
1359 1 4 . 1 1 70 70 CYS CA C 70 63.145 63.145 62.340 0.805 19498
1360 1 4 . 1 1 70 70 CYS CB C 70 27.510 27.510 28.007 -0.497 19498
1361 1 4 . 1 1 70 70 CYS H H 70 7.616 7.616 7.595 0.021 19498
1362 1 4 . 1 1 71 71 THR N N 71 118.640 118.640 115.693 2.947 19498
1363 1 4 . 1 1 71 71 THR HA H 71 4.270 4.270 4.086 0.184 19498
1364 1 4 . 1 1 71 71 THR CA C 71 67.980 67.980 66.623 1.357 19498
1365 1 4 . 1 1 71 71 THR CB C 71 67.949 67.949 68.514 -0.565 19498
1366 1 4 . 1 1 71 71 THR H H 71 8.509 8.509 8.328 0.181 19498
1367 1 4 . 1 1 72 72 ASP HA H 72 4.430 4.430 4.521 -0.091 19498
1368 1 4 . 1 1 72 72 ASP CA C 72 57.590 57.590 57.311 0.279 19498
1369 1 4 . 1 1 72 72 ASP CB C 72 40.415 40.415 40.838 -0.423 19498
1370 1 4 . 1 1 73 73 TRP N N 73 121.657 121.657 121.509 0.148 19498
1371 1 4 . 1 1 73 73 TRP HA H 73 4.407 4.407 4.444 -0.037 19498
1372 1 4 . 1 1 73 73 TRP CA C 73 62.951 62.951 61.951 1.000 19498
1373 1 4 . 1 1 73 73 TRP CB C 73 29.114 29.114 30.137 -1.023 19498
1374 1 4 . 1 1 73 73 TRP H H 73 7.780 7.780 7.556 0.224 19498
1375 1 4 . 1 1 74 74 LEU N N 74 118.727 118.727 118.703 0.024 19498
1376 1 4 . 1 1 74 74 LEU HA H 74 3.582 3.582 3.973 -0.391 19498
1377 1 4 . 1 1 74 74 LEU CA C 74 58.184 58.184 58.138 0.046 19498
1378 1 4 . 1 1 74 74 LEU CB C 74 37.610 37.610 41.886 -4.276 19498
1379 1 4 . 1 1 74 74 LEU H H 74 8.490 8.490 7.946 0.544 19498
1380 1 4 . 1 1 75 75 ASN N N 75 117.962 117.962 117.604 0.358 19498
1381 1 4 . 1 1 75 75 ASN HA H 75 4.527 4.527 4.602 -0.075 19498
1382 1 4 . 1 1 75 75 ASN CA C 75 56.501 56.501 55.861 0.639 19498
1383 1 4 . 1 1 75 75 ASN CB C 75 37.999 37.999 37.934 0.065 19498
1384 1 4 . 1 1 75 75 ASN H H 75 8.639 8.639 8.035 0.604 19498
1385 1 4 . 1 1 76 76 HIS N N 76 120.823 120.823 119.004 1.819 19498
1386 1 4 . 1 1 76 76 HIS HA H 76 4.450 4.450 4.212 0.238 19498
1387 1 4 . 1 1 76 76 HIS CA C 76 58.737 58.737 59.252 -0.515 19498
1388 1 4 . 1 1 76 76 HIS CB C 76 28.007 28.007 29.916 -1.909 19498
1389 1 4 . 1 1 76 76 HIS H H 76 8.158 8.158 7.805 0.353 19498
1390 1 4 . 1 1 77 77 MET N N 77 118.749 118.749 115.465 3.284 19498
1391 1 4 . 1 1 77 77 MET HA H 77 4.071 4.071 3.827 0.244 19498
1392 1 4 . 1 1 77 77 MET CA C 77 55.827 55.827 57.440 -1.613 19498
1393 1 4 . 1 1 77 77 MET CB C 77 29.541 29.541 32.038 -2.497 19498
1394 1 4 . 1 1 77 77 MET H H 77 8.404 8.404 7.469 0.935 19498
1395 1 4 . 1 1 78 78 TYR N N 78 120.762 120.762 119.501 1.261 19498
1396 1 4 . 1 1 78 78 TYR HA H 78 3.662 3.662 4.070 -0.408 19498
1397 1 4 . 1 1 78 78 TYR CA C 78 62.640 62.640 61.959 0.681 19498
1398 1 4 . 1 1 78 78 TYR CB C 78 37.545 37.545 37.730 -0.185 19498
1399 1 4 . 1 1 78 78 TYR H H 78 8.322 8.322 7.663 0.659 19498
1400 1 4 . 1 1 79 79 ASP N N 79 116.578 116.578 117.985 -1.407 19498
1401 1 4 . 1 1 79 79 ASP HA H 79 4.106 4.106 4.388 -0.282 19498
1402 1 4 . 1 1 79 79 ASP CA C 79 57.410 57.410 57.211 0.199 19498
1403 1 4 . 1 1 79 79 ASP CB C 79 40.503 40.503 40.536 -0.033 19498
1404 1 4 . 1 1 79 79 ASP H H 79 7.460 7.460 8.477 -1.017 19498
1405 1 4 . 1 1 80 80 GLN N N 80 116.175 116.175 118.389 -2.214 19498
1406 1 4 . 1 1 80 80 GLN HA H 80 4.056 4.056 4.093 -0.037 19498
1407 1 4 . 1 1 80 80 GLN CA C 80 57.629 57.629 58.586 -0.957 19498
1408 1 4 . 1 1 80 80 GLN CB C 80 29.662 29.662 28.627 1.035 19498
1409 1 4 . 1 1 80 80 GLN H H 80 7.552 7.552 8.514 -0.962 19498
1410 1 4 . 1 1 81 81 LEU N N 81 118.398 118.398 117.419 0.979 19498
1411 1 4 . 1 1 81 81 LEU HA H 81 4.233 4.233 4.418 -0.185 19498
1412 1 4 . 1 1 81 81 LEU CA C 81 55.461 55.461 55.714 -0.253 19498
1413 1 4 . 1 1 81 81 LEU CB C 81 42.406 42.406 41.441 0.965 19498
1414 1 4 . 1 1 81 81 LEU H H 81 7.957 7.957 7.465 0.492 19498
1415 1 4 . 1 1 82 82 LYS N N 82 119.114 119.114 118.201 0.913 19498
1416 1 4 . 1 1 82 82 LYS HA H 82 3.841 3.841 4.248 -0.407 19498
1417 1 4 . 1 1 82 82 LYS CA C 82 58.510 58.510 57.858 0.652 19498
1418 1 4 . 1 1 82 82 LYS CB C 82 30.922 30.922 32.572 -1.650 19498
1419 1 4 . 1 1 82 82 LYS H H 82 7.664 7.664 7.607 0.057 19498
1420 1 4 . 1 1 83 83 ASP N N 83 118.655 118.655 118.007 0.648 19498
1421 1 4 . 1 1 83 83 ASP HA H 83 4.819 4.819 4.456 0.363 19498
1422 1 4 . 1 1 83 83 ASP CA C 83 53.886 53.886 54.999 -1.113 19498
1423 1 4 . 1 1 83 83 ASP CB C 83 40.986 40.986 41.170 -0.184 19498
1424 1 4 . 1 1 83 83 ASP H H 83 7.862 7.862 7.671 0.191 19498
1425 1 4 . 1 1 84 84 TRP N N 84 121.757 121.757 121.067 0.690 19498
1426 1 4 . 1 1 84 84 TRP CA C 84 58.462 58.462 56.010 2.452 19498
1427 1 4 . 1 1 84 84 TRP CB C 84 28.934 28.934 29.558 -0.624 19498
1428 1 4 . 1 1 84 84 TRP H H 84 7.925 7.925 7.294 0.631 19498
1429 1 5 . 1 1 6 6 SER CA C 6 56.008 56.008 58.445 -2.437 19498
1430 1 5 . 1 1 7 7 GLY N N 7 109.496 109.496 114.712 -5.216 19498
1431 1 5 . 1 1 7 7 GLY CA C 7 46.042 46.042 46.401 -0.359 19498
1432 1 5 . 1 1 7 7 GLY H H 7 8.432 8.432 9.012 -0.580 19498
1433 1 5 . 1 1 8 8 ASN N N 8 119.432 119.432 119.863 -0.431 19498
1434 1 5 . 1 1 8 8 ASN HA H 8 4.685 4.685 4.627 0.058 19498
1435 1 5 . 1 1 8 8 ASN CA C 8 53.922 53.922 54.095 -0.173 19498
1436 1 5 . 1 1 8 8 ASN CB C 8 37.970 37.970 38.454 -0.484 19498
1437 1 5 . 1 1 8 8 ASN H H 8 8.367 8.367 7.889 0.478 19498
1438 1 5 . 1 1 9 9 LEU N N 9 123.537 123.537 118.447 5.090 19498
1439 1 5 . 1 1 9 9 LEU HA H 9 3.984 3.984 4.695 -0.711 19498
1440 1 5 . 1 1 9 9 LEU CA C 9 56.417 56.417 54.676 1.740 19498
1441 1 5 . 1 1 9 9 LEU CB C 9 41.566 41.566 42.185 -0.619 19498
1442 1 5 . 1 1 9 9 LEU H H 9 7.922 7.922 7.721 0.201 19498
1443 1 5 . 1 1 10 10 ALA N N 10 122.287 122.287 124.116 -1.829 19498
1444 1 5 . 1 1 10 10 ALA HA H 10 4.127 4.127 4.068 0.059 19498
1445 1 5 . 1 1 10 10 ALA CA C 10 55.912 55.912 55.358 0.554 19498
1446 1 5 . 1 1 10 10 ALA CB C 10 17.998 17.998 18.273 -0.275 19498
1447 1 5 . 1 1 10 10 ALA H H 10 8.064 8.064 8.162 -0.098 19498
1448 1 5 . 1 1 11 11 ALA N N 11 121.326 121.326 119.826 1.500 19498
1449 1 5 . 1 1 11 11 ALA HA H 11 4.207 4.207 4.209 -0.002 19498
1450 1 5 . 1 1 11 11 ALA CA C 11 54.960 54.960 54.088 0.872 19498
1451 1 5 . 1 1 11 11 ALA CB C 11 17.998 17.998 18.454 -0.456 19498
1452 1 5 . 1 1 11 11 ALA H H 11 8.143 8.143 8.375 -0.232 19498
1453 1 5 . 1 1 12 12 PHE N N 12 122.913 122.913 119.236 3.677 19498
1454 1 5 . 1 1 12 12 PHE HA H 12 4.411 4.411 4.152 0.259 19498
1455 1 5 . 1 1 12 12 PHE CA C 12 61.007 61.007 61.255 -0.248 19498
1456 1 5 . 1 1 12 12 PHE CB C 12 39.499 39.499 39.214 0.285 19498
1457 1 5 . 1 1 12 12 PHE H H 12 7.779 7.779 8.219 -0.440 19498
1458 1 5 . 1 1 13 13 LYS N N 13 120.689 120.689 117.488 3.201 19498
1459 1 5 . 1 1 13 13 LYS HA H 13 3.861 3.861 4.126 -0.265 19498
1460 1 5 . 1 1 13 13 LYS CA C 13 59.099 59.099 59.199 -0.100 19498
1461 1 5 . 1 1 13 13 LYS CB C 13 31.867 31.867 32.392 -0.525 19498
1462 1 5 . 1 1 13 13 LYS H H 13 8.614 8.614 8.349 0.265 19498
1463 1 5 . 1 1 14 14 ALA N N 14 122.076 122.076 121.311 0.765 19498
1464 1 5 . 1 1 14 14 ALA HA H 14 3.182 3.182 4.150 -0.968 19498
1465 1 5 . 1 1 14 14 ALA CA C 14 55.108 55.108 54.641 0.467 19498
1466 1 5 . 1 1 14 14 ALA CB C 14 18.120 18.120 18.115 0.005 19498
1467 1 5 . 1 1 14 14 ALA H H 14 8.178 8.178 7.587 0.591 19498
1468 1 5 . 1 1 15 15 ALA N N 15 121.714 121.714 120.121 1.593 19498
1469 1 5 . 1 1 15 15 ALA HA H 15 4.040 4.040 4.067 -0.027 19498
1470 1 5 . 1 1 15 15 ALA CA C 15 55.158 55.158 54.928 0.230 19498
1471 1 5 . 1 1 15 15 ALA CB C 15 19.042 19.042 18.071 0.971 19498
1472 1 5 . 1 1 15 15 ALA H H 15 7.793 7.793 7.529 0.264 19498
1473 1 5 . 1 1 16 16 THR N N 16 111.959 111.959 113.617 -1.658 19498
1474 1 5 . 1 1 16 16 THR HA H 16 3.705 3.705 3.969 -0.264 19498
1475 1 5 . 1 1 16 16 THR CA C 16 66.762 66.762 67.068 -0.306 19498
1476 1 5 . 1 1 16 16 THR CB C 16 68.213 68.213 68.518 -0.305 19498
1477 1 5 . 1 1 16 16 THR H H 16 8.133 8.133 7.592 0.541 19498
1478 1 5 . 1 1 17 17 ASN N N 17 121.090 121.090 117.931 3.159 19498
1479 1 5 . 1 1 17 17 ASN HA H 17 4.520 4.520 4.504 0.016 19498
1480 1 5 . 1 1 17 17 ASN CA C 17 56.191 56.191 55.847 0.344 19498
1481 1 5 . 1 1 17 17 ASN CB C 17 38.365 38.365 38.508 -0.143 19498
1482 1 5 . 1 1 17 17 ASN H H 17 8.152 8.152 7.721 0.431 19498
1483 1 5 . 1 1 18 18 LYS N N 18 119.978 119.978 118.725 1.253 19498
1484 1 5 . 1 1 18 18 LYS HA H 18 3.914 3.914 3.977 -0.063 19498
1485 1 5 . 1 1 18 18 LYS CA C 18 59.865 59.865 58.145 1.720 19498
1486 1 5 . 1 1 18 18 LYS CB C 18 30.999 30.999 31.423 -0.424 19498
1487 1 5 . 1 1 18 18 LYS H H 18 7.568 7.568 7.641 -0.073 19498
1488 1 5 . 1 1 19 19 LEU N N 19 117.558 117.558 119.414 -1.856 19498
1489 1 5 . 1 1 19 19 LEU HA H 19 4.135 4.135 4.177 -0.042 19498
1490 1 5 . 1 1 19 19 LEU CA C 19 58.001 58.001 57.481 0.520 19498
1491 1 5 . 1 1 19 19 LEU CB C 19 40.823 40.823 41.516 -0.693 19498
1492 1 5 . 1 1 19 19 LEU H H 19 7.001 7.001 7.957 -0.956 19498
1493 1 5 . 1 1 20 20 PHE N N 20 121.123 121.123 118.016 3.107 19498
1494 1 5 . 1 1 20 20 PHE HA H 20 4.873 4.873 4.204 0.669 19498
1495 1 5 . 1 1 20 20 PHE CA C 20 60.375 60.375 60.540 -0.165 19498
1496 1 5 . 1 1 20 20 PHE CB C 20 38.480 38.480 39.154 -0.674 19498
1497 1 5 . 1 1 20 20 PHE H H 20 8.193 8.193 7.657 0.536 19498
1498 1 5 . 1 1 21 21 GLN N N 21 118.591 118.591 114.709 3.882 19498
1499 1 5 . 1 1 21 21 GLN HA H 21 4.208 4.208 4.242 -0.034 19498
1500 1 5 . 1 1 21 21 GLN CA C 21 58.055 58.055 56.727 1.328 19498
1501 1 5 . 1 1 21 21 GLN CB C 21 28.284 28.284 29.077 -0.793 19498
1502 1 5 . 1 1 21 21 GLN H H 21 7.918 7.918 7.934 -0.016 19498
1503 1 5 . 1 1 22 22 LEU N N 22 118.477 118.477 116.503 1.974 19498
1504 1 5 . 1 1 22 22 LEU HA H 22 4.534 4.534 4.546 -0.012 19498
1505 1 5 . 1 1 22 22 LEU CA C 22 54.033 54.033 54.172 -0.139 19498
1506 1 5 . 1 1 22 22 LEU CB C 22 41.469 41.469 42.567 -1.098 19498
1507 1 5 . 1 1 22 22 LEU H H 22 7.561 7.561 7.550 0.011 19498
1508 1 5 . 1 1 23 23 ASP N N 23 115.410 115.410 117.749 -2.339 19498
1509 1 5 . 1 1 23 23 ASP HA H 23 4.280 4.280 4.191 0.089 19498
1510 1 5 . 1 1 23 23 ASP CA C 23 55.494 55.494 55.657 -0.164 19498
1511 1 5 . 1 1 23 23 ASP CB C 23 39.317 39.317 39.571 -0.254 19498
1512 1 5 . 1 1 23 23 ASP H H 23 8.163 8.163 7.907 0.256 19498
1513 1 5 . 1 1 24 24 LEU N N 24 116.367 116.367 114.697 1.670 19498
1514 1 5 . 1 1 24 24 LEU HA H 24 4.790 4.790 4.815 -0.025 19498
1515 1 5 . 1 1 24 24 LEU CA C 24 53.030 53.030 53.386 -0.356 19498
1516 1 5 . 1 1 24 24 LEU CB C 24 43.867 43.867 44.452 -0.585 19498
1517 1 5 . 1 1 24 24 LEU H H 24 7.136 7.136 7.430 -0.294 19498
1518 1 5 . 1 1 25 25 ALA N N 25 123.243 123.243 120.783 2.460 19498
1519 1 5 . 1 1 25 25 ALA HA H 25 4.480 4.480 4.678 -0.198 19498
1520 1 5 . 1 1 25 25 ALA CA C 25 50.890 50.890 52.128 -1.238 19498
1521 1 5 . 1 1 25 25 ALA CB C 25 21.655 21.655 22.127 -0.472 19498
1522 1 5 . 1 1 25 25 ALA H H 25 8.931 8.931 8.539 0.392 19498
1523 1 5 . 1 1 26 26 VAL N N 26 119.587 119.587 122.320 -2.733 19498
1524 1 5 . 1 1 26 26 VAL HA H 26 4.889 4.889 4.766 0.123 19498
1525 1 5 . 1 1 26 26 VAL CA C 26 61.278 61.278 60.910 0.368 19498
1526 1 5 . 1 1 26 26 VAL CB C 26 33.310 33.310 34.403 -1.093 19498
1527 1 5 . 1 1 26 26 VAL H H 26 7.575 7.575 8.393 -0.818 19498
1528 1 5 . 1 1 27 27 ILE N N 27 130.377 130.377 126.658 3.719 19498
1529 1 5 . 1 1 27 27 ILE HA H 27 4.489 4.489 4.779 -0.290 19498
1530 1 5 . 1 1 27 27 ILE CA C 27 60.177 60.177 60.334 -0.157 19498
1531 1 5 . 1 1 27 27 ILE CB C 27 40.019 40.019 39.630 0.390 19498
1532 1 5 . 1 1 27 27 ILE H H 27 9.437 9.437 8.388 1.049 19498
1533 1 5 . 1 1 28 28 TYR N N 28 126.844 126.844 122.451 4.393 19498
1534 1 5 . 1 1 28 28 TYR HA H 28 5.709 5.709 5.641 0.068 19498
1535 1 5 . 1 1 28 28 TYR CA C 28 55.486 55.486 55.022 0.464 19498
1536 1 5 . 1 1 28 28 TYR CB C 28 42.019 42.019 40.746 1.273 19498
1537 1 5 . 1 1 28 28 TYR H H 28 8.531 8.531 8.174 0.357 19498
1538 1 5 . 1 1 29 29 ASP N N 29 122.875 122.875 123.011 -0.136 19498
1539 1 5 . 1 1 29 29 ASP HA H 29 4.966 4.966 4.600 0.366 19498
1540 1 5 . 1 1 29 29 ASP CA C 29 53.659 53.659 53.065 0.594 19498
1541 1 5 . 1 1 29 29 ASP CB C 29 44.660 44.660 43.448 1.212 19498
1542 1 5 . 1 1 29 29 ASP H H 29 8.614 8.614 8.721 -0.107 19498
1543 1 5 . 1 1 30 30 ASP N N 30 119.325 119.325 123.160 -3.835 19498
1544 1 5 . 1 1 30 30 ASP HA H 30 5.447 5.447 4.623 0.824 19498
1545 1 5 . 1 1 30 30 ASP CA C 30 53.501 53.501 53.579 -0.078 19498
1546 1 5 . 1 1 30 30 ASP CB C 30 43.921 43.921 41.977 1.944 19498
1547 1 5 . 1 1 30 30 ASP H H 30 8.607 8.607 8.236 0.371 19498
1548 1 5 . 1 1 31 31 TRP N N 31 120.552 120.552 119.779 0.773 19498
1549 1 5 . 1 1 31 31 TRP HA H 31 4.615 4.615 4.687 -0.072 19498
1550 1 5 . 1 1 31 31 TRP CA C 31 58.000 58.000 57.193 0.807 19498
1551 1 5 . 1 1 31 31 TRP CB C 31 31.500 31.500 27.764 3.736 19498
1552 1 5 . 1 1 31 31 TRP H H 31 8.673 8.673 8.085 0.588 19498
1553 1 5 . 1 1 32 32 TYR CA C 32 52.400 52.400 57.966 -5.566 19498
1554 1 5 . 1 1 32 32 TYR CB C 32 42.350 42.350 39.102 3.248 19498
1555 1 5 . 1 1 33 33 ASP CA C 33 52.400 52.400 54.915 -2.515 19498
1556 1 5 . 1 1 33 33 ASP CB C 33 42.350 42.350 40.909 1.441 19498
1557 1 5 . 1 1 34 34 ALA N N 34 126.709 126.709 125.954 0.755 19498
1558 1 5 . 1 1 34 34 ALA HA H 34 3.845 3.845 4.491 -0.646 19498
1559 1 5 . 1 1 34 34 ALA CA C 34 58.599 58.599 51.815 6.785 19498
1560 1 5 . 1 1 34 34 ALA CB C 34 18.610 18.610 19.895 -1.285 19498
1561 1 5 . 1 1 34 34 ALA H H 34 8.424 8.424 7.962 0.462 19498
1562 1 5 . 1 1 35 35 TYR N N 35 117.123 117.123 123.669 -6.546 19498
1563 1 5 . 1 1 35 35 TYR HA H 35 4.350 4.350 4.260 0.090 19498
1564 1 5 . 1 1 35 35 TYR CA C 35 60.466 60.466 60.891 -0.425 19498
1565 1 5 . 1 1 35 35 TYR CB C 35 38.113 38.113 38.623 -0.510 19498
1566 1 5 . 1 1 35 35 TYR H H 35 8.334 8.334 8.965 -0.631 19498
1567 1 5 . 1 1 36 36 THR N N 36 108.046 108.046 109.759 -1.713 19498
1568 1 5 . 1 1 36 36 THR HA H 36 4.018 4.018 4.219 -0.201 19498
1569 1 5 . 1 1 36 36 THR CA C 36 61.809 61.809 62.388 -0.579 19498
1570 1 5 . 1 1 36 36 THR CB C 36 69.926 69.926 68.966 0.960 19498
1571 1 5 . 1 1 36 36 THR H H 36 7.563 7.563 8.084 -0.521 19498
1572 1 5 . 1 1 37 37 ARG N N 37 118.456 118.456 121.869 -3.413 19498
1573 1 5 . 1 1 37 37 ARG CA C 37 57.001 57.001 54.779 2.222 19498
1574 1 5 . 1 1 37 37 ARG H H 37 7.952 7.952 7.529 0.423 19498
1575 1 5 . 1 1 40 40 CYS CA C 40 56.316 56.316 57.840 -1.524 19498
1576 1 5 . 1 1 40 40 CYS CB C 40 29.999 29.999 29.926 0.073 19498
1577 1 5 . 1 1 41 41 ILE N N 41 121.419 121.419 124.471 -3.052 19498
1578 1 5 . 1 1 41 41 ILE HA H 41 4.709 4.709 4.552 0.157 19498
1579 1 5 . 1 1 41 41 ILE CA C 41 60.462 60.462 60.934 -0.472 19498
1580 1 5 . 1 1 41 41 ILE CB C 41 42.309 42.309 42.270 0.039 19498
1581 1 5 . 1 1 41 41 ILE H H 41 8.459 8.459 9.105 -0.646 19498
1582 1 5 . 1 1 42 42 ARG N N 42 127.916 127.916 126.905 1.011 19498
1583 1 5 . 1 1 42 42 ARG CA C 42 54.501 54.501 54.373 0.128 19498
1584 1 5 . 1 1 42 42 ARG CB C 42 33.204 33.204 33.904 -0.700 19498
1585 1 5 . 1 1 42 42 ARG H H 42 9.004 9.004 9.046 -0.042 19498
1586 1 5 . 1 1 43 43 LEU N N 43 124.715 124.715 127.120 -2.405 19498
1587 1 5 . 1 1 43 43 LEU HA H 43 5.538 5.538 4.734 0.804 19498
1588 1 5 . 1 1 43 43 LEU CA C 43 53.266 53.266 54.207 -0.941 19498
1589 1 5 . 1 1 43 43 LEU CB C 43 46.163 46.163 42.735 3.428 19498
1590 1 5 . 1 1 43 43 LEU H H 43 8.757 8.757 8.743 0.014 19498
1591 1 5 . 1 1 44 44 ARG N N 44 123.499 123.499 125.731 -2.232 19498
1592 1 5 . 1 1 44 44 ARG HA H 44 5.004 5.004 4.751 0.253 19498
1593 1 5 . 1 1 44 44 ARG CA C 44 55.508 55.508 54.816 0.692 19498
1594 1 5 . 1 1 44 44 ARG CB C 44 34.543 34.543 32.748 1.795 19498
1595 1 5 . 1 1 44 44 ARG H H 44 9.366 9.366 8.738 0.628 19498
1596 1 5 . 1 1 45 45 ILE N N 45 122.919 122.919 126.757 -3.838 19498
1597 1 5 . 1 1 45 45 ILE HA H 45 5.260 5.260 4.607 0.653 19498
1598 1 5 . 1 1 45 45 ILE CA C 45 59.933 59.933 59.261 0.672 19498
1599 1 5 . 1 1 45 45 ILE CB C 45 39.751 39.751 38.443 1.308 19498
1600 1 5 . 1 1 45 45 ILE H H 45 8.938 8.938 8.196 0.742 19498
1601 1 5 . 1 1 46 46 GLU N N 46 126.745 126.745 126.939 -0.194 19498
1602 1 5 . 1 1 46 46 GLU HA H 46 5.465 5.465 4.878 0.587 19498
1603 1 5 . 1 1 46 46 GLU CA C 46 53.707 53.707 54.526 -0.820 19498
1604 1 5 . 1 1 46 46 GLU CB C 46 35.276 35.276 34.128 1.148 19498
1605 1 5 . 1 1 46 46 GLU H H 46 9.097 9.097 8.407 0.690 19498
1606 1 5 . 1 1 47 47 ASP N N 47 117.988 117.988 124.092 -6.104 19498
1607 1 5 . 1 1 47 47 ASP HA H 47 4.976 4.976 4.690 0.286 19498
1608 1 5 . 1 1 47 47 ASP CA C 47 52.411 52.411 53.543 -1.132 19498
1609 1 5 . 1 1 47 47 ASP CB C 47 41.609 41.609 43.068 -1.459 19498
1610 1 5 . 1 1 47 47 ASP H H 47 8.209 8.209 8.971 -0.762 19498
1611 1 5 . 1 1 48 48 ARG N N 48 117.098 117.098 123.462 -6.364 19498
1612 1 5 . 1 1 48 48 ARG HA H 48 4.129 4.129 4.106 0.023 19498
1613 1 5 . 1 1 48 48 ARG CA C 48 58.323 58.323 58.526 -0.203 19498
1614 1 5 . 1 1 48 48 ARG CB C 48 29.511 29.511 29.805 -0.294 19498
1615 1 5 . 1 1 48 48 ARG H H 48 8.872 8.872 8.646 0.226 19498
1616 1 5 . 1 1 49 49 SER N N 49 115.006 115.006 114.863 0.143 19498
1617 1 5 . 1 1 49 49 SER HA H 49 4.614 4.614 4.516 0.098 19498
1618 1 5 . 1 1 49 49 SER CA C 49 58.411 58.411 57.558 0.853 19498
1619 1 5 . 1 1 49 49 SER CB C 49 63.806 63.806 63.253 0.553 19498
1620 1 5 . 1 1 49 49 SER H H 49 8.142 8.142 8.659 -0.517 19498
1621 1 5 . 1 1 50 50 GLY N N 50 109.042 109.042 109.430 -0.388 19498
1622 1 5 . 1 1 50 50 GLY CA C 50 44.997 44.997 45.344 -0.347 19498
1623 1 5 . 1 1 50 50 GLY H H 50 8.035 8.035 7.782 0.253 19498
1624 1 5 . 1 1 51 51 ASN N N 51 119.842 119.842 118.055 1.787 19498
1625 1 5 . 1 1 51 51 ASN HA H 51 4.546 4.546 4.951 -0.405 19498
1626 1 5 . 1 1 51 51 ASN CA C 51 53.419 53.419 51.544 1.875 19498
1627 1 5 . 1 1 51 51 ASN CB C 51 38.422 38.422 40.672 -2.250 19498
1628 1 5 . 1 1 51 51 ASN H H 51 8.613 8.613 7.799 0.814 19498
1629 1 5 . 1 1 52 52 LEU N N 52 124.085 124.085 121.976 2.109 19498
1630 1 5 . 1 1 52 52 LEU HA H 52 4.142 4.142 4.675 -0.533 19498
1631 1 5 . 1 1 52 52 LEU CA C 52 56.023 56.023 55.876 0.147 19498
1632 1 5 . 1 1 52 52 LEU CB C 52 42.353 42.353 42.878 -0.525 19498
1633 1 5 . 1 1 52 52 LEU H H 52 8.631 8.631 8.627 0.004 19498
1634 1 5 . 1 1 53 53 ILE N N 53 129.362 129.362 120.840 8.522 19498
1635 1 5 . 1 1 53 53 ILE HA H 53 4.137 4.137 4.495 -0.358 19498
1636 1 5 . 1 1 53 53 ILE CA C 53 61.800 61.800 61.521 0.279 19498
1637 1 5 . 1 1 53 53 ILE CB C 53 37.256 37.256 39.176 -1.920 19498
1638 1 5 . 1 1 53 53 ILE H H 53 9.432 9.432 8.589 0.843 19498
1639 1 5 . 1 1 54 54 ASP N N 54 113.575 113.575 118.279 -4.704 19498
1640 1 5 . 1 1 54 54 ASP HA H 54 4.847 4.847 4.902 -0.055 19498
1641 1 5 . 1 1 54 54 ASP CA C 54 53.586 53.586 54.247 -0.661 19498
1642 1 5 . 1 1 54 54 ASP CB C 54 44.500 44.500 43.351 1.149 19498
1643 1 5 . 1 1 54 54 ASP H H 54 7.761 7.761 7.704 0.057 19498
1644 1 5 . 1 1 55 55 THR N N 55 115.783 115.783 112.252 3.531 19498
1645 1 5 . 1 1 55 55 THR HA H 55 5.427 5.427 5.064 0.363 19498
1646 1 5 . 1 1 55 55 THR CA C 55 59.185 59.185 61.017 -1.832 19498
1647 1 5 . 1 1 55 55 THR CB C 55 70.551 70.551 71.884 -1.333 19498
1648 1 5 . 1 1 55 55 THR H H 55 10.106 10.106 8.282 1.824 19498
1649 1 5 . 1 1 56 56 SER N N 56 119.808 119.808 117.345 2.463 19498
1650 1 5 . 1 1 56 56 SER HA H 56 4.135 4.135 4.496 -0.361 19498
1651 1 5 . 1 1 56 56 SER CA C 56 58.001 58.001 57.687 0.314 19498
1652 1 5 . 1 1 56 56 SER CB C 56 65.039 65.039 66.285 -1.246 19498
1653 1 5 . 1 1 56 56 SER H H 56 7.872 7.872 8.446 -0.574 19498
1654 1 5 . 1 1 57 57 THR N N 57 117.962 117.962 118.383 -0.421 19498
1655 1 5 . 1 1 57 57 THR HA H 57 4.964 4.964 4.448 0.516 19498
1656 1 5 . 1 1 57 57 THR CA C 57 61.001 61.001 61.859 -0.858 19498
1657 1 5 . 1 1 57 57 THR CB C 57 70.881 70.881 70.089 0.792 19498
1658 1 5 . 1 1 57 57 THR H H 57 7.524 7.524 7.908 -0.384 19498
1659 1 5 . 1 1 58 58 PHE N N 58 123.853 123.853 127.014 -3.161 19498
1660 1 5 . 1 1 58 58 PHE HA H 58 4.603 4.603 4.865 -0.262 19498
1661 1 5 . 1 1 58 58 PHE CA C 58 56.648 56.648 57.355 -0.707 19498
1662 1 5 . 1 1 58 58 PHE CB C 58 43.583 43.583 41.657 1.926 19498
1663 1 5 . 1 1 58 58 PHE H H 58 8.861 8.861 9.034 -0.173 19498
1664 1 5 . 1 1 59 59 TYR N N 59 117.898 117.898 120.853 -2.955 19498
1665 1 5 . 1 1 59 59 TYR HA H 59 5.328 5.328 4.858 0.470 19498
1666 1 5 . 1 1 59 59 TYR CA C 59 56.221 56.221 56.026 0.195 19498
1667 1 5 . 1 1 59 59 TYR CB C 59 42.106 42.106 39.153 2.953 19498
1668 1 5 . 1 1 59 59 TYR H H 59 8.328 8.328 8.513 -0.185 19498
1669 1 5 . 1 1 60 60 HIS CA C 60 60.065 60.065 55.496 4.569 19498
1670 1 5 . 1 1 60 60 HIS CB C 60 34.284 34.284 32.156 2.128 19498
1671 1 5 . 1 1 61 61 HIS N N 61 121.880 121.880 123.462 -1.582 19498
1672 1 5 . 1 1 61 61 HIS CA C 61 58.001 58.001 56.273 1.728 19498
1673 1 5 . 1 1 61 61 HIS CB C 61 29.999 29.999 28.661 1.338 19498
1674 1 5 . 1 1 61 61 HIS H H 61 7.734 7.734 8.700 -0.966 19498
1675 1 5 . 1 1 62 62 ASP N N 62 128.148 128.148 126.983 1.165 19498
1676 1 5 . 1 1 62 62 ASP HA H 62 4.870 4.870 4.719 0.151 19498
1677 1 5 . 1 1 62 62 ASP CA C 62 53.348 53.348 53.343 0.005 19498
1678 1 5 . 1 1 62 62 ASP CB C 62 42.600 42.600 42.422 0.178 19498
1679 1 5 . 1 1 62 62 ASP H H 62 11.492 11.492 7.761 3.731 19498
1680 1 5 . 1 1 63 63 GLU N N 63 126.564 126.564 127.194 -0.630 19498
1681 1 5 . 1 1 63 63 GLU HA H 63 3.795 3.795 3.867 -0.072 19498
1682 1 5 . 1 1 63 63 GLU CA C 63 59.863 59.863 59.728 0.135 19498
1683 1 5 . 1 1 63 63 GLU CB C 63 34.007 34.007 29.331 4.676 19498
1684 1 5 . 1 1 63 63 GLU H H 63 8.982 8.982 8.760 0.222 19498
1685 1 5 . 1 1 64 64 ASP N N 64 117.779 117.779 119.479 -1.700 19498
1686 1 5 . 1 1 64 64 ASP HA H 64 4.401 4.401 4.596 -0.195 19498
1687 1 5 . 1 1 64 64 ASP CA C 64 57.664 57.664 56.630 1.034 19498
1688 1 5 . 1 1 64 64 ASP CB C 64 40.369 40.369 40.687 -0.318 19498
1689 1 5 . 1 1 64 64 ASP H H 64 8.272 8.272 7.797 0.475 19498
1690 1 5 . 1 1 65 65 VAL N N 65 121.948 121.948 120.851 1.097 19498
1691 1 5 . 1 1 65 65 VAL HA H 65 3.386 3.386 3.748 -0.362 19498
1692 1 5 . 1 1 65 65 VAL CA C 65 65.913 65.913 65.989 -0.076 19498
1693 1 5 . 1 1 65 65 VAL CB C 65 31.465 31.465 31.447 0.018 19498
1694 1 5 . 1 1 65 65 VAL H H 65 7.335 7.335 8.651 -1.316 19498
1695 1 5 . 1 1 66 66 LEU N N 66 120.747 120.747 120.598 0.149 19498
1696 1 5 . 1 1 66 66 LEU HA H 66 3.905 3.905 3.695 0.210 19498
1697 1 5 . 1 1 66 66 LEU CA C 66 58.076 58.076 58.203 -0.127 19498
1698 1 5 . 1 1 66 66 LEU CB C 66 42.160 42.160 41.305 0.855 19498
1699 1 5 . 1 1 66 66 LEU H H 66 8.164 8.164 7.764 0.400 19498
1700 1 5 . 1 1 67 67 PHE N N 67 116.553 116.553 116.699 -0.146 19498
1701 1 5 . 1 1 67 67 PHE HA H 67 3.900 3.900 4.206 -0.306 19498
1702 1 5 . 1 1 67 67 PHE CA C 67 62.849 62.849 61.656 1.194 19498
1703 1 5 . 1 1 67 67 PHE CB C 67 38.003 38.003 38.082 -0.079 19498
1704 1 5 . 1 1 67 67 PHE H H 67 8.350 8.350 7.485 0.865 19498
1705 1 5 . 1 1 68 68 ASN N N 68 121.020 121.020 119.024 1.996 19498
1706 1 5 . 1 1 68 68 ASN HA H 68 4.415 4.415 4.410 0.005 19498
1707 1 5 . 1 1 68 68 ASN CA C 68 56.725 56.725 56.651 0.073 19498
1708 1 5 . 1 1 68 68 ASN CB C 68 38.071 38.071 38.693 -0.622 19498
1709 1 5 . 1 1 68 68 ASN H H 68 8.001 8.001 7.829 0.172 19498
1710 1 5 . 1 1 69 69 MET N N 69 120.402 120.402 118.698 1.704 19498
1711 1 5 . 1 1 69 69 MET HA H 69 4.011 4.011 4.095 -0.084 19498
1712 1 5 . 1 1 69 69 MET CA C 69 59.605 59.605 59.344 0.261 19498
1713 1 5 . 1 1 69 69 MET CB C 69 31.867 31.867 32.267 -0.400 19498
1714 1 5 . 1 1 69 69 MET H H 69 8.465 8.465 7.856 0.609 19498
1715 1 5 . 1 1 70 70 CYS N N 70 117.496 117.496 117.338 0.158 19498
1716 1 5 . 1 1 70 70 CYS CA C 70 63.145 63.145 63.768 -0.623 19498
1717 1 5 . 1 1 70 70 CYS CB C 70 27.510 27.510 26.916 0.594 19498
1718 1 5 . 1 1 70 70 CYS H H 70 7.616 7.616 7.673 -0.057 19498
1719 1 5 . 1 1 71 71 THR N N 71 118.640 118.640 115.054 3.586 19498
1720 1 5 . 1 1 71 71 THR HA H 71 4.270 4.270 4.079 0.191 19498
1721 1 5 . 1 1 71 71 THR CA C 71 67.980 67.980 66.097 1.883 19498
1722 1 5 . 1 1 71 71 THR CB C 71 67.949 67.949 68.567 -0.618 19498
1723 1 5 . 1 1 71 71 THR H H 71 8.509 8.509 7.955 0.554 19498
1724 1 5 . 1 1 72 72 ASP HA H 72 4.430 4.430 4.468 -0.038 19498
1725 1 5 . 1 1 72 72 ASP CA C 72 57.590 57.590 57.374 0.216 19498
1726 1 5 . 1 1 72 72 ASP CB C 72 40.415 40.415 40.767 -0.352 19498
1727 1 5 . 1 1 73 73 TRP N N 73 121.657 121.657 121.092 0.565 19498
1728 1 5 . 1 1 73 73 TRP HA H 73 4.407 4.407 4.397 0.010 19498
1729 1 5 . 1 1 73 73 TRP CA C 73 62.951 62.951 61.694 1.257 19498
1730 1 5 . 1 1 73 73 TRP CB C 73 29.114 29.114 29.790 -0.676 19498
1731 1 5 . 1 1 73 73 TRP H H 73 7.780 7.780 7.591 0.189 19498
1732 1 5 . 1 1 74 74 LEU N N 74 118.727 118.727 118.519 0.208 19498
1733 1 5 . 1 1 74 74 LEU HA H 74 3.582 3.582 3.545 0.037 19498
1734 1 5 . 1 1 74 74 LEU CA C 74 58.184 58.184 57.582 0.602 19498
1735 1 5 . 1 1 74 74 LEU CB C 74 37.610 37.610 41.323 -3.713 19498
1736 1 5 . 1 1 74 74 LEU H H 74 8.490 8.490 7.547 0.943 19498
1737 1 5 . 1 1 75 75 ASN N N 75 117.962 117.962 117.579 0.383 19498
1738 1 5 . 1 1 75 75 ASN HA H 75 4.527 4.527 4.560 -0.033 19498
1739 1 5 . 1 1 75 75 ASN CA C 75 56.501 56.501 55.792 0.709 19498
1740 1 5 . 1 1 75 75 ASN CB C 75 37.999 37.999 38.458 -0.459 19498
1741 1 5 . 1 1 75 75 ASN H H 75 8.639 8.639 7.829 0.810 19498
1742 1 5 . 1 1 76 76 HIS N N 76 120.823 120.823 119.780 1.043 19498
1743 1 5 . 1 1 76 76 HIS HA H 76 4.450 4.450 4.162 0.288 19498
1744 1 5 . 1 1 76 76 HIS CA C 76 58.737 58.737 59.148 -0.411 19498
1745 1 5 . 1 1 76 76 HIS CB C 76 28.007 28.007 29.641 -1.634 19498
1746 1 5 . 1 1 76 76 HIS H H 76 8.158 8.158 7.514 0.644 19498
1747 1 5 . 1 1 77 77 MET N N 77 118.749 118.749 115.592 3.157 19498
1748 1 5 . 1 1 77 77 MET HA H 77 4.071 4.071 3.798 0.273 19498
1749 1 5 . 1 1 77 77 MET CA C 77 55.827 55.827 57.294 -1.467 19498
1750 1 5 . 1 1 77 77 MET CB C 77 29.541 29.541 31.951 -2.410 19498
1751 1 5 . 1 1 77 77 MET H H 77 8.404 8.404 6.979 1.425 19498
1752 1 5 . 1 1 78 78 TYR N N 78 120.762 120.762 119.710 1.052 19498
1753 1 5 . 1 1 78 78 TYR HA H 78 3.662 3.662 4.020 -0.358 19498
1754 1 5 . 1 1 78 78 TYR CA C 78 62.640 62.640 60.324 2.316 19498
1755 1 5 . 1 1 78 78 TYR CB C 78 37.545 37.545 37.661 -0.116 19498
1756 1 5 . 1 1 78 78 TYR H H 78 8.322 8.322 7.235 1.087 19498
1757 1 5 . 1 1 79 79 ASP N N 79 116.578 116.578 116.997 -0.419 19498
1758 1 5 . 1 1 79 79 ASP HA H 79 4.106 4.106 4.394 -0.288 19498
1759 1 5 . 1 1 79 79 ASP CA C 79 57.410 57.410 56.788 0.622 19498
1760 1 5 . 1 1 79 79 ASP CB C 79 40.503 40.503 41.124 -0.621 19498
1761 1 5 . 1 1 79 79 ASP H H 79 7.460 7.460 7.963 -0.503 19498
1762 1 5 . 1 1 80 80 GLN N N 80 116.175 116.175 120.072 -3.897 19498
1763 1 5 . 1 1 80 80 GLN HA H 80 4.056 4.056 4.035 0.021 19498
1764 1 5 . 1 1 80 80 GLN CA C 80 57.629 57.629 58.432 -0.803 19498
1765 1 5 . 1 1 80 80 GLN CB C 80 29.662 29.662 28.804 0.858 19498
1766 1 5 . 1 1 80 80 GLN H H 80 7.552 7.552 7.878 -0.326 19498
1767 1 5 . 1 1 81 81 LEU N N 81 118.398 118.398 116.027 2.371 19498
1768 1 5 . 1 1 81 81 LEU HA H 81 4.233 4.233 4.347 -0.114 19498
1769 1 5 . 1 1 81 81 LEU CA C 81 55.461 55.461 55.280 0.181 19498
1770 1 5 . 1 1 81 81 LEU CB C 81 42.406 42.406 41.625 0.781 19498
1771 1 5 . 1 1 81 81 LEU H H 81 7.957 7.957 7.606 0.351 19498
1772 1 5 . 1 1 82 82 LYS N N 82 119.114 119.114 117.548 1.566 19498
1773 1 5 . 1 1 82 82 LYS HA H 82 3.841 3.841 4.425 -0.584 19498
1774 1 5 . 1 1 82 82 LYS CA C 82 58.510 58.510 57.435 1.075 19498
1775 1 5 . 1 1 82 82 LYS CB C 82 30.922 30.922 32.620 -1.698 19498
1776 1 5 . 1 1 82 82 LYS H H 82 7.664 7.664 7.323 0.341 19498
1777 1 5 . 1 1 83 83 ASP N N 83 118.655 118.655 119.399 -0.744 19498
1778 1 5 . 1 1 83 83 ASP HA H 83 4.819 4.819 4.264 0.555 19498
1779 1 5 . 1 1 83 83 ASP CA C 83 53.886 53.886 56.505 -2.619 19498
1780 1 5 . 1 1 83 83 ASP CB C 83 40.986 40.986 41.014 -0.028 19498
1781 1 5 . 1 1 83 83 ASP H H 83 7.862 7.862 7.562 0.300 19498
1782 1 5 . 1 1 84 84 TRP N N 84 121.757 121.757 120.731 1.026 19498
1783 1 5 . 1 1 84 84 TRP CA C 84 58.462 58.462 56.398 2.064 19498
1784 1 5 . 1 1 84 84 TRP CB C 84 28.934 28.934 29.176 -0.242 19498
1785 1 5 . 1 1 84 84 TRP H H 84 7.925 7.925 8.049 -0.124 19498
1786 1 6 . 1 1 6 6 SER CA C 6 56.008 56.008 58.120 -2.112 19498
1787 1 6 . 1 1 7 7 GLY N N 7 109.496 109.496 108.804 0.692 19498
1788 1 6 . 1 1 7 7 GLY CA C 7 46.042 46.042 44.894 1.148 19498
1789 1 6 . 1 1 7 7 GLY H H 7 8.432 8.432 8.155 0.277 19498
1790 1 6 . 1 1 8 8 ASN N N 8 119.432 119.432 115.477 3.955 19498
1791 1 6 . 1 1 8 8 ASN HA H 8 4.685 4.685 4.497 0.188 19498
1792 1 6 . 1 1 8 8 ASN CA C 8 53.922 53.922 53.721 0.201 19498
1793 1 6 . 1 1 8 8 ASN CB C 8 37.970 37.970 37.646 0.324 19498
1794 1 6 . 1 1 8 8 ASN H H 8 8.367 8.367 8.330 0.037 19498
1795 1 6 . 1 1 9 9 LEU N N 9 123.537 123.537 118.683 4.854 19498
1796 1 6 . 1 1 9 9 LEU HA H 9 3.984 3.984 4.139 -0.155 19498
1797 1 6 . 1 1 9 9 LEU CA C 9 56.417 56.417 54.722 1.695 19498
1798 1 6 . 1 1 9 9 LEU CB C 9 41.566 41.566 41.157 0.409 19498
1799 1 6 . 1 1 9 9 LEU H H 9 7.922 7.922 7.668 0.254 19498
1800 1 6 . 1 1 10 10 ALA N N 10 122.287 122.287 124.011 -1.724 19498
1801 1 6 . 1 1 10 10 ALA HA H 10 4.127 4.127 3.997 0.130 19498
1802 1 6 . 1 1 10 10 ALA CA C 10 55.912 55.912 55.243 0.669 19498
1803 1 6 . 1 1 10 10 ALA CB C 10 17.998 17.998 18.165 -0.167 19498
1804 1 6 . 1 1 10 10 ALA H H 10 8.064 8.064 8.082 -0.018 19498
1805 1 6 . 1 1 11 11 ALA N N 11 121.326 121.326 119.535 1.791 19498
1806 1 6 . 1 1 11 11 ALA HA H 11 4.207 4.207 4.220 -0.013 19498
1807 1 6 . 1 1 11 11 ALA CA C 11 54.960 54.960 53.682 1.278 19498
1808 1 6 . 1 1 11 11 ALA CB C 11 17.998 17.998 18.477 -0.479 19498
1809 1 6 . 1 1 11 11 ALA H H 11 8.143 8.143 8.199 -0.056 19498
1810 1 6 . 1 1 12 12 PHE N N 12 122.913 122.913 119.740 3.173 19498
1811 1 6 . 1 1 12 12 PHE HA H 12 4.411 4.411 4.127 0.284 19498
1812 1 6 . 1 1 12 12 PHE CA C 12 61.007 61.007 60.781 0.226 19498
1813 1 6 . 1 1 12 12 PHE CB C 12 39.499 39.499 39.200 0.299 19498
1814 1 6 . 1 1 12 12 PHE H H 12 7.779 7.779 8.197 -0.418 19498
1815 1 6 . 1 1 13 13 LYS N N 13 120.689 120.689 118.619 2.070 19498
1816 1 6 . 1 1 13 13 LYS HA H 13 3.861 3.861 4.069 -0.208 19498
1817 1 6 . 1 1 13 13 LYS CA C 13 59.099 59.099 58.415 0.684 19498
1818 1 6 . 1 1 13 13 LYS CB C 13 31.867 31.867 31.508 0.359 19498
1819 1 6 . 1 1 13 13 LYS H H 13 8.614 8.614 8.632 -0.018 19498
1820 1 6 . 1 1 14 14 ALA N N 14 122.076 122.076 120.896 1.180 19498
1821 1 6 . 1 1 14 14 ALA HA H 14 3.182 3.182 4.091 -0.909 19498
1822 1 6 . 1 1 14 14 ALA CA C 14 55.108 55.108 54.575 0.533 19498
1823 1 6 . 1 1 14 14 ALA CB C 14 18.120 18.120 17.940 0.180 19498
1824 1 6 . 1 1 14 14 ALA H H 14 8.178 8.178 7.772 0.406 19498
1825 1 6 . 1 1 15 15 ALA N N 15 121.714 121.714 119.780 1.934 19498
1826 1 6 . 1 1 15 15 ALA HA H 15 4.040 4.040 3.980 0.060 19498
1827 1 6 . 1 1 15 15 ALA CA C 15 55.158 55.158 54.424 0.734 19498
1828 1 6 . 1 1 15 15 ALA CB C 15 19.042 19.042 18.060 0.982 19498
1829 1 6 . 1 1 15 15 ALA H H 15 7.793 7.793 7.464 0.329 19498
1830 1 6 . 1 1 16 16 THR N N 16 111.959 111.959 114.582 -2.623 19498
1831 1 6 . 1 1 16 16 THR HA H 16 3.705 3.705 3.839 -0.134 19498
1832 1 6 . 1 1 16 16 THR CA C 16 66.762 66.762 67.041 -0.279 19498
1833 1 6 . 1 1 16 16 THR CB C 16 68.213 68.213 68.531 -0.318 19498
1834 1 6 . 1 1 16 16 THR H H 16 8.133 8.133 7.961 0.172 19498
1835 1 6 . 1 1 17 17 ASN N N 17 121.090 121.090 118.958 2.132 19498
1836 1 6 . 1 1 17 17 ASN HA H 17 4.520 4.520 4.485 0.035 19498
1837 1 6 . 1 1 17 17 ASN CA C 17 56.191 56.191 56.107 0.084 19498
1838 1 6 . 1 1 17 17 ASN CB C 17 38.365 38.365 38.835 -0.470 19498
1839 1 6 . 1 1 17 17 ASN H H 17 8.152 8.152 7.791 0.361 19498
1840 1 6 . 1 1 18 18 LYS N N 18 119.978 119.978 118.541 1.437 19498
1841 1 6 . 1 1 18 18 LYS HA H 18 3.914 3.914 3.954 -0.040 19498
1842 1 6 . 1 1 18 18 LYS CA C 18 59.865 59.865 58.739 1.126 19498
1843 1 6 . 1 1 18 18 LYS CB C 18 30.999 30.999 31.901 -0.902 19498
1844 1 6 . 1 1 18 18 LYS H H 18 7.568 7.568 7.454 0.114 19498
1845 1 6 . 1 1 19 19 LEU N N 19 117.558 117.558 118.721 -1.163 19498
1846 1 6 . 1 1 19 19 LEU HA H 19 4.135 4.135 4.271 -0.136 19498
1847 1 6 . 1 1 19 19 LEU CA C 19 58.001 58.001 57.349 0.652 19498
1848 1 6 . 1 1 19 19 LEU CB C 19 40.823 40.823 42.043 -1.220 19498
1849 1 6 . 1 1 19 19 LEU H H 19 7.001 7.001 7.472 -0.471 19498
1850 1 6 . 1 1 20 20 PHE N N 20 121.123 121.123 118.537 2.586 19498
1851 1 6 . 1 1 20 20 PHE HA H 20 4.873 4.873 4.220 0.653 19498
1852 1 6 . 1 1 20 20 PHE CA C 20 60.375 60.375 60.789 -0.414 19498
1853 1 6 . 1 1 20 20 PHE CB C 20 38.480 38.480 38.950 -0.470 19498
1854 1 6 . 1 1 20 20 PHE H H 20 8.193 8.193 7.865 0.328 19498
1855 1 6 . 1 1 21 21 GLN N N 21 118.591 118.591 117.925 0.666 19498
1856 1 6 . 1 1 21 21 GLN HA H 21 4.208 4.208 3.926 0.282 19498
1857 1 6 . 1 1 21 21 GLN CA C 21 58.055 58.055 58.370 -0.314 19498
1858 1 6 . 1 1 21 21 GLN CB C 21 28.284 28.284 28.719 -0.435 19498
1859 1 6 . 1 1 21 21 GLN H H 21 7.918 7.918 7.738 0.180 19498
1860 1 6 . 1 1 22 22 LEU N N 22 118.477 118.477 118.265 0.212 19498
1861 1 6 . 1 1 22 22 LEU HA H 22 4.534 4.534 4.454 0.080 19498
1862 1 6 . 1 1 22 22 LEU CA C 22 54.033 54.033 54.056 -0.022 19498
1863 1 6 . 1 1 22 22 LEU CB C 22 41.469 41.469 42.602 -1.133 19498
1864 1 6 . 1 1 22 22 LEU H H 22 7.561 7.561 7.649 -0.088 19498
1865 1 6 . 1 1 23 23 ASP N N 23 115.410 115.410 118.627 -3.217 19498
1866 1 6 . 1 1 23 23 ASP HA H 23 4.280 4.280 4.092 0.188 19498
1867 1 6 . 1 1 23 23 ASP CA C 23 55.494 55.494 55.362 0.132 19498
1868 1 6 . 1 1 23 23 ASP CB C 23 39.317 39.317 39.448 -0.131 19498
1869 1 6 . 1 1 23 23 ASP H H 23 8.163 8.163 7.573 0.590 19498
1870 1 6 . 1 1 24 24 LEU N N 24 116.367 116.367 115.210 1.157 19498
1871 1 6 . 1 1 24 24 LEU HA H 24 4.790 4.790 4.819 -0.029 19498
1872 1 6 . 1 1 24 24 LEU CA C 24 53.030 53.030 53.450 -0.420 19498
1873 1 6 . 1 1 24 24 LEU CB C 24 43.867 43.867 44.165 -0.298 19498
1874 1 6 . 1 1 24 24 LEU H H 24 7.136 7.136 7.796 -0.660 19498
1875 1 6 . 1 1 25 25 ALA N N 25 123.243 123.243 120.623 2.620 19498
1876 1 6 . 1 1 25 25 ALA HA H 25 4.480 4.480 4.715 -0.235 19498
1877 1 6 . 1 1 25 25 ALA CA C 25 50.890 50.890 51.660 -0.770 19498
1878 1 6 . 1 1 25 25 ALA CB C 25 21.655 21.655 21.708 -0.053 19498
1879 1 6 . 1 1 25 25 ALA H H 25 8.931 8.931 8.314 0.617 19498
1880 1 6 . 1 1 26 26 VAL N N 26 119.587 119.587 119.259 0.328 19498
1881 1 6 . 1 1 26 26 VAL HA H 26 4.889 4.889 4.587 0.302 19498
1882 1 6 . 1 1 26 26 VAL CA C 26 61.278 61.278 61.635 -0.357 19498
1883 1 6 . 1 1 26 26 VAL CB C 26 33.310 33.310 35.267 -1.957 19498
1884 1 6 . 1 1 26 26 VAL H H 26 7.575 7.575 8.283 -0.708 19498
1885 1 6 . 1 1 27 27 ILE N N 27 130.377 130.377 124.627 5.750 19498
1886 1 6 . 1 1 27 27 ILE HA H 27 4.489 4.489 4.859 -0.370 19498
1887 1 6 . 1 1 27 27 ILE CA C 27 60.177 60.177 60.437 -0.260 19498
1888 1 6 . 1 1 27 27 ILE CB C 27 40.019 40.019 40.816 -0.798 19498
1889 1 6 . 1 1 27 27 ILE H H 27 9.437 9.437 8.478 0.959 19498
1890 1 6 . 1 1 28 28 TYR N N 28 126.844 126.844 120.965 5.879 19498
1891 1 6 . 1 1 28 28 TYR HA H 28 5.709 5.709 5.641 0.068 19498
1892 1 6 . 1 1 28 28 TYR CA C 28 55.486 55.486 55.025 0.461 19498
1893 1 6 . 1 1 28 28 TYR CB C 28 42.019 42.019 41.288 0.731 19498
1894 1 6 . 1 1 28 28 TYR H H 28 8.531 8.531 8.238 0.293 19498
1895 1 6 . 1 1 29 29 ASP N N 29 122.875 122.875 122.610 0.265 19498
1896 1 6 . 1 1 29 29 ASP HA H 29 4.966 4.966 4.893 0.073 19498
1897 1 6 . 1 1 29 29 ASP CA C 29 53.659 53.659 53.887 -0.228 19498
1898 1 6 . 1 1 29 29 ASP CB C 29 44.660 44.660 43.633 1.027 19498
1899 1 6 . 1 1 29 29 ASP H H 29 8.614 8.614 8.737 -0.123 19498
1900 1 6 . 1 1 30 30 ASP N N 30 119.325 119.325 120.721 -1.396 19498
1901 1 6 . 1 1 30 30 ASP HA H 30 5.447 5.447 4.987 0.460 19498
1902 1 6 . 1 1 30 30 ASP CA C 30 53.501 53.501 53.480 0.021 19498
1903 1 6 . 1 1 30 30 ASP CB C 30 43.921 43.921 42.415 1.506 19498
1904 1 6 . 1 1 30 30 ASP H H 30 8.607 8.607 8.674 -0.067 19498
1905 1 6 . 1 1 31 31 TRP N N 31 120.552 120.552 126.026 -5.474 19498
1906 1 6 . 1 1 31 31 TRP HA H 31 4.615 4.615 4.232 0.383 19498
1907 1 6 . 1 1 31 31 TRP CA C 31 58.000 58.000 58.495 -0.494 19498
1908 1 6 . 1 1 31 31 TRP CB C 31 31.500 31.500 27.639 3.861 19498
1909 1 6 . 1 1 31 31 TRP H H 31 8.673 8.673 8.949 -0.276 19498
1910 1 6 . 1 1 32 32 TYR CA C 32 52.400 52.400 58.938 -6.538 19498
1911 1 6 . 1 1 32 32 TYR CB C 32 42.350 42.350 39.119 3.231 19498
1912 1 6 . 1 1 33 33 ASP CA C 33 52.400 52.400 54.221 -1.821 19498
1913 1 6 . 1 1 33 33 ASP CB C 33 42.350 42.350 40.576 1.774 19498
1914 1 6 . 1 1 34 34 ALA N N 34 126.709 126.709 122.261 4.448 19498
1915 1 6 . 1 1 34 34 ALA HA H 34 3.845 3.845 4.726 -0.881 19498
1916 1 6 . 1 1 34 34 ALA CA C 34 58.599 58.599 51.430 7.169 19498
1917 1 6 . 1 1 34 34 ALA CB C 34 18.610 18.610 20.879 -2.269 19498
1918 1 6 . 1 1 34 34 ALA H H 34 8.424 8.424 7.469 0.955 19498
1919 1 6 . 1 1 35 35 TYR N N 35 117.123 117.123 115.121 2.002 19498
1920 1 6 . 1 1 35 35 TYR HA H 35 4.350 4.350 4.617 -0.267 19498
1921 1 6 . 1 1 35 35 TYR CA C 35 60.466 60.466 58.798 1.668 19498
1922 1 6 . 1 1 35 35 TYR CB C 35 38.113 38.113 38.489 -0.376 19498
1923 1 6 . 1 1 35 35 TYR H H 35 8.334 8.334 8.406 -0.072 19498
1924 1 6 . 1 1 36 36 THR N N 36 108.046 108.046 117.534 -9.488 19498
1925 1 6 . 1 1 36 36 THR HA H 36 4.018 4.018 4.122 -0.104 19498
1926 1 6 . 1 1 36 36 THR CA C 36 61.809 61.809 60.778 1.031 19498
1927 1 6 . 1 1 36 36 THR CB C 36 69.926 69.926 67.252 2.674 19498
1928 1 6 . 1 1 36 36 THR H H 36 7.563 7.563 8.059 -0.496 19498
1929 1 6 . 1 1 37 37 ARG N N 37 118.456 118.456 121.724 -3.268 19498
1930 1 6 . 1 1 37 37 ARG CA C 37 57.001 57.001 58.464 -1.463 19498
1931 1 6 . 1 1 37 37 ARG H H 37 7.952 7.952 7.768 0.184 19498
1932 1 6 . 1 1 40 40 CYS CA C 40 56.316 56.316 56.763 -0.447 19498
1933 1 6 . 1 1 40 40 CYS CB C 40 29.999 29.999 30.161 -0.162 19498
1934 1 6 . 1 1 41 41 ILE N N 41 121.419 121.419 122.644 -1.225 19498
1935 1 6 . 1 1 41 41 ILE HA H 41 4.709 4.709 4.992 -0.283 19498
1936 1 6 . 1 1 41 41 ILE CA C 41 60.462 60.462 60.528 -0.066 19498
1937 1 6 . 1 1 41 41 ILE CB C 41 42.309 42.309 41.974 0.335 19498
1938 1 6 . 1 1 41 41 ILE H H 41 8.459 8.459 8.237 0.222 19498
1939 1 6 . 1 1 42 42 ARG N N 42 127.916 127.916 126.620 1.296 19498
1940 1 6 . 1 1 42 42 ARG CA C 42 54.501 54.501 54.326 0.175 19498
1941 1 6 . 1 1 42 42 ARG CB C 42 33.204 33.204 34.585 -1.381 19498
1942 1 6 . 1 1 42 42 ARG H H 42 9.004 9.004 8.945 0.059 19498
1943 1 6 . 1 1 43 43 LEU N N 43 124.715 124.715 126.648 -1.933 19498
1944 1 6 . 1 1 43 43 LEU HA H 43 5.538 5.538 4.948 0.590 19498
1945 1 6 . 1 1 43 43 LEU CA C 43 53.266 53.266 54.409 -1.143 19498
1946 1 6 . 1 1 43 43 LEU CB C 43 46.163 46.163 43.609 2.554 19498
1947 1 6 . 1 1 43 43 LEU H H 43 8.757 8.757 9.241 -0.484 19498
1948 1 6 . 1 1 44 44 ARG N N 44 123.499 123.499 126.090 -2.591 19498
1949 1 6 . 1 1 44 44 ARG HA H 44 5.004 5.004 4.868 0.136 19498
1950 1 6 . 1 1 44 44 ARG CA C 44 55.508 55.508 54.862 0.646 19498
1951 1 6 . 1 1 44 44 ARG CB C 44 34.543 34.543 33.049 1.494 19498
1952 1 6 . 1 1 44 44 ARG H H 44 9.366 9.366 9.448 -0.082 19498
1953 1 6 . 1 1 45 45 ILE N N 45 122.919 122.919 127.920 -5.001 19498
1954 1 6 . 1 1 45 45 ILE HA H 45 5.260 5.260 4.546 0.714 19498
1955 1 6 . 1 1 45 45 ILE CA C 45 59.933 59.933 58.951 0.982 19498
1956 1 6 . 1 1 45 45 ILE CB C 45 39.751 39.751 39.272 0.479 19498
1957 1 6 . 1 1 45 45 ILE H H 45 8.938 8.938 8.822 0.116 19498
1958 1 6 . 1 1 46 46 GLU N N 46 126.745 126.745 125.258 1.487 19498
1959 1 6 . 1 1 46 46 GLU HA H 46 5.465 5.465 4.806 0.659 19498
1960 1 6 . 1 1 46 46 GLU CA C 46 53.707 53.707 54.389 -0.682 19498
1961 1 6 . 1 1 46 46 GLU CB C 46 35.276 35.276 33.062 2.214 19498
1962 1 6 . 1 1 46 46 GLU H H 46 9.097 9.097 8.624 0.473 19498
1963 1 6 . 1 1 47 47 ASP N N 47 117.988 117.988 121.415 -3.427 19498
1964 1 6 . 1 1 47 47 ASP HA H 47 4.976 4.976 4.817 0.159 19498
1965 1 6 . 1 1 47 47 ASP CA C 47 52.411 52.411 52.880 -0.469 19498
1966 1 6 . 1 1 47 47 ASP CB C 47 41.609 41.609 43.702 -2.093 19498
1967 1 6 . 1 1 47 47 ASP H H 47 8.209 8.209 8.844 -0.635 19498
1968 1 6 . 1 1 48 48 ARG N N 48 117.098 117.098 121.375 -4.277 19498
1969 1 6 . 1 1 48 48 ARG HA H 48 4.129 4.129 4.312 -0.183 19498
1970 1 6 . 1 1 48 48 ARG CA C 48 58.323 58.323 57.308 1.015 19498
1971 1 6 . 1 1 48 48 ARG CB C 48 29.511 29.511 29.468 0.043 19498
1972 1 6 . 1 1 48 48 ARG H H 48 8.872 8.872 8.840 0.032 19498
1973 1 6 . 1 1 49 49 SER N N 49 115.006 115.006 114.436 0.570 19498
1974 1 6 . 1 1 49 49 SER HA H 49 4.614 4.614 4.593 0.021 19498
1975 1 6 . 1 1 49 49 SER CA C 49 58.411 58.411 57.919 0.492 19498
1976 1 6 . 1 1 49 49 SER CB C 49 63.806 63.806 63.062 0.744 19498
1977 1 6 . 1 1 49 49 SER H H 49 8.142 8.142 7.754 0.388 19498
1978 1 6 . 1 1 50 50 GLY N N 50 109.042 109.042 111.234 -2.192 19498
1979 1 6 . 1 1 50 50 GLY CA C 50 44.997 44.997 45.352 -0.354 19498
1980 1 6 . 1 1 50 50 GLY H H 50 8.035 8.035 7.955 0.080 19498
1981 1 6 . 1 1 51 51 ASN N N 51 119.842 119.842 118.802 1.040 19498
1982 1 6 . 1 1 51 51 ASN HA H 51 4.546 4.546 4.966 -0.420 19498
1983 1 6 . 1 1 51 51 ASN CA C 51 53.419 53.419 52.593 0.826 19498
1984 1 6 . 1 1 51 51 ASN CB C 51 38.422 38.422 40.944 -2.522 19498
1985 1 6 . 1 1 51 51 ASN H H 51 8.613 8.613 7.774 0.839 19498
1986 1 6 . 1 1 52 52 LEU N N 52 124.085 124.085 122.345 1.740 19498
1987 1 6 . 1 1 52 52 LEU HA H 52 4.142 4.142 4.583 -0.441 19498
1988 1 6 . 1 1 52 52 LEU CA C 52 56.023 56.023 55.751 0.272 19498
1989 1 6 . 1 1 52 52 LEU CB C 52 42.353 42.353 42.540 -0.187 19498
1990 1 6 . 1 1 52 52 LEU H H 52 8.631 8.631 8.493 0.138 19498
1991 1 6 . 1 1 53 53 ILE N N 53 129.362 129.362 122.085 7.277 19498
1992 1 6 . 1 1 53 53 ILE HA H 53 4.137 4.137 4.462 -0.325 19498
1993 1 6 . 1 1 53 53 ILE CA C 53 61.800 61.800 62.073 -0.273 19498
1994 1 6 . 1 1 53 53 ILE CB C 53 37.256 37.256 38.864 -1.608 19498
1995 1 6 . 1 1 53 53 ILE H H 53 9.432 9.432 8.912 0.520 19498
1996 1 6 . 1 1 54 54 ASP N N 54 113.575 113.575 117.961 -4.386 19498
1997 1 6 . 1 1 54 54 ASP HA H 54 4.847 4.847 5.044 -0.197 19498
1998 1 6 . 1 1 54 54 ASP CA C 54 53.586 53.586 54.000 -0.414 19498
1999 1 6 . 1 1 54 54 ASP CB C 54 44.500 44.500 44.738 -0.238 19498
2000 1 6 . 1 1 54 54 ASP H H 54 7.761 7.761 7.953 -0.192 19498
2001 1 6 . 1 1 55 55 THR N N 55 115.783 115.783 112.442 3.341 19498
2002 1 6 . 1 1 55 55 THR HA H 55 5.427 5.427 5.341 0.086 19498
2003 1 6 . 1 1 55 55 THR CA C 55 59.185 59.185 60.589 -1.404 19498
2004 1 6 . 1 1 55 55 THR CB C 55 70.551 70.551 72.025 -1.474 19498
2005 1 6 . 1 1 55 55 THR H H 55 10.106 10.106 8.284 1.822 19498
2006 1 6 . 1 1 56 56 SER N N 56 119.808 119.808 117.582 2.226 19498
2007 1 6 . 1 1 56 56 SER HA H 56 4.135 4.135 4.546 -0.411 19498
2008 1 6 . 1 1 56 56 SER CA C 56 58.001 58.001 57.658 0.343 19498
2009 1 6 . 1 1 56 56 SER CB C 56 65.039 65.039 64.544 0.495 19498
2010 1 6 . 1 1 56 56 SER H H 56 7.872 7.872 8.917 -1.045 19498
2011 1 6 . 1 1 57 57 THR N N 57 117.962 117.962 121.066 -3.104 19498
2012 1 6 . 1 1 57 57 THR HA H 57 4.964 4.964 4.883 0.081 19498
2013 1 6 . 1 1 57 57 THR CA C 57 61.001 61.001 61.579 -0.578 19498
2014 1 6 . 1 1 57 57 THR CB C 57 70.881 70.881 70.345 0.536 19498
2015 1 6 . 1 1 57 57 THR H H 57 7.524 7.524 7.883 -0.359 19498
2016 1 6 . 1 1 58 58 PHE N N 58 123.853 123.853 125.168 -1.315 19498
2017 1 6 . 1 1 58 58 PHE HA H 58 4.603 4.603 4.726 -0.123 19498
2018 1 6 . 1 1 58 58 PHE CA C 58 56.648 56.648 57.241 -0.593 19498
2019 1 6 . 1 1 58 58 PHE CB C 58 43.583 43.583 42.233 1.351 19498
2020 1 6 . 1 1 58 58 PHE H H 58 8.861 8.861 8.493 0.368 19498
2021 1 6 . 1 1 59 59 TYR N N 59 117.898 117.898 120.693 -2.795 19498
2022 1 6 . 1 1 59 59 TYR HA H 59 5.328 5.328 4.872 0.456 19498
2023 1 6 . 1 1 59 59 TYR CA C 59 56.221 56.221 57.596 -1.375 19498
2024 1 6 . 1 1 59 59 TYR CB C 59 42.106 42.106 40.632 1.474 19498
2025 1 6 . 1 1 59 59 TYR H H 59 8.328 8.328 8.615 -0.287 19498
2026 1 6 . 1 1 60 60 HIS CA C 60 60.065 60.065 56.250 3.815 19498
2027 1 6 . 1 1 60 60 HIS CB C 60 34.284 34.284 32.074 2.211 19498
2028 1 6 . 1 1 61 61 HIS N N 61 121.880 121.880 124.015 -2.135 19498
2029 1 6 . 1 1 61 61 HIS CA C 61 58.001 58.001 55.188 2.813 19498
2030 1 6 . 1 1 61 61 HIS CB C 61 29.999 29.999 28.094 1.905 19498
2031 1 6 . 1 1 61 61 HIS H H 61 7.734 7.734 8.302 -0.568 19498
2032 1 6 . 1 1 62 62 ASP N N 62 128.148 128.148 123.746 4.402 19498
2033 1 6 . 1 1 62 62 ASP HA H 62 4.870 4.870 4.863 0.007 19498
2034 1 6 . 1 1 62 62 ASP CA C 62 53.348 53.348 54.171 -0.823 19498
2035 1 6 . 1 1 62 62 ASP CB C 62 42.600 42.600 44.113 -1.513 19498
2036 1 6 . 1 1 62 62 ASP H H 62 11.492 11.492 8.193 3.299 19498
2037 1 6 . 1 1 63 63 GLU N N 63 126.564 126.564 125.468 1.096 19498
2038 1 6 . 1 1 63 63 GLU HA H 63 3.795 3.795 3.834 -0.039 19498
2039 1 6 . 1 1 63 63 GLU CA C 63 59.863 59.863 60.117 -0.254 19498
2040 1 6 . 1 1 63 63 GLU CB C 63 34.007 34.007 30.244 3.763 19498
2041 1 6 . 1 1 63 63 GLU H H 63 8.982 8.982 8.802 0.180 19498
2042 1 6 . 1 1 64 64 ASP N N 64 117.779 117.779 117.889 -0.110 19498
2043 1 6 . 1 1 64 64 ASP HA H 64 4.401 4.401 4.554 -0.153 19498
2044 1 6 . 1 1 64 64 ASP CA C 64 57.664 57.664 57.147 0.518 19498
2045 1 6 . 1 1 64 64 ASP CB C 64 40.369 40.369 40.619 -0.250 19498
2046 1 6 . 1 1 64 64 ASP H H 64 8.272 8.272 8.744 -0.472 19498
2047 1 6 . 1 1 65 65 VAL N N 65 121.948 121.948 119.857 2.091 19498
2048 1 6 . 1 1 65 65 VAL HA H 65 3.386 3.386 3.736 -0.350 19498
2049 1 6 . 1 1 65 65 VAL CA C 65 65.913 65.913 65.557 0.356 19498
2050 1 6 . 1 1 65 65 VAL CB C 65 31.465 31.465 31.376 0.089 19498
2051 1 6 . 1 1 65 65 VAL H H 65 7.335 7.335 7.853 -0.518 19498
2052 1 6 . 1 1 66 66 LEU N N 66 120.747 120.747 120.698 0.049 19498
2053 1 6 . 1 1 66 66 LEU HA H 66 3.905 3.905 3.827 0.078 19498
2054 1 6 . 1 1 66 66 LEU CA C 66 58.076 58.076 57.937 0.139 19498
2055 1 6 . 1 1 66 66 LEU CB C 66 42.160 42.160 40.629 1.531 19498
2056 1 6 . 1 1 66 66 LEU H H 66 8.164 8.164 7.452 0.712 19498
2057 1 6 . 1 1 67 67 PHE N N 67 116.553 116.553 117.986 -1.433 19498
2058 1 6 . 1 1 67 67 PHE HA H 67 3.900 3.900 3.978 -0.078 19498
2059 1 6 . 1 1 67 67 PHE CA C 67 62.849 62.849 61.867 0.982 19498
2060 1 6 . 1 1 67 67 PHE CB C 67 38.003 38.003 37.724 0.279 19498
2061 1 6 . 1 1 67 67 PHE H H 67 8.350 8.350 7.390 0.960 19498
2062 1 6 . 1 1 68 68 ASN N N 68 121.020 121.020 117.564 3.456 19498
2063 1 6 . 1 1 68 68 ASN HA H 68 4.415 4.415 4.387 0.028 19498
2064 1 6 . 1 1 68 68 ASN CA C 68 56.725 56.725 56.023 0.702 19498
2065 1 6 . 1 1 68 68 ASN CB C 68 38.071 38.071 38.461 -0.390 19498
2066 1 6 . 1 1 68 68 ASN H H 68 8.001 8.001 7.848 0.153 19498
2067 1 6 . 1 1 69 69 MET N N 69 120.402 120.402 118.341 2.061 19498
2068 1 6 . 1 1 69 69 MET HA H 69 4.011 4.011 4.124 -0.113 19498
2069 1 6 . 1 1 69 69 MET CA C 69 59.605 59.605 59.227 0.378 19498
2070 1 6 . 1 1 69 69 MET CB C 69 31.867 31.867 32.532 -0.665 19498
2071 1 6 . 1 1 69 69 MET H H 69 8.465 8.465 7.604 0.861 19498
2072 1 6 . 1 1 70 70 CYS N N 70 117.496 117.496 116.725 0.771 19498
2073 1 6 . 1 1 70 70 CYS CA C 70 63.145 63.145 63.436 -0.291 19498
2074 1 6 . 1 1 70 70 CYS CB C 70 27.510 27.510 27.271 0.239 19498
2075 1 6 . 1 1 70 70 CYS H H 70 7.616 7.616 7.563 0.053 19498
2076 1 6 . 1 1 71 71 THR N N 71 118.640 118.640 115.005 3.635 19498
2077 1 6 . 1 1 71 71 THR HA H 71 4.270 4.270 4.029 0.241 19498
2078 1 6 . 1 1 71 71 THR CA C 71 67.980 67.980 65.807 2.173 19498
2079 1 6 . 1 1 71 71 THR CB C 71 67.949 67.949 68.380 -0.431 19498
2080 1 6 . 1 1 71 71 THR H H 71 8.509 8.509 7.804 0.705 19498
2081 1 6 . 1 1 72 72 ASP HA H 72 4.430 4.430 4.396 0.034 19498
2082 1 6 . 1 1 72 72 ASP CA C 72 57.590 57.590 57.703 -0.113 19498
2083 1 6 . 1 1 72 72 ASP CB C 72 40.415 40.415 40.843 -0.428 19498
2084 1 6 . 1 1 73 73 TRP N N 73 121.657 121.657 121.135 0.522 19498
2085 1 6 . 1 1 73 73 TRP HA H 73 4.407 4.407 4.368 0.039 19498
2086 1 6 . 1 1 73 73 TRP CA C 73 62.951 62.951 60.980 1.971 19498
2087 1 6 . 1 1 73 73 TRP CB C 73 29.114 29.114 29.558 -0.444 19498
2088 1 6 . 1 1 73 73 TRP H H 73 7.780 7.780 7.869 -0.089 19498
2089 1 6 . 1 1 74 74 LEU N N 74 118.727 118.727 117.308 1.419 19498
2090 1 6 . 1 1 74 74 LEU HA H 74 3.582 3.582 3.887 -0.305 19498
2091 1 6 . 1 1 74 74 LEU CA C 74 58.184 58.184 57.889 0.294 19498
2092 1 6 . 1 1 74 74 LEU CB C 74 37.610 37.610 41.487 -3.877 19498
2093 1 6 . 1 1 74 74 LEU H H 74 8.490 8.490 7.567 0.923 19498
2094 1 6 . 1 1 75 75 ASN N N 75 117.962 117.962 115.064 2.898 19498
2095 1 6 . 1 1 75 75 ASN HA H 75 4.527 4.527 4.532 -0.005 19498
2096 1 6 . 1 1 75 75 ASN CA C 75 56.501 56.501 54.645 1.856 19498
2097 1 6 . 1 1 75 75 ASN CB C 75 37.999 37.999 38.562 -0.563 19498
2098 1 6 . 1 1 75 75 ASN H H 75 8.639 8.639 7.776 0.864 19498
2099 1 6 . 1 1 76 76 HIS N N 76 120.823 120.823 120.172 0.651 19498
2100 1 6 . 1 1 76 76 HIS HA H 76 4.450 4.450 4.182 0.268 19498
2101 1 6 . 1 1 76 76 HIS CA C 76 58.737 58.737 59.555 -0.818 19498
2102 1 6 . 1 1 76 76 HIS CB C 76 28.007 28.007 29.853 -1.846 19498
2103 1 6 . 1 1 76 76 HIS H H 76 8.158 8.158 7.465 0.693 19498
2104 1 6 . 1 1 77 77 MET N N 77 118.749 118.749 115.274 3.475 19498
2105 1 6 . 1 1 77 77 MET HA H 77 4.071 4.071 3.731 0.340 19498
2106 1 6 . 1 1 77 77 MET CA C 77 55.827 55.827 58.188 -2.361 19498
2107 1 6 . 1 1 77 77 MET CB C 77 29.541 29.541 31.726 -2.185 19498
2108 1 6 . 1 1 77 77 MET H H 77 8.404 8.404 7.265 1.139 19498
2109 1 6 . 1 1 78 78 TYR N N 78 120.762 120.762 118.605 2.157 19498
2110 1 6 . 1 1 78 78 TYR HA H 78 3.662 3.662 3.956 -0.294 19498
2111 1 6 . 1 1 78 78 TYR CA C 78 62.640 62.640 61.645 0.995 19498
2112 1 6 . 1 1 78 78 TYR CB C 78 37.545 37.545 37.430 0.115 19498
2113 1 6 . 1 1 78 78 TYR H H 78 8.322 8.322 7.619 0.703 19498
2114 1 6 . 1 1 79 79 ASP N N 79 116.578 116.578 116.615 -0.037 19498
2115 1 6 . 1 1 79 79 ASP HA H 79 4.106 4.106 4.344 -0.238 19498
2116 1 6 . 1 1 79 79 ASP CA C 79 57.410 57.410 56.967 0.444 19498
2117 1 6 . 1 1 79 79 ASP CB C 79 40.503 40.503 40.625 -0.122 19498
2118 1 6 . 1 1 79 79 ASP H H 79 7.460 7.460 8.277 -0.817 19498
2119 1 6 . 1 1 80 80 GLN N N 80 116.175 116.175 117.364 -1.189 19498
2120 1 6 . 1 1 80 80 GLN HA H 80 4.056 4.056 4.185 -0.129 19498
2121 1 6 . 1 1 80 80 GLN CA C 80 57.629 57.629 57.803 -0.174 19498
2122 1 6 . 1 1 80 80 GLN CB C 80 29.662 29.662 29.303 0.359 19498
2123 1 6 . 1 1 80 80 GLN H H 80 7.552 7.552 7.320 0.232 19498
2124 1 6 . 1 1 81 81 LEU N N 81 118.398 118.398 117.368 1.030 19498
2125 1 6 . 1 1 81 81 LEU HA H 81 4.233 4.233 3.525 0.708 19498
2126 1 6 . 1 1 81 81 LEU CA C 81 55.461 55.461 56.108 -0.648 19498
2127 1 6 . 1 1 81 81 LEU CB C 81 42.406 42.406 41.483 0.923 19498
2128 1 6 . 1 1 81 81 LEU H H 81 7.957 7.957 7.248 0.709 19498
2129 1 6 . 1 1 82 82 LYS N N 82 119.114 119.114 117.907 1.207 19498
2130 1 6 . 1 1 82 82 LYS HA H 82 3.841 3.841 3.920 -0.079 19498
2131 1 6 . 1 1 82 82 LYS CA C 82 58.510 58.510 58.769 -0.259 19498
2132 1 6 . 1 1 82 82 LYS CB C 82 30.922 30.922 32.139 -1.217 19498
2133 1 6 . 1 1 82 82 LYS H H 82 7.664 7.664 7.359 0.305 19498
2134 1 6 . 1 1 83 83 ASP N N 83 118.655 118.655 117.378 1.277 19498
2135 1 6 . 1 1 83 83 ASP HA H 83 4.819 4.819 4.510 0.309 19498
2136 1 6 . 1 1 83 83 ASP CA C 83 53.886 53.886 56.119 -2.233 19498
2137 1 6 . 1 1 83 83 ASP CB C 83 40.986 40.986 41.472 -0.486 19498
2138 1 6 . 1 1 83 83 ASP H H 83 7.862 7.862 7.903 -0.041 19498
2139 1 6 . 1 1 84 84 TRP N N 84 121.757 121.757 118.937 2.820 19498
2140 1 6 . 1 1 84 84 TRP CA C 84 58.462 58.462 54.988 3.474 19498
2141 1 6 . 1 1 84 84 TRP CB C 84 28.934 28.934 28.143 0.791 19498
2142 1 6 . 1 1 84 84 TRP H H 84 7.925 7.925 7.064 0.861 19498
2143 1 7 . 1 1 6 6 SER CA C 6 56.008 56.008 57.481 -1.473 19498
2144 1 7 . 1 1 7 7 GLY N N 7 109.496 109.496 108.892 0.604 19498
2145 1 7 . 1 1 7 7 GLY CA C 7 46.042 46.042 45.562 0.480 19498
2146 1 7 . 1 1 7 7 GLY H H 7 8.432 8.432 8.680 -0.248 19498
2147 1 7 . 1 1 8 8 ASN N N 8 119.432 119.432 118.957 0.475 19498
2148 1 7 . 1 1 8 8 ASN HA H 8 4.685 4.685 4.591 0.094 19498
2149 1 7 . 1 1 8 8 ASN CA C 8 53.922 53.922 53.567 0.355 19498
2150 1 7 . 1 1 8 8 ASN CB C 8 37.970 37.970 38.204 -0.234 19498
2151 1 7 . 1 1 8 8 ASN H H 8 8.367 8.367 8.049 0.318 19498
2152 1 7 . 1 1 9 9 LEU N N 9 123.537 123.537 120.397 3.140 19498
2153 1 7 . 1 1 9 9 LEU HA H 9 3.984 3.984 3.939 0.045 19498
2154 1 7 . 1 1 9 9 LEU CA C 9 56.417 56.417 55.090 1.327 19498
2155 1 7 . 1 1 9 9 LEU CB C 9 41.566 41.566 40.998 0.568 19498
2156 1 7 . 1 1 9 9 LEU H H 9 7.922 7.922 7.970 -0.048 19498
2157 1 7 . 1 1 10 10 ALA N N 10 122.287 122.287 123.807 -1.520 19498
2158 1 7 . 1 1 10 10 ALA HA H 10 4.127 4.127 4.032 0.095 19498
2159 1 7 . 1 1 10 10 ALA CA C 10 55.912 55.912 54.976 0.936 19498
2160 1 7 . 1 1 10 10 ALA CB C 10 17.998 17.998 18.399 -0.401 19498
2161 1 7 . 1 1 10 10 ALA H H 10 8.064 8.064 8.001 0.063 19498
2162 1 7 . 1 1 11 11 ALA N N 11 121.326 121.326 120.065 1.261 19498
2163 1 7 . 1 1 11 11 ALA HA H 11 4.207 4.207 4.116 0.091 19498
2164 1 7 . 1 1 11 11 ALA CA C 11 54.960 54.960 54.469 0.490 19498
2165 1 7 . 1 1 11 11 ALA CB C 11 17.998 17.998 18.241 -0.243 19498
2166 1 7 . 1 1 11 11 ALA H H 11 8.143 8.143 8.149 -0.006 19498
2167 1 7 . 1 1 12 12 PHE N N 12 122.913 122.913 119.818 3.095 19498
2168 1 7 . 1 1 12 12 PHE HA H 12 4.411 4.411 4.105 0.306 19498
2169 1 7 . 1 1 12 12 PHE CA C 12 61.007 61.007 61.221 -0.214 19498
2170 1 7 . 1 1 12 12 PHE CB C 12 39.499 39.499 39.067 0.432 19498
2171 1 7 . 1 1 12 12 PHE H H 12 7.779 7.779 8.264 -0.485 19498
2172 1 7 . 1 1 13 13 LYS N N 13 120.689 120.689 118.487 2.202 19498
2173 1 7 . 1 1 13 13 LYS HA H 13 3.861 3.861 4.025 -0.164 19498
2174 1 7 . 1 1 13 13 LYS CA C 13 59.099 59.099 59.325 -0.226 19498
2175 1 7 . 1 1 13 13 LYS CB C 13 31.867 31.867 32.110 -0.243 19498
2176 1 7 . 1 1 13 13 LYS H H 13 8.614 8.614 8.673 -0.059 19498
2177 1 7 . 1 1 14 14 ALA N N 14 122.076 122.076 121.430 0.646 19498
2178 1 7 . 1 1 14 14 ALA HA H 14 3.182 3.182 4.142 -0.960 19498
2179 1 7 . 1 1 14 14 ALA CA C 14 55.108 55.108 54.542 0.566 19498
2180 1 7 . 1 1 14 14 ALA CB C 14 18.120 18.120 17.998 0.122 19498
2181 1 7 . 1 1 14 14 ALA H H 14 8.178 8.178 7.582 0.596 19498
2182 1 7 . 1 1 15 15 ALA N N 15 121.714 121.714 119.774 1.940 19498
2183 1 7 . 1 1 15 15 ALA HA H 15 4.040 4.040 3.953 0.087 19498
2184 1 7 . 1 1 15 15 ALA CA C 15 55.158 55.158 54.176 0.982 19498
2185 1 7 . 1 1 15 15 ALA CB C 15 19.042 19.042 18.126 0.916 19498
2186 1 7 . 1 1 15 15 ALA H H 15 7.793 7.793 7.473 0.320 19498
2187 1 7 . 1 1 16 16 THR N N 16 111.959 111.959 114.174 -2.215 19498
2188 1 7 . 1 1 16 16 THR HA H 16 3.705 3.705 3.852 -0.147 19498
2189 1 7 . 1 1 16 16 THR CA C 16 66.762 66.762 67.030 -0.268 19498
2190 1 7 . 1 1 16 16 THR CB C 16 68.213 68.213 68.386 -0.173 19498
2191 1 7 . 1 1 16 16 THR H H 16 8.133 8.133 7.794 0.339 19498
2192 1 7 . 1 1 17 17 ASN N N 17 121.090 121.090 118.267 2.823 19498
2193 1 7 . 1 1 17 17 ASN HA H 17 4.520 4.520 4.852 -0.332 19498
2194 1 7 . 1 1 17 17 ASN CA C 17 56.191 56.191 55.743 0.448 19498
2195 1 7 . 1 1 17 17 ASN CB C 17 38.365 38.365 38.565 -0.200 19498
2196 1 7 . 1 1 17 17 ASN H H 17 8.152 8.152 8.014 0.138 19498
2197 1 7 . 1 1 18 18 LYS N N 18 119.978 119.978 120.166 -0.188 19498
2198 1 7 . 1 1 18 18 LYS HA H 18 3.914 3.914 4.199 -0.285 19498
2199 1 7 . 1 1 18 18 LYS CA C 18 59.865 59.865 57.754 2.111 19498
2200 1 7 . 1 1 18 18 LYS CB C 18 30.999 30.999 31.974 -0.975 19498
2201 1 7 . 1 1 18 18 LYS H H 18 7.568 7.568 7.464 0.104 19498
2202 1 7 . 1 1 19 19 LEU N N 19 117.558 117.558 119.895 -2.337 19498
2203 1 7 . 1 1 19 19 LEU HA H 19 4.135 4.135 4.020 0.115 19498
2204 1 7 . 1 1 19 19 LEU CA C 19 58.001 58.001 57.621 0.380 19498
2205 1 7 . 1 1 19 19 LEU CB C 19 40.823 40.823 41.445 -0.622 19498
2206 1 7 . 1 1 19 19 LEU H H 19 7.001 7.001 7.656 -0.655 19498
2207 1 7 . 1 1 20 20 PHE N N 20 121.123 121.123 115.786 5.337 19498
2208 1 7 . 1 1 20 20 PHE HA H 20 4.873 4.873 4.182 0.691 19498
2209 1 7 . 1 1 20 20 PHE CA C 20 60.375 60.375 61.049 -0.674 19498
2210 1 7 . 1 1 20 20 PHE CB C 20 38.480 38.480 38.260 0.220 19498
2211 1 7 . 1 1 20 20 PHE H H 20 8.193 8.193 7.360 0.833 19498
2212 1 7 . 1 1 21 21 GLN N N 21 118.591 118.591 114.922 3.669 19498
2213 1 7 . 1 1 21 21 GLN HA H 21 4.208 4.208 4.219 -0.011 19498
2214 1 7 . 1 1 21 21 GLN CA C 21 58.055 58.055 57.176 0.879 19498
2215 1 7 . 1 1 21 21 GLN CB C 21 28.284 28.284 29.117 -0.833 19498
2216 1 7 . 1 1 21 21 GLN H H 21 7.918 7.918 7.919 -0.001 19498
2217 1 7 . 1 1 22 22 LEU N N 22 118.477 118.477 117.408 1.069 19498
2218 1 7 . 1 1 22 22 LEU HA H 22 4.534 4.534 4.505 0.029 19498
2219 1 7 . 1 1 22 22 LEU CA C 22 54.033 54.033 54.076 -0.043 19498
2220 1 7 . 1 1 22 22 LEU CB C 22 41.469 41.469 43.729 -2.260 19498
2221 1 7 . 1 1 22 22 LEU H H 22 7.561 7.561 7.517 0.044 19498
2222 1 7 . 1 1 23 23 ASP N N 23 115.410 115.410 117.616 -2.206 19498
2223 1 7 . 1 1 23 23 ASP HA H 23 4.280 4.280 4.301 -0.021 19498
2224 1 7 . 1 1 23 23 ASP CA C 23 55.494 55.494 55.513 -0.019 19498
2225 1 7 . 1 1 23 23 ASP CB C 23 39.317 39.317 38.567 0.750 19498
2226 1 7 . 1 1 23 23 ASP H H 23 8.163 8.163 7.883 0.280 19498
2227 1 7 . 1 1 24 24 LEU N N 24 116.367 116.367 114.110 2.257 19498
2228 1 7 . 1 1 24 24 LEU HA H 24 4.790 4.790 4.720 0.070 19498
2229 1 7 . 1 1 24 24 LEU CA C 24 53.030 53.030 53.241 -0.211 19498
2230 1 7 . 1 1 24 24 LEU CB C 24 43.867 43.867 43.477 0.390 19498
2231 1 7 . 1 1 24 24 LEU H H 24 7.136 7.136 7.381 -0.245 19498
2232 1 7 . 1 1 25 25 ALA N N 25 123.243 123.243 121.127 2.116 19498
2233 1 7 . 1 1 25 25 ALA HA H 25 4.480 4.480 4.730 -0.250 19498
2234 1 7 . 1 1 25 25 ALA CA C 25 50.890 50.890 51.252 -0.362 19498
2235 1 7 . 1 1 25 25 ALA CB C 25 21.655 21.655 21.586 0.069 19498
2236 1 7 . 1 1 25 25 ALA H H 25 8.931 8.931 8.484 0.447 19498
2237 1 7 . 1 1 26 26 VAL N N 26 119.587 119.587 119.397 0.190 19498
2238 1 7 . 1 1 26 26 VAL HA H 26 4.889 4.889 4.658 0.231 19498
2239 1 7 . 1 1 26 26 VAL CA C 26 61.278 61.278 61.301 -0.023 19498
2240 1 7 . 1 1 26 26 VAL CB C 26 33.310 33.310 35.086 -1.776 19498
2241 1 7 . 1 1 26 26 VAL H H 26 7.575 7.575 8.228 -0.653 19498
2242 1 7 . 1 1 27 27 ILE N N 27 130.377 130.377 122.913 7.464 19498
2243 1 7 . 1 1 27 27 ILE HA H 27 4.489 4.489 4.740 -0.251 19498
2244 1 7 . 1 1 27 27 ILE CA C 27 60.177 60.177 60.601 -0.424 19498
2245 1 7 . 1 1 27 27 ILE CB C 27 40.019 40.019 40.666 -0.647 19498
2246 1 7 . 1 1 27 27 ILE H H 27 9.437 9.437 8.571 0.866 19498
2247 1 7 . 1 1 28 28 TYR N N 28 126.844 126.844 121.373 5.471 19498
2248 1 7 . 1 1 28 28 TYR HA H 28 5.709 5.709 5.811 -0.102 19498
2249 1 7 . 1 1 28 28 TYR CA C 28 55.486 55.486 55.088 0.398 19498
2250 1 7 . 1 1 28 28 TYR CB C 28 42.019 42.019 41.072 0.947 19498
2251 1 7 . 1 1 28 28 TYR H H 28 8.531 8.531 8.073 0.458 19498
2252 1 7 . 1 1 29 29 ASP N N 29 122.875 122.875 123.266 -0.391 19498
2253 1 7 . 1 1 29 29 ASP HA H 29 4.966 4.966 4.994 -0.028 19498
2254 1 7 . 1 1 29 29 ASP CA C 29 53.659 53.659 53.934 -0.275 19498
2255 1 7 . 1 1 29 29 ASP CB C 29 44.660 44.660 43.670 0.990 19498
2256 1 7 . 1 1 29 29 ASP H H 29 8.614 8.614 8.837 -0.223 19498
2257 1 7 . 1 1 30 30 ASP N N 30 119.325 119.325 121.212 -1.887 19498
2258 1 7 . 1 1 30 30 ASP HA H 30 5.447 5.447 4.925 0.522 19498
2259 1 7 . 1 1 30 30 ASP CA C 30 53.501 53.501 54.133 -0.631 19498
2260 1 7 . 1 1 30 30 ASP CB C 30 43.921 43.921 42.801 1.120 19498
2261 1 7 . 1 1 30 30 ASP H H 30 8.607 8.607 8.660 -0.053 19498
2262 1 7 . 1 1 31 31 TRP N N 31 120.552 120.552 125.785 -5.233 19498
2263 1 7 . 1 1 31 31 TRP HA H 31 4.615 4.615 4.668 -0.053 19498
2264 1 7 . 1 1 31 31 TRP CA C 31 58.000 58.000 58.467 -0.467 19498
2265 1 7 . 1 1 31 31 TRP CB C 31 31.500 31.500 30.702 0.798 19498
2266 1 7 . 1 1 31 31 TRP H H 31 8.673 8.673 8.719 -0.046 19498
2267 1 7 . 1 1 32 32 TYR CA C 32 52.400 52.400 57.556 -5.157 19498
2268 1 7 . 1 1 32 32 TYR CB C 32 42.350 42.350 38.959 3.391 19498
2269 1 7 . 1 1 33 33 ASP CA C 33 52.400 52.400 53.586 -1.186 19498
2270 1 7 . 1 1 33 33 ASP CB C 33 42.350 42.350 41.933 0.417 19498
2271 1 7 . 1 1 34 34 ALA N N 34 126.709 126.709 120.615 6.094 19498
2272 1 7 . 1 1 34 34 ALA HA H 34 3.845 3.845 4.414 -0.569 19498
2273 1 7 . 1 1 34 34 ALA CA C 34 58.599 58.599 52.178 6.421 19498
2274 1 7 . 1 1 34 34 ALA CB C 34 18.610 18.610 18.997 -0.387 19498
2275 1 7 . 1 1 34 34 ALA H H 34 8.424 8.424 8.192 0.232 19498
2276 1 7 . 1 1 35 35 TYR N N 35 117.123 117.123 122.786 -5.663 19498
2277 1 7 . 1 1 35 35 TYR HA H 35 4.350 4.350 4.236 0.114 19498
2278 1 7 . 1 1 35 35 TYR CA C 35 60.466 60.466 60.533 -0.067 19498
2279 1 7 . 1 1 35 35 TYR CB C 35 38.113 38.113 39.005 -0.892 19498
2280 1 7 . 1 1 35 35 TYR H H 35 8.334 8.334 8.651 -0.317 19498
2281 1 7 . 1 1 36 36 THR N N 36 108.046 108.046 108.454 -0.408 19498
2282 1 7 . 1 1 36 36 THR HA H 36 4.018 4.018 4.207 -0.189 19498
2283 1 7 . 1 1 36 36 THR CA C 36 61.809 61.809 60.696 1.113 19498
2284 1 7 . 1 1 36 36 THR CB C 36 69.926 69.926 68.471 1.455 19498
2285 1 7 . 1 1 36 36 THR H H 36 7.563 7.563 7.958 -0.395 19498
2286 1 7 . 1 1 37 37 ARG N N 37 118.456 118.456 119.064 -0.608 19498
2287 1 7 . 1 1 37 37 ARG CA C 37 57.001 57.001 56.626 0.375 19498
2288 1 7 . 1 1 37 37 ARG H H 37 7.952 7.952 7.387 0.565 19498
2289 1 7 . 1 1 40 40 CYS CA C 40 56.316 56.316 56.755 -0.439 19498
2290 1 7 . 1 1 40 40 CYS CB C 40 29.999 29.999 30.127 -0.127 19498
2291 1 7 . 1 1 41 41 ILE N N 41 121.419 121.419 124.442 -3.023 19498
2292 1 7 . 1 1 41 41 ILE HA H 41 4.709 4.709 4.777 -0.068 19498
2293 1 7 . 1 1 41 41 ILE CA C 41 60.462 60.462 60.420 0.042 19498
2294 1 7 . 1 1 41 41 ILE CB C 41 42.309 42.309 41.717 0.592 19498
2295 1 7 . 1 1 41 41 ILE H H 41 8.459 8.459 9.189 -0.730 19498
2296 1 7 . 1 1 42 42 ARG N N 42 127.916 127.916 126.431 1.485 19498
2297 1 7 . 1 1 42 42 ARG CA C 42 54.501 54.501 54.911 -0.410 19498
2298 1 7 . 1 1 42 42 ARG CB C 42 33.204 33.204 32.663 0.541 19498
2299 1 7 . 1 1 42 42 ARG H H 42 9.004 9.004 8.815 0.189 19498
2300 1 7 . 1 1 43 43 LEU N N 43 124.715 124.715 126.247 -1.532 19498
2301 1 7 . 1 1 43 43 LEU HA H 43 5.538 5.538 4.939 0.599 19498
2302 1 7 . 1 1 43 43 LEU CA C 43 53.266 53.266 54.058 -0.792 19498
2303 1 7 . 1 1 43 43 LEU CB C 43 46.163 46.163 44.520 1.643 19498
2304 1 7 . 1 1 43 43 LEU H H 43 8.757 8.757 8.458 0.299 19498
2305 1 7 . 1 1 44 44 ARG N N 44 123.499 123.499 127.268 -3.769 19498
2306 1 7 . 1 1 44 44 ARG HA H 44 5.004 5.004 4.700 0.304 19498
2307 1 7 . 1 1 44 44 ARG CA C 44 55.508 55.508 54.586 0.922 19498
2308 1 7 . 1 1 44 44 ARG CB C 44 34.543 34.543 33.093 1.450 19498
2309 1 7 . 1 1 44 44 ARG H H 44 9.366 9.366 9.259 0.107 19498
2310 1 7 . 1 1 45 45 ILE N N 45 122.919 122.919 127.300 -4.381 19498
2311 1 7 . 1 1 45 45 ILE HA H 45 5.260 5.260 4.541 0.719 19498
2312 1 7 . 1 1 45 45 ILE CA C 45 59.933 59.933 59.130 0.803 19498
2313 1 7 . 1 1 45 45 ILE CB C 45 39.751 39.751 38.873 0.878 19498
2314 1 7 . 1 1 45 45 ILE H H 45 8.938 8.938 8.067 0.871 19498
2315 1 7 . 1 1 46 46 GLU N N 46 126.745 126.745 124.132 2.613 19498
2316 1 7 . 1 1 46 46 GLU HA H 46 5.465 5.465 4.704 0.761 19498
2317 1 7 . 1 1 46 46 GLU CA C 46 53.707 53.707 55.120 -1.413 19498
2318 1 7 . 1 1 46 46 GLU CB C 46 35.276 35.276 34.211 1.065 19498
2319 1 7 . 1 1 46 46 GLU H H 46 9.097 9.097 8.706 0.391 19498
2320 1 7 . 1 1 47 47 ASP N N 47 117.988 117.988 120.600 -2.612 19498
2321 1 7 . 1 1 47 47 ASP HA H 47 4.976 4.976 4.790 0.186 19498
2322 1 7 . 1 1 47 47 ASP CA C 47 52.411 52.411 52.951 -0.540 19498
2323 1 7 . 1 1 47 47 ASP CB C 47 41.609 41.609 42.592 -0.983 19498
2324 1 7 . 1 1 47 47 ASP H H 47 8.209 8.209 8.686 -0.477 19498
2325 1 7 . 1 1 48 48 ARG N N 48 117.098 117.098 121.481 -4.383 19498
2326 1 7 . 1 1 48 48 ARG HA H 48 4.129 4.129 4.478 -0.349 19498
2327 1 7 . 1 1 48 48 ARG CA C 48 58.323 58.323 56.468 1.855 19498
2328 1 7 . 1 1 48 48 ARG CB C 48 29.511 29.511 29.559 -0.048 19498
2329 1 7 . 1 1 48 48 ARG H H 48 8.872 8.872 8.628 0.244 19498
2330 1 7 . 1 1 49 49 SER N N 49 115.006 115.006 115.586 -0.580 19498
2331 1 7 . 1 1 49 49 SER HA H 49 4.614 4.614 4.590 0.024 19498
2332 1 7 . 1 1 49 49 SER CA C 49 58.411 58.411 58.499 -0.088 19498
2333 1 7 . 1 1 49 49 SER CB C 49 63.806 63.806 63.236 0.570 19498
2334 1 7 . 1 1 49 49 SER H H 49 8.142 8.142 8.021 0.121 19498
2335 1 7 . 1 1 50 50 GLY N N 50 109.042 109.042 111.055 -2.013 19498
2336 1 7 . 1 1 50 50 GLY CA C 50 44.997 44.997 45.553 -0.556 19498
2337 1 7 . 1 1 50 50 GLY H H 50 8.035 8.035 8.600 -0.565 19498
2338 1 7 . 1 1 51 51 ASN N N 51 119.842 119.842 118.411 1.431 19498
2339 1 7 . 1 1 51 51 ASN HA H 51 4.546 4.546 4.916 -0.370 19498
2340 1 7 . 1 1 51 51 ASN CA C 51 53.419 53.419 52.608 0.812 19498
2341 1 7 . 1 1 51 51 ASN CB C 51 38.422 38.422 40.300 -1.878 19498
2342 1 7 . 1 1 51 51 ASN H H 51 8.613 8.613 8.205 0.408 19498
2343 1 7 . 1 1 52 52 LEU N N 52 124.085 124.085 121.644 2.441 19498
2344 1 7 . 1 1 52 52 LEU HA H 52 4.142 4.142 4.575 -0.433 19498
2345 1 7 . 1 1 52 52 LEU CA C 52 56.023 56.023 55.727 0.296 19498
2346 1 7 . 1 1 52 52 LEU CB C 52 42.353 42.353 42.520 -0.167 19498
2347 1 7 . 1 1 52 52 LEU H H 52 8.631 8.631 8.360 0.271 19498
2348 1 7 . 1 1 53 53 ILE N N 53 129.362 129.362 121.423 7.939 19498
2349 1 7 . 1 1 53 53 ILE HA H 53 4.137 4.137 4.307 -0.170 19498
2350 1 7 . 1 1 53 53 ILE CA C 53 61.800 61.800 61.651 0.149 19498
2351 1 7 . 1 1 53 53 ILE CB C 53 37.256 37.256 38.937 -1.681 19498
2352 1 7 . 1 1 53 53 ILE H H 53 9.432 9.432 8.517 0.915 19498
2353 1 7 . 1 1 54 54 ASP N N 54 113.575 113.575 118.109 -4.534 19498
2354 1 7 . 1 1 54 54 ASP HA H 54 4.847 4.847 4.912 -0.065 19498
2355 1 7 . 1 1 54 54 ASP CA C 54 53.586 53.586 54.236 -0.650 19498
2356 1 7 . 1 1 54 54 ASP CB C 54 44.500 44.500 44.073 0.427 19498
2357 1 7 . 1 1 54 54 ASP H H 54 7.761 7.761 8.003 -0.242 19498
2358 1 7 . 1 1 55 55 THR N N 55 115.783 115.783 112.329 3.454 19498
2359 1 7 . 1 1 55 55 THR HA H 55 5.427 5.427 4.679 0.748 19498
2360 1 7 . 1 1 55 55 THR CA C 55 59.185 59.185 61.325 -2.140 19498
2361 1 7 . 1 1 55 55 THR CB C 55 70.551 70.551 71.615 -1.064 19498
2362 1 7 . 1 1 55 55 THR H H 55 10.106 10.106 8.333 1.773 19498
2363 1 7 . 1 1 56 56 SER N N 56 119.808 119.808 118.210 1.598 19498
2364 1 7 . 1 1 56 56 SER HA H 56 4.135 4.135 4.428 -0.293 19498
2365 1 7 . 1 1 56 56 SER CA C 56 58.001 58.001 57.415 0.586 19498
2366 1 7 . 1 1 56 56 SER CB C 56 65.039 65.039 64.297 0.742 19498
2367 1 7 . 1 1 56 56 SER H H 56 7.872 7.872 8.255 -0.383 19498
2368 1 7 . 1 1 57 57 THR N N 57 117.962 117.962 120.464 -2.502 19498
2369 1 7 . 1 1 57 57 THR HA H 57 4.964 4.964 4.530 0.434 19498
2370 1 7 . 1 1 57 57 THR CA C 57 61.001 61.001 62.009 -1.008 19498
2371 1 7 . 1 1 57 57 THR CB C 57 70.881 70.881 70.669 0.212 19498
2372 1 7 . 1 1 57 57 THR H H 57 7.524 7.524 8.108 -0.584 19498
2373 1 7 . 1 1 58 58 PHE N N 58 123.853 123.853 127.194 -3.341 19498
2374 1 7 . 1 1 58 58 PHE HA H 58 4.603 4.603 4.825 -0.222 19498
2375 1 7 . 1 1 58 58 PHE CA C 58 56.648 56.648 57.322 -0.674 19498
2376 1 7 . 1 1 58 58 PHE CB C 58 43.583 43.583 41.011 2.572 19498
2377 1 7 . 1 1 58 58 PHE H H 58 8.861 8.861 9.190 -0.329 19498
2378 1 7 . 1 1 59 59 TYR N N 59 117.898 117.898 121.100 -3.202 19498
2379 1 7 . 1 1 59 59 TYR HA H 59 5.328 5.328 5.490 -0.162 19498
2380 1 7 . 1 1 59 59 TYR CA C 59 56.221 56.221 55.133 1.088 19498
2381 1 7 . 1 1 59 59 TYR CB C 59 42.106 42.106 40.003 2.103 19498
2382 1 7 . 1 1 59 59 TYR H H 59 8.328 8.328 8.735 -0.406 19498
2383 1 7 . 1 1 60 60 HIS CA C 60 60.065 60.065 56.487 3.578 19498
2384 1 7 . 1 1 60 60 HIS CB C 60 34.284 34.284 32.729 1.555 19498
2385 1 7 . 1 1 61 61 HIS N N 61 121.880 121.880 122.604 -0.724 19498
2386 1 7 . 1 1 61 61 HIS CA C 61 58.001 58.001 54.689 3.312 19498
2387 1 7 . 1 1 61 61 HIS CB C 61 29.999 29.999 28.431 1.568 19498
2388 1 7 . 1 1 61 61 HIS H H 61 7.734 7.734 8.263 -0.529 19498
2389 1 7 . 1 1 62 62 ASP N N 62 128.148 128.148 124.742 3.406 19498
2390 1 7 . 1 1 62 62 ASP HA H 62 4.870 4.870 4.917 -0.047 19498
2391 1 7 . 1 1 62 62 ASP CA C 62 53.348 53.348 53.694 -0.346 19498
2392 1 7 . 1 1 62 62 ASP CB C 62 42.600 42.600 43.450 -0.850 19498
2393 1 7 . 1 1 62 62 ASP H H 62 11.492 11.492 8.003 3.489 19498
2394 1 7 . 1 1 63 63 GLU N N 63 126.564 126.564 126.167 0.397 19498
2395 1 7 . 1 1 63 63 GLU HA H 63 3.795 3.795 3.982 -0.187 19498
2396 1 7 . 1 1 63 63 GLU CA C 63 59.863 59.863 60.052 -0.189 19498
2397 1 7 . 1 1 63 63 GLU CB C 63 34.007 34.007 29.853 4.154 19498
2398 1 7 . 1 1 63 63 GLU H H 63 8.982 8.982 8.791 0.191 19498
2399 1 7 . 1 1 64 64 ASP N N 64 117.779 117.779 119.567 -1.788 19498
2400 1 7 . 1 1 64 64 ASP HA H 64 4.401 4.401 4.530 -0.129 19498
2401 1 7 . 1 1 64 64 ASP CA C 64 57.664 57.664 57.005 0.659 19498
2402 1 7 . 1 1 64 64 ASP CB C 64 40.369 40.369 40.912 -0.543 19498
2403 1 7 . 1 1 64 64 ASP H H 64 8.272 8.272 7.985 0.287 19498
2404 1 7 . 1 1 65 65 VAL N N 65 121.948 121.948 120.720 1.228 19498
2405 1 7 . 1 1 65 65 VAL HA H 65 3.386 3.386 3.708 -0.322 19498
2406 1 7 . 1 1 65 65 VAL CA C 65 65.913 65.913 65.599 0.314 19498
2407 1 7 . 1 1 65 65 VAL CB C 65 31.465 31.465 31.893 -0.428 19498
2408 1 7 . 1 1 65 65 VAL H H 65 7.335 7.335 8.259 -0.924 19498
2409 1 7 . 1 1 66 66 LEU N N 66 120.747 120.747 121.505 -0.758 19498
2410 1 7 . 1 1 66 66 LEU HA H 66 3.905 3.905 3.879 0.026 19498
2411 1 7 . 1 1 66 66 LEU CA C 66 58.076 58.076 58.300 -0.224 19498
2412 1 7 . 1 1 66 66 LEU CB C 66 42.160 42.160 41.008 1.152 19498
2413 1 7 . 1 1 66 66 LEU H H 66 8.164 8.164 8.063 0.101 19498
2414 1 7 . 1 1 67 67 PHE N N 67 116.553 116.553 116.135 0.418 19498
2415 1 7 . 1 1 67 67 PHE HA H 67 3.900 3.900 4.167 -0.267 19498
2416 1 7 . 1 1 67 67 PHE CA C 67 62.849 62.849 61.578 1.271 19498
2417 1 7 . 1 1 67 67 PHE CB C 67 38.003 38.003 38.026 -0.023 19498
2418 1 7 . 1 1 67 67 PHE H H 67 8.350 8.350 7.658 0.692 19498
2419 1 7 . 1 1 68 68 ASN N N 68 121.020 121.020 119.047 1.973 19498
2420 1 7 . 1 1 68 68 ASN HA H 68 4.415 4.415 4.469 -0.054 19498
2421 1 7 . 1 1 68 68 ASN CA C 68 56.725 56.725 56.237 0.488 19498
2422 1 7 . 1 1 68 68 ASN CB C 68 38.071 38.071 38.415 -0.344 19498
2423 1 7 . 1 1 68 68 ASN H H 68 8.001 8.001 7.572 0.429 19498
2424 1 7 . 1 1 69 69 MET N N 69 120.402 120.402 118.651 1.751 19498
2425 1 7 . 1 1 69 69 MET HA H 69 4.011 4.011 4.192 -0.181 19498
2426 1 7 . 1 1 69 69 MET CA C 69 59.605 59.605 59.135 0.470 19498
2427 1 7 . 1 1 69 69 MET CB C 69 31.867 31.867 32.655 -0.788 19498
2428 1 7 . 1 1 69 69 MET H H 69 8.465 8.465 7.773 0.692 19498
2429 1 7 . 1 1 70 70 CYS N N 70 117.496 117.496 116.829 0.667 19498
2430 1 7 . 1 1 70 70 CYS CA C 70 63.145 63.145 63.812 -0.667 19498
2431 1 7 . 1 1 70 70 CYS CB C 70 27.510 27.510 26.975 0.535 19498
2432 1 7 . 1 1 70 70 CYS H H 70 7.616 7.616 7.537 0.079 19498
2433 1 7 . 1 1 71 71 THR N N 71 118.640 118.640 115.212 3.428 19498
2434 1 7 . 1 1 71 71 THR HA H 71 4.270 4.270 4.197 0.073 19498
2435 1 7 . 1 1 71 71 THR CA C 71 67.980 67.980 65.987 1.993 19498
2436 1 7 . 1 1 71 71 THR CB C 71 67.949 67.949 68.489 -0.540 19498
2437 1 7 . 1 1 71 71 THR H H 71 8.509 8.509 7.978 0.531 19498
2438 1 7 . 1 1 72 72 ASP HA H 72 4.430 4.430 4.528 -0.098 19498
2439 1 7 . 1 1 72 72 ASP CA C 72 57.590 57.590 58.100 -0.510 19498
2440 1 7 . 1 1 72 72 ASP CB C 72 40.415 40.415 40.836 -0.421 19498
2441 1 7 . 1 1 73 73 TRP N N 73 121.657 121.657 120.675 0.982 19498
2442 1 7 . 1 1 73 73 TRP HA H 73 4.407 4.407 4.481 -0.074 19498
2443 1 7 . 1 1 73 73 TRP CA C 73 62.951 62.951 61.593 1.358 19498
2444 1 7 . 1 1 73 73 TRP CB C 73 29.114 29.114 30.083 -0.969 19498
2445 1 7 . 1 1 73 73 TRP H H 73 7.780 7.780 7.313 0.467 19498
2446 1 7 . 1 1 74 74 LEU N N 74 118.727 118.727 119.476 -0.749 19498
2447 1 7 . 1 1 74 74 LEU HA H 74 3.582 3.582 3.920 -0.338 19498
2448 1 7 . 1 1 74 74 LEU CA C 74 58.184 58.184 58.151 0.033 19498
2449 1 7 . 1 1 74 74 LEU CB C 74 37.610 37.610 41.814 -4.204 19498
2450 1 7 . 1 1 74 74 LEU H H 74 8.490 8.490 7.568 0.922 19498
2451 1 7 . 1 1 75 75 ASN N N 75 117.962 117.962 116.541 1.421 19498
2452 1 7 . 1 1 75 75 ASN HA H 75 4.527 4.527 4.617 -0.090 19498
2453 1 7 . 1 1 75 75 ASN CA C 75 56.501 56.501 55.824 0.677 19498
2454 1 7 . 1 1 75 75 ASN CB C 75 37.999 37.999 38.117 -0.118 19498
2455 1 7 . 1 1 75 75 ASN H H 75 8.639 8.639 8.108 0.531 19498
2456 1 7 . 1 1 76 76 HIS N N 76 120.823 120.823 119.489 1.334 19498
2457 1 7 . 1 1 76 76 HIS HA H 76 4.450 4.450 4.237 0.213 19498
2458 1 7 . 1 1 76 76 HIS CA C 76 58.737 58.737 59.531 -0.794 19498
2459 1 7 . 1 1 76 76 HIS CB C 76 28.007 28.007 29.967 -1.960 19498
2460 1 7 . 1 1 76 76 HIS H H 76 8.158 8.158 7.781 0.377 19498
2461 1 7 . 1 1 77 77 MET N N 77 118.749 118.749 115.580 3.169 19498
2462 1 7 . 1 1 77 77 MET HA H 77 4.071 4.071 3.926 0.145 19498
2463 1 7 . 1 1 77 77 MET CA C 77 55.827 55.827 57.616 -1.789 19498
2464 1 7 . 1 1 77 77 MET CB C 77 29.541 29.541 31.945 -2.404 19498
2465 1 7 . 1 1 77 77 MET H H 77 8.404 8.404 7.392 1.012 19498
2466 1 7 . 1 1 78 78 TYR N N 78 120.762 120.762 120.438 0.324 19498
2467 1 7 . 1 1 78 78 TYR HA H 78 3.662 3.662 3.962 -0.300 19498
2468 1 7 . 1 1 78 78 TYR CA C 78 62.640 62.640 62.023 0.617 19498
2469 1 7 . 1 1 78 78 TYR CB C 78 37.545 37.545 37.834 -0.289 19498
2470 1 7 . 1 1 78 78 TYR H H 78 8.322 8.322 7.578 0.744 19498
2471 1 7 . 1 1 79 79 ASP N N 79 116.578 116.578 117.501 -0.923 19498
2472 1 7 . 1 1 79 79 ASP HA H 79 4.106 4.106 4.283 -0.177 19498
2473 1 7 . 1 1 79 79 ASP CA C 79 57.410 57.410 57.299 0.111 19498
2474 1 7 . 1 1 79 79 ASP CB C 79 40.503 40.503 40.853 -0.350 19498
2475 1 7 . 1 1 79 79 ASP H H 79 7.460 7.460 7.929 -0.469 19498
2476 1 7 . 1 1 80 80 GLN N N 80 116.175 116.175 119.871 -3.696 19498
2477 1 7 . 1 1 80 80 GLN HA H 80 4.056 4.056 4.131 -0.075 19498
2478 1 7 . 1 1 80 80 GLN CA C 80 57.629 57.629 58.092 -0.463 19498
2479 1 7 . 1 1 80 80 GLN CB C 80 29.662 29.662 28.695 0.967 19498
2480 1 7 . 1 1 80 80 GLN H H 80 7.552 7.552 8.148 -0.596 19498
2481 1 7 . 1 1 81 81 LEU N N 81 118.398 118.398 115.584 2.814 19498
2482 1 7 . 1 1 81 81 LEU HA H 81 4.233 4.233 4.496 -0.263 19498
2483 1 7 . 1 1 81 81 LEU CA C 81 55.461 55.461 55.200 0.261 19498
2484 1 7 . 1 1 81 81 LEU CB C 81 42.406 42.406 41.486 0.920 19498
2485 1 7 . 1 1 81 81 LEU H H 81 7.957 7.957 7.572 0.385 19498
2486 1 7 . 1 1 82 82 LYS N N 82 119.114 119.114 117.153 1.961 19498
2487 1 7 . 1 1 82 82 LYS HA H 82 3.841 3.841 4.270 -0.429 19498
2488 1 7 . 1 1 82 82 LYS CA C 82 58.510 58.510 57.961 0.549 19498
2489 1 7 . 1 1 82 82 LYS CB C 82 30.922 30.922 32.904 -1.982 19498
2490 1 7 . 1 1 82 82 LYS H H 82 7.664 7.664 7.320 0.344 19498
2491 1 7 . 1 1 83 83 ASP N N 83 118.655 118.655 117.649 1.006 19498
2492 1 7 . 1 1 83 83 ASP HA H 83 4.819 4.819 4.725 0.094 19498
2493 1 7 . 1 1 83 83 ASP CA C 83 53.886 53.886 55.323 -1.437 19498
2494 1 7 . 1 1 83 83 ASP CB C 83 40.986 40.986 42.235 -1.249 19498
2495 1 7 . 1 1 83 83 ASP H H 83 7.862 7.862 7.773 0.089 19498
2496 1 7 . 1 1 84 84 TRP N N 84 121.757 121.757 121.701 0.056 19498
2497 1 7 . 1 1 84 84 TRP CA C 84 58.462 58.462 57.248 1.214 19498
2498 1 7 . 1 1 84 84 TRP CB C 84 28.934 28.934 30.583 -1.649 19498
2499 1 7 . 1 1 84 84 TRP H H 84 7.925 7.925 7.630 0.295 19498
2500 1 8 . 1 1 6 6 SER CA C 6 56.008 56.008 57.478 -1.470 19498
2501 1 8 . 1 1 7 7 GLY N N 7 109.496 109.496 110.685 -1.189 19498
2502 1 8 . 1 1 7 7 GLY CA C 7 46.042 46.042 46.285 -0.243 19498
2503 1 8 . 1 1 7 7 GLY H H 7 8.432 8.432 8.671 -0.239 19498
2504 1 8 . 1 1 8 8 ASN N N 8 119.432 119.432 118.049 1.383 19498
2505 1 8 . 1 1 8 8 ASN HA H 8 4.685 4.685 4.473 0.212 19498
2506 1 8 . 1 1 8 8 ASN CA C 8 53.922 53.922 53.970 -0.048 19498
2507 1 8 . 1 1 8 8 ASN CB C 8 37.970 37.970 38.522 -0.552 19498
2508 1 8 . 1 1 8 8 ASN H H 8 8.367 8.367 7.582 0.785 19498
2509 1 8 . 1 1 9 9 LEU N N 9 123.537 123.537 117.920 5.617 19498
2510 1 8 . 1 1 9 9 LEU HA H 9 3.984 3.984 4.550 -0.566 19498
2511 1 8 . 1 1 9 9 LEU CA C 9 56.417 56.417 54.736 1.681 19498
2512 1 8 . 1 1 9 9 LEU CB C 9 41.566 41.566 42.945 -1.379 19498
2513 1 8 . 1 1 9 9 LEU H H 9 7.922 7.922 7.506 0.416 19498
2514 1 8 . 1 1 10 10 ALA N N 10 122.287 122.287 124.248 -1.961 19498
2515 1 8 . 1 1 10 10 ALA HA H 10 4.127 4.127 3.974 0.153 19498
2516 1 8 . 1 1 10 10 ALA CA C 10 55.912 55.912 55.623 0.288 19498
2517 1 8 . 1 1 10 10 ALA CB C 10 17.998 17.998 17.893 0.105 19498
2518 1 8 . 1 1 10 10 ALA H H 10 8.064 8.064 7.757 0.307 19498
2519 1 8 . 1 1 11 11 ALA N N 11 121.326 121.326 119.606 1.720 19498
2520 1 8 . 1 1 11 11 ALA HA H 11 4.207 4.207 4.068 0.139 19498
2521 1 8 . 1 1 11 11 ALA CA C 11 54.960 54.960 54.593 0.367 19498
2522 1 8 . 1 1 11 11 ALA CB C 11 17.998 17.998 18.370 -0.372 19498
2523 1 8 . 1 1 11 11 ALA H H 11 8.143 8.143 8.498 -0.355 19498
2524 1 8 . 1 1 12 12 PHE N N 12 122.913 122.913 118.734 4.179 19498
2525 1 8 . 1 1 12 12 PHE HA H 12 4.411 4.411 4.096 0.315 19498
2526 1 8 . 1 1 12 12 PHE CA C 12 61.007 61.007 61.472 -0.465 19498
2527 1 8 . 1 1 12 12 PHE CB C 12 39.499 39.499 39.220 0.279 19498
2528 1 8 . 1 1 12 12 PHE H H 12 7.779 7.779 8.162 -0.383 19498
2529 1 8 . 1 1 13 13 LYS N N 13 120.689 120.689 117.708 2.981 19498
2530 1 8 . 1 1 13 13 LYS HA H 13 3.861 3.861 4.075 -0.214 19498
2531 1 8 . 1 1 13 13 LYS CA C 13 59.099 59.099 58.121 0.978 19498
2532 1 8 . 1 1 13 13 LYS CB C 13 31.867 31.867 31.689 0.177 19498
2533 1 8 . 1 1 13 13 LYS H H 13 8.614 8.614 8.561 0.053 19498
2534 1 8 . 1 1 14 14 ALA N N 14 122.076 122.076 121.427 0.649 19498
2535 1 8 . 1 1 14 14 ALA HA H 14 3.182 3.182 4.115 -0.933 19498
2536 1 8 . 1 1 14 14 ALA CA C 14 55.108 55.108 54.792 0.316 19498
2537 1 8 . 1 1 14 14 ALA CB C 14 18.120 18.120 18.098 0.022 19498
2538 1 8 . 1 1 14 14 ALA H H 14 8.178 8.178 7.395 0.783 19498
2539 1 8 . 1 1 15 15 ALA N N 15 121.714 121.714 119.557 2.157 19498
2540 1 8 . 1 1 15 15 ALA HA H 15 4.040 4.040 3.903 0.137 19498
2541 1 8 . 1 1 15 15 ALA CA C 15 55.158 55.158 54.502 0.656 19498
2542 1 8 . 1 1 15 15 ALA CB C 15 19.042 19.042 18.390 0.652 19498
2543 1 8 . 1 1 15 15 ALA H H 15 7.793 7.793 7.882 -0.089 19498
2544 1 8 . 1 1 16 16 THR N N 16 111.959 111.959 115.061 -3.102 19498
2545 1 8 . 1 1 16 16 THR HA H 16 3.705 3.705 3.886 -0.181 19498
2546 1 8 . 1 1 16 16 THR CA C 16 66.762 66.762 67.892 -1.130 19498
2547 1 8 . 1 1 16 16 THR CB C 16 68.213 68.213 68.459 -0.246 19498
2548 1 8 . 1 1 16 16 THR H H 16 8.133 8.133 7.411 0.722 19498
2549 1 8 . 1 1 17 17 ASN N N 17 121.090 121.090 117.916 3.174 19498
2550 1 8 . 1 1 17 17 ASN HA H 17 4.520 4.520 4.481 0.039 19498
2551 1 8 . 1 1 17 17 ASN CA C 17 56.191 56.191 55.548 0.643 19498
2552 1 8 . 1 1 17 17 ASN CB C 17 38.365 38.365 38.798 -0.433 19498
2553 1 8 . 1 1 17 17 ASN H H 17 8.152 8.152 7.766 0.386 19498
2554 1 8 . 1 1 18 18 LYS N N 18 119.978 119.978 119.466 0.512 19498
2555 1 8 . 1 1 18 18 LYS HA H 18 3.914 3.914 4.099 -0.185 19498
2556 1 8 . 1 1 18 18 LYS CA C 18 59.865 59.865 58.226 1.639 19498
2557 1 8 . 1 1 18 18 LYS CB C 18 30.999 30.999 31.913 -0.913 19498
2558 1 8 . 1 1 18 18 LYS H H 18 7.568 7.568 7.333 0.235 19498
2559 1 8 . 1 1 19 19 LEU N N 19 117.558 117.558 120.219 -2.661 19498
2560 1 8 . 1 1 19 19 LEU HA H 19 4.135 4.135 4.145 -0.010 19498
2561 1 8 . 1 1 19 19 LEU CA C 19 58.001 58.001 57.717 0.284 19498
2562 1 8 . 1 1 19 19 LEU CB C 19 40.823 40.823 41.882 -1.059 19498
2563 1 8 . 1 1 19 19 LEU H H 19 7.001 7.001 7.482 -0.481 19498
2564 1 8 . 1 1 20 20 PHE N N 20 121.123 121.123 117.981 3.142 19498
2565 1 8 . 1 1 20 20 PHE HA H 20 4.873 4.873 4.158 0.715 19498
2566 1 8 . 1 1 20 20 PHE CA C 20 60.375 60.375 61.055 -0.680 19498
2567 1 8 . 1 1 20 20 PHE CB C 20 38.480 38.480 39.208 -0.728 19498
2568 1 8 . 1 1 20 20 PHE H H 20 8.193 8.193 7.659 0.534 19498
2569 1 8 . 1 1 21 21 GLN N N 21 118.591 118.591 115.305 3.286 19498
2570 1 8 . 1 1 21 21 GLN HA H 21 4.208 4.208 4.139 0.069 19498
2571 1 8 . 1 1 21 21 GLN CA C 21 58.055 58.055 56.967 1.088 19498
2572 1 8 . 1 1 21 21 GLN CB C 21 28.284 28.284 28.719 -0.435 19498
2573 1 8 . 1 1 21 21 GLN H H 21 7.918 7.918 7.964 -0.046 19498
2574 1 8 . 1 1 22 22 LEU N N 22 118.477 118.477 118.617 -0.140 19498
2575 1 8 . 1 1 22 22 LEU HA H 22 4.534 4.534 4.470 0.064 19498
2576 1 8 . 1 1 22 22 LEU CA C 22 54.033 54.033 54.166 -0.133 19498
2577 1 8 . 1 1 22 22 LEU CB C 22 41.469 41.469 43.046 -1.577 19498
2578 1 8 . 1 1 22 22 LEU H H 22 7.561 7.561 7.450 0.111 19498
2579 1 8 . 1 1 23 23 ASP N N 23 115.410 115.410 118.794 -3.384 19498
2580 1 8 . 1 1 23 23 ASP HA H 23 4.280 4.280 4.165 0.115 19498
2581 1 8 . 1 1 23 23 ASP CA C 23 55.494 55.494 55.470 0.024 19498
2582 1 8 . 1 1 23 23 ASP CB C 23 39.317 39.317 39.225 0.092 19498
2583 1 8 . 1 1 23 23 ASP H H 23 8.163 8.163 7.776 0.387 19498
2584 1 8 . 1 1 24 24 LEU N N 24 116.367 116.367 111.804 4.563 19498
2585 1 8 . 1 1 24 24 LEU HA H 24 4.790 4.790 5.191 -0.401 19498
2586 1 8 . 1 1 24 24 LEU CA C 24 53.030 53.030 52.962 0.068 19498
2587 1 8 . 1 1 24 24 LEU CB C 24 43.867 43.867 44.244 -0.377 19498
2588 1 8 . 1 1 24 24 LEU H H 24 7.136 7.136 7.549 -0.413 19498
2589 1 8 . 1 1 25 25 ALA N N 25 123.243 123.243 121.058 2.185 19498
2590 1 8 . 1 1 25 25 ALA HA H 25 4.480 4.480 4.839 -0.359 19498
2591 1 8 . 1 1 25 25 ALA CA C 25 50.890 50.890 51.285 -0.395 19498
2592 1 8 . 1 1 25 25 ALA CB C 25 21.655 21.655 21.496 0.159 19498
2593 1 8 . 1 1 25 25 ALA H H 25 8.931 8.931 8.549 0.382 19498
2594 1 8 . 1 1 26 26 VAL N N 26 119.587 119.587 122.578 -2.991 19498
2595 1 8 . 1 1 26 26 VAL HA H 26 4.889 4.889 4.390 0.499 19498
2596 1 8 . 1 1 26 26 VAL CA C 26 61.278 61.278 61.179 0.099 19498
2597 1 8 . 1 1 26 26 VAL CB C 26 33.310 33.310 32.671 0.639 19498
2598 1 8 . 1 1 26 26 VAL H H 26 7.575 7.575 8.308 -0.733 19498
2599 1 8 . 1 1 27 27 ILE N N 27 130.377 130.377 126.895 3.482 19498
2600 1 8 . 1 1 27 27 ILE HA H 27 4.489 4.489 4.702 -0.213 19498
2601 1 8 . 1 1 27 27 ILE CA C 27 60.177 60.177 60.615 -0.438 19498
2602 1 8 . 1 1 27 27 ILE CB C 27 40.019 40.019 38.401 1.618 19498
2603 1 8 . 1 1 27 27 ILE H H 27 9.437 9.437 8.075 1.362 19498
2604 1 8 . 1 1 28 28 TYR N N 28 126.844 126.844 122.656 4.188 19498
2605 1 8 . 1 1 28 28 TYR HA H 28 5.709 5.709 5.587 0.122 19498
2606 1 8 . 1 1 28 28 TYR CA C 28 55.486 55.486 54.389 1.097 19498
2607 1 8 . 1 1 28 28 TYR CB C 28 42.019 42.019 40.380 1.639 19498
2608 1 8 . 1 1 28 28 TYR H H 28 8.531 8.531 8.165 0.366 19498
2609 1 8 . 1 1 29 29 ASP N N 29 122.875 122.875 120.987 1.888 19498
2610 1 8 . 1 1 29 29 ASP HA H 29 4.966 4.966 4.620 0.346 19498
2611 1 8 . 1 1 29 29 ASP CA C 29 53.659 53.659 54.303 -0.644 19498
2612 1 8 . 1 1 29 29 ASP CB C 29 44.660 44.660 41.970 2.690 19498
2613 1 8 . 1 1 29 29 ASP H H 29 8.614 8.614 8.613 0.001 19498
2614 1 8 . 1 1 30 30 ASP N N 30 119.325 119.325 123.444 -4.119 19498
2615 1 8 . 1 1 30 30 ASP HA H 30 5.447 5.447 4.676 0.771 19498
2616 1 8 . 1 1 30 30 ASP CA C 30 53.501 53.501 53.690 -0.189 19498
2617 1 8 . 1 1 30 30 ASP CB C 30 43.921 43.921 42.617 1.304 19498
2618 1 8 . 1 1 30 30 ASP H H 30 8.607 8.607 8.479 0.128 19498
2619 1 8 . 1 1 31 31 TRP N N 31 120.552 120.552 121.575 -1.023 19498
2620 1 8 . 1 1 31 31 TRP HA H 31 4.615 4.615 4.388 0.227 19498
2621 1 8 . 1 1 31 31 TRP CA C 31 58.000 58.000 58.162 -0.162 19498
2622 1 8 . 1 1 31 31 TRP CB C 31 31.500 31.500 29.620 1.880 19498
2623 1 8 . 1 1 31 31 TRP H H 31 8.673 8.673 8.485 0.188 19498
2624 1 8 . 1 1 32 32 TYR CA C 32 52.400 52.400 55.404 -3.004 19498
2625 1 8 . 1 1 32 32 TYR CB C 32 42.350 42.350 41.135 1.215 19498
2626 1 8 . 1 1 33 33 ASP CA C 33 52.400 52.400 54.089 -1.689 19498
2627 1 8 . 1 1 33 33 ASP CB C 33 42.350 42.350 40.853 1.497 19498
2628 1 8 . 1 1 34 34 ALA N N 34 126.709 126.709 119.897 6.812 19498
2629 1 8 . 1 1 34 34 ALA HA H 34 3.845 3.845 4.124 -0.279 19498
2630 1 8 . 1 1 34 34 ALA CA C 34 58.599 58.599 51.344 7.255 19498
2631 1 8 . 1 1 34 34 ALA CB C 34 18.610 18.610 19.717 -1.107 19498
2632 1 8 . 1 1 34 34 ALA H H 34 8.424 8.424 6.485 1.939 19498
2633 1 8 . 1 1 35 35 TYR N N 35 117.123 117.123 123.677 -6.554 19498
2634 1 8 . 1 1 35 35 TYR HA H 35 4.350 4.350 4.352 -0.002 19498
2635 1 8 . 1 1 35 35 TYR CA C 35 60.466 60.466 58.547 1.919 19498
2636 1 8 . 1 1 35 35 TYR CB C 35 38.113 38.113 38.462 -0.349 19498
2637 1 8 . 1 1 35 35 TYR H H 35 8.334 8.334 8.800 -0.466 19498
2638 1 8 . 1 1 36 36 THR N N 36 108.046 108.046 109.470 -1.424 19498
2639 1 8 . 1 1 36 36 THR HA H 36 4.018 4.018 4.136 -0.118 19498
2640 1 8 . 1 1 36 36 THR CA C 36 61.809 61.809 62.037 -0.228 19498
2641 1 8 . 1 1 36 36 THR CB C 36 69.926 69.926 68.481 1.445 19498
2642 1 8 . 1 1 36 36 THR H H 36 7.563 7.563 7.587 -0.024 19498
2643 1 8 . 1 1 37 37 ARG N N 37 118.456 118.456 119.756 -1.300 19498
2644 1 8 . 1 1 37 37 ARG CA C 37 57.001 57.001 56.893 0.108 19498
2645 1 8 . 1 1 37 37 ARG H H 37 7.952 7.952 7.395 0.557 19498
2646 1 8 . 1 1 40 40 CYS CA C 40 56.316 56.316 58.203 -1.887 19498
2647 1 8 . 1 1 40 40 CYS CB C 40 29.999 29.999 28.940 1.059 19498
2648 1 8 . 1 1 41 41 ILE N N 41 121.419 121.419 126.772 -5.353 19498
2649 1 8 . 1 1 41 41 ILE HA H 41 4.709 4.709 4.380 0.329 19498
2650 1 8 . 1 1 41 41 ILE CA C 41 60.462 60.462 60.790 -0.328 19498
2651 1 8 . 1 1 41 41 ILE CB C 41 42.309 42.309 40.451 1.858 19498
2652 1 8 . 1 1 41 41 ILE H H 41 8.459 8.459 8.039 0.420 19498
2653 1 8 . 1 1 42 42 ARG N N 42 127.916 127.916 126.411 1.505 19498
2654 1 8 . 1 1 42 42 ARG CA C 42 54.501 54.501 55.084 -0.583 19498
2655 1 8 . 1 1 42 42 ARG CB C 42 33.204 33.204 32.756 0.448 19498
2656 1 8 . 1 1 42 42 ARG H H 42 9.004 9.004 8.687 0.317 19498
2657 1 8 . 1 1 43 43 LEU N N 43 124.715 124.715 124.941 -0.226 19498
2658 1 8 . 1 1 43 43 LEU HA H 43 5.538 5.538 4.786 0.752 19498
2659 1 8 . 1 1 43 43 LEU CA C 43 53.266 53.266 54.362 -1.096 19498
2660 1 8 . 1 1 43 43 LEU CB C 43 46.163 46.163 43.252 2.911 19498
2661 1 8 . 1 1 43 43 LEU H H 43 8.757 8.757 8.526 0.231 19498
2662 1 8 . 1 1 44 44 ARG N N 44 123.499 123.499 125.825 -2.326 19498
2663 1 8 . 1 1 44 44 ARG HA H 44 5.004 5.004 4.746 0.258 19498
2664 1 8 . 1 1 44 44 ARG CA C 44 55.508 55.508 55.039 0.469 19498
2665 1 8 . 1 1 44 44 ARG CB C 44 34.543 34.543 32.495 2.049 19498
2666 1 8 . 1 1 44 44 ARG H H 44 9.366 9.366 8.834 0.532 19498
2667 1 8 . 1 1 45 45 ILE N N 45 122.919 122.919 127.040 -4.121 19498
2668 1 8 . 1 1 45 45 ILE HA H 45 5.260 5.260 4.525 0.735 19498
2669 1 8 . 1 1 45 45 ILE CA C 45 59.933 59.933 59.159 0.774 19498
2670 1 8 . 1 1 45 45 ILE CB C 45 39.751 39.751 38.816 0.935 19498
2671 1 8 . 1 1 45 45 ILE H H 45 8.938 8.938 8.450 0.488 19498
2672 1 8 . 1 1 46 46 GLU N N 46 126.745 126.745 125.253 1.492 19498
2673 1 8 . 1 1 46 46 GLU HA H 46 5.465 5.465 4.809 0.656 19498
2674 1 8 . 1 1 46 46 GLU CA C 46 53.707 53.707 54.766 -1.059 19498
2675 1 8 . 1 1 46 46 GLU CB C 46 35.276 35.276 33.084 2.192 19498
2676 1 8 . 1 1 46 46 GLU H H 46 9.097 9.097 8.693 0.404 19498
2677 1 8 . 1 1 47 47 ASP N N 47 117.988 117.988 120.820 -2.832 19498
2678 1 8 . 1 1 47 47 ASP HA H 47 4.976 4.976 4.689 0.287 19498
2679 1 8 . 1 1 47 47 ASP CA C 47 52.411 52.411 54.068 -1.657 19498
2680 1 8 . 1 1 47 47 ASP CB C 47 41.609 41.609 43.375 -1.766 19498
2681 1 8 . 1 1 47 47 ASP H H 47 8.209 8.209 8.827 -0.618 19498
2682 1 8 . 1 1 48 48 ARG N N 48 117.098 117.098 122.195 -5.097 19498
2683 1 8 . 1 1 48 48 ARG HA H 48 4.129 4.129 4.283 -0.154 19498
2684 1 8 . 1 1 48 48 ARG CA C 48 58.323 58.323 57.003 1.320 19498
2685 1 8 . 1 1 48 48 ARG CB C 48 29.511 29.511 29.014 0.497 19498
2686 1 8 . 1 1 48 48 ARG H H 48 8.872 8.872 8.853 0.019 19498
2687 1 8 . 1 1 49 49 SER N N 49 115.006 115.006 113.979 1.027 19498
2688 1 8 . 1 1 49 49 SER HA H 49 4.614 4.614 4.629 -0.015 19498
2689 1 8 . 1 1 49 49 SER CA C 49 58.411 58.411 58.226 0.185 19498
2690 1 8 . 1 1 49 49 SER CB C 49 63.806 63.806 63.788 0.018 19498
2691 1 8 . 1 1 49 49 SER H H 49 8.142 8.142 7.966 0.176 19498
2692 1 8 . 1 1 50 50 GLY N N 50 109.042 109.042 109.543 -0.501 19498
2693 1 8 . 1 1 50 50 GLY CA C 50 44.997 44.997 45.221 -0.224 19498
2694 1 8 . 1 1 50 50 GLY H H 50 8.035 8.035 7.904 0.132 19498
2695 1 8 . 1 1 51 51 ASN N N 51 119.842 119.842 120.753 -0.911 19498
2696 1 8 . 1 1 51 51 ASN HA H 51 4.546 4.546 4.660 -0.114 19498
2697 1 8 . 1 1 51 51 ASN CA C 51 53.419 53.419 53.209 0.210 19498
2698 1 8 . 1 1 51 51 ASN CB C 51 38.422 38.422 38.608 -0.186 19498
2699 1 8 . 1 1 51 51 ASN H H 51 8.613 8.613 8.188 0.425 19498
2700 1 8 . 1 1 52 52 LEU N N 52 124.085 124.085 122.723 1.362 19498
2701 1 8 . 1 1 52 52 LEU HA H 52 4.142 4.142 4.438 -0.296 19498
2702 1 8 . 1 1 52 52 LEU CA C 52 56.023 56.023 55.874 0.149 19498
2703 1 8 . 1 1 52 52 LEU CB C 52 42.353 42.353 42.433 -0.080 19498
2704 1 8 . 1 1 52 52 LEU H H 52 8.631 8.631 8.410 0.221 19498
2705 1 8 . 1 1 53 53 ILE N N 53 129.362 129.362 121.067 8.295 19498
2706 1 8 . 1 1 53 53 ILE HA H 53 4.137 4.137 4.322 -0.185 19498
2707 1 8 . 1 1 53 53 ILE CA C 53 61.800 61.800 61.652 0.148 19498
2708 1 8 . 1 1 53 53 ILE CB C 53 37.256 37.256 39.137 -1.881 19498
2709 1 8 . 1 1 53 53 ILE H H 53 9.432 9.432 8.519 0.913 19498
2710 1 8 . 1 1 54 54 ASP N N 54 113.575 113.575 118.360 -4.785 19498
2711 1 8 . 1 1 54 54 ASP HA H 54 4.847 4.847 4.951 -0.104 19498
2712 1 8 . 1 1 54 54 ASP CA C 54 53.586 53.586 54.294 -0.708 19498
2713 1 8 . 1 1 54 54 ASP CB C 54 44.500 44.500 44.423 0.076 19498
2714 1 8 . 1 1 54 54 ASP H H 54 7.761 7.761 8.396 -0.635 19498
2715 1 8 . 1 1 55 55 THR N N 55 115.783 115.783 116.072 -0.289 19498
2716 1 8 . 1 1 55 55 THR HA H 55 5.427 5.427 4.765 0.662 19498
2717 1 8 . 1 1 55 55 THR CA C 55 59.185 59.185 61.885 -2.700 19498
2718 1 8 . 1 1 55 55 THR CB C 55 70.551 70.551 71.850 -1.299 19498
2719 1 8 . 1 1 55 55 THR H H 55 10.106 10.106 8.417 1.689 19498
2720 1 8 . 1 1 56 56 SER N N 56 119.808 119.808 119.899 -0.091 19498
2721 1 8 . 1 1 56 56 SER HA H 56 4.135 4.135 4.514 -0.379 19498
2722 1 8 . 1 1 56 56 SER CA C 56 58.001 58.001 56.571 1.431 19498
2723 1 8 . 1 1 56 56 SER CB C 56 65.039 65.039 64.254 0.785 19498
2724 1 8 . 1 1 56 56 SER H H 56 7.872 7.872 8.882 -1.010 19498
2725 1 8 . 1 1 57 57 THR N N 57 117.962 117.962 121.751 -3.789 19498
2726 1 8 . 1 1 57 57 THR HA H 57 4.964 4.964 4.487 0.477 19498
2727 1 8 . 1 1 57 57 THR CA C 57 61.001 61.001 62.075 -1.074 19498
2728 1 8 . 1 1 57 57 THR CB C 57 70.881 70.881 70.301 0.580 19498
2729 1 8 . 1 1 57 57 THR H H 57 7.524 7.524 8.225 -0.701 19498
2730 1 8 . 1 1 58 58 PHE N N 58 123.853 123.853 127.543 -3.690 19498
2731 1 8 . 1 1 58 58 PHE HA H 58 4.603 4.603 4.632 -0.029 19498
2732 1 8 . 1 1 58 58 PHE CA C 58 56.648 56.648 57.597 -0.949 19498
2733 1 8 . 1 1 58 58 PHE CB C 58 43.583 43.583 39.916 3.667 19498
2734 1 8 . 1 1 58 58 PHE H H 58 8.861 8.861 8.172 0.689 19498
2735 1 8 . 1 1 59 59 TYR N N 59 117.898 117.898 122.637 -4.739 19498
2736 1 8 . 1 1 59 59 TYR HA H 59 5.328 5.328 4.818 0.510 19498
2737 1 8 . 1 1 59 59 TYR CA C 59 56.221 56.221 58.163 -1.942 19498
2738 1 8 . 1 1 59 59 TYR CB C 59 42.106 42.106 40.747 1.359 19498
2739 1 8 . 1 1 59 59 TYR H H 59 8.328 8.328 8.683 -0.355 19498
2740 1 8 . 1 1 60 60 HIS CA C 60 60.065 60.065 55.396 4.669 19498
2741 1 8 . 1 1 60 60 HIS CB C 60 34.284 34.284 31.222 3.062 19498
2742 1 8 . 1 1 61 61 HIS N N 61 121.880 121.880 119.709 2.171 19498
2743 1 8 . 1 1 61 61 HIS CA C 61 58.001 58.001 56.751 1.250 19498
2744 1 8 . 1 1 61 61 HIS CB C 61 29.999 29.999 30.571 -0.572 19498
2745 1 8 . 1 1 61 61 HIS H H 61 7.734 7.734 8.163 -0.429 19498
2746 1 8 . 1 1 62 62 ASP N N 62 128.148 128.148 119.742 8.406 19498
2747 1 8 . 1 1 62 62 ASP HA H 62 4.870 4.870 4.475 0.395 19498
2748 1 8 . 1 1 62 62 ASP CA C 62 53.348 53.348 55.173 -1.825 19498
2749 1 8 . 1 1 62 62 ASP CB C 62 42.600 42.600 42.014 0.586 19498
2750 1 8 . 1 1 62 62 ASP H H 62 11.492 11.492 8.430 3.062 19498
2751 1 8 . 1 1 63 63 GLU N N 63 126.564 126.564 122.999 3.565 19498
2752 1 8 . 1 1 63 63 GLU HA H 63 3.795 3.795 3.774 0.021 19498
2753 1 8 . 1 1 63 63 GLU CA C 63 59.863 59.863 59.448 0.415 19498
2754 1 8 . 1 1 63 63 GLU CB C 63 34.007 34.007 29.808 4.199 19498
2755 1 8 . 1 1 63 63 GLU H H 63 8.982 8.982 8.952 0.030 19498
2756 1 8 . 1 1 64 64 ASP N N 64 117.779 117.779 119.106 -1.327 19498
2757 1 8 . 1 1 64 64 ASP HA H 64 4.401 4.401 4.426 -0.025 19498
2758 1 8 . 1 1 64 64 ASP CA C 64 57.664 57.664 57.352 0.312 19498
2759 1 8 . 1 1 64 64 ASP CB C 64 40.369 40.369 40.773 -0.404 19498
2760 1 8 . 1 1 64 64 ASP H H 64 8.272 8.272 7.692 0.580 19498
2761 1 8 . 1 1 65 65 VAL N N 65 121.948 121.948 119.912 2.036 19498
2762 1 8 . 1 1 65 65 VAL HA H 65 3.386 3.386 3.929 -0.543 19498
2763 1 8 . 1 1 65 65 VAL CA C 65 65.913 65.913 65.159 0.754 19498
2764 1 8 . 1 1 65 65 VAL CB C 65 31.465 31.465 31.886 -0.421 19498
2765 1 8 . 1 1 65 65 VAL H H 65 7.335 7.335 7.977 -0.642 19498
2766 1 8 . 1 1 66 66 LEU N N 66 120.747 120.747 120.305 0.442 19498
2767 1 8 . 1 1 66 66 LEU HA H 66 3.905 3.905 3.961 -0.056 19498
2768 1 8 . 1 1 66 66 LEU CA C 66 58.076 58.076 57.870 0.206 19498
2769 1 8 . 1 1 66 66 LEU CB C 66 42.160 42.160 40.243 1.917 19498
2770 1 8 . 1 1 66 66 LEU H H 66 8.164 8.164 7.268 0.896 19498
2771 1 8 . 1 1 67 67 PHE N N 67 116.553 116.553 117.587 -1.034 19498
2772 1 8 . 1 1 67 67 PHE HA H 67 3.900 3.900 4.031 -0.131 19498
2773 1 8 . 1 1 67 67 PHE CA C 67 62.849 62.849 62.003 0.846 19498
2774 1 8 . 1 1 67 67 PHE CB C 67 38.003 38.003 37.772 0.231 19498
2775 1 8 . 1 1 67 67 PHE H H 67 8.350 8.350 7.540 0.810 19498
2776 1 8 . 1 1 68 68 ASN N N 68 121.020 121.020 118.203 2.817 19498
2777 1 8 . 1 1 68 68 ASN HA H 68 4.415 4.415 4.483 -0.068 19498
2778 1 8 . 1 1 68 68 ASN CA C 68 56.725 56.725 56.381 0.344 19498
2779 1 8 . 1 1 68 68 ASN CB C 68 38.071 38.071 38.684 -0.613 19498
2780 1 8 . 1 1 68 68 ASN H H 68 8.001 8.001 7.883 0.118 19498
2781 1 8 . 1 1 69 69 MET N N 69 120.402 120.402 119.165 1.237 19498
2782 1 8 . 1 1 69 69 MET HA H 69 4.011 4.011 4.221 -0.210 19498
2783 1 8 . 1 1 69 69 MET CA C 69 59.605 59.605 59.326 0.279 19498
2784 1 8 . 1 1 69 69 MET CB C 69 31.867 31.867 32.888 -1.021 19498
2785 1 8 . 1 1 69 69 MET H H 69 8.465 8.465 7.769 0.696 19498
2786 1 8 . 1 1 70 70 CYS N N 70 117.496 117.496 117.516 -0.020 19498
2787 1 8 . 1 1 70 70 CYS CA C 70 63.145 63.145 63.863 -0.718 19498
2788 1 8 . 1 1 70 70 CYS CB C 70 27.510 27.510 26.853 0.657 19498
2789 1 8 . 1 1 70 70 CYS H H 70 7.616 7.616 8.108 -0.492 19498
2790 1 8 . 1 1 71 71 THR N N 71 118.640 118.640 115.295 3.345 19498
2791 1 8 . 1 1 71 71 THR HA H 71 4.270 4.270 4.214 0.056 19498
2792 1 8 . 1 1 71 71 THR CA C 71 67.980 67.980 66.380 1.600 19498
2793 1 8 . 1 1 71 71 THR CB C 71 67.949 67.949 68.743 -0.794 19498
2794 1 8 . 1 1 71 71 THR H H 71 8.509 8.509 7.968 0.541 19498
2795 1 8 . 1 1 72 72 ASP HA H 72 4.430 4.430 4.521 -0.091 19498
2796 1 8 . 1 1 72 72 ASP CA C 72 57.590 57.590 57.658 -0.068 19498
2797 1 8 . 1 1 72 72 ASP CB C 72 40.415 40.415 41.007 -0.592 19498
2798 1 8 . 1 1 73 73 TRP N N 73 121.657 121.657 121.025 0.632 19498
2799 1 8 . 1 1 73 73 TRP HA H 73 4.407 4.407 4.456 -0.049 19498
2800 1 8 . 1 1 73 73 TRP CA C 73 62.951 62.951 61.923 1.028 19498
2801 1 8 . 1 1 73 73 TRP CB C 73 29.114 29.114 29.978 -0.864 19498
2802 1 8 . 1 1 73 73 TRP H H 73 7.780 7.780 7.633 0.147 19498
2803 1 8 . 1 1 74 74 LEU N N 74 118.727 118.727 118.863 -0.136 19498
2804 1 8 . 1 1 74 74 LEU HA H 74 3.582 3.582 3.896 -0.314 19498
2805 1 8 . 1 1 74 74 LEU CA C 74 58.184 58.184 57.794 0.390 19498
2806 1 8 . 1 1 74 74 LEU CB C 74 37.610 37.610 41.727 -4.117 19498
2807 1 8 . 1 1 74 74 LEU H H 74 8.490 8.490 7.793 0.697 19498
2808 1 8 . 1 1 75 75 ASN N N 75 117.962 117.962 116.960 1.002 19498
2809 1 8 . 1 1 75 75 ASN HA H 75 4.527 4.527 4.632 -0.105 19498
2810 1 8 . 1 1 75 75 ASN CA C 75 56.501 56.501 56.264 0.237 19498
2811 1 8 . 1 1 75 75 ASN CB C 75 37.999 37.999 38.792 -0.793 19498
2812 1 8 . 1 1 75 75 ASN H H 75 8.639 8.639 8.370 0.269 19498
2813 1 8 . 1 1 76 76 HIS N N 76 120.823 120.823 119.108 1.715 19498
2814 1 8 . 1 1 76 76 HIS HA H 76 4.450 4.450 4.191 0.259 19498
2815 1 8 . 1 1 76 76 HIS CA C 76 58.737 58.737 59.193 -0.456 19498
2816 1 8 . 1 1 76 76 HIS CB C 76 28.007 28.007 29.769 -1.762 19498
2817 1 8 . 1 1 76 76 HIS H H 76 8.158 8.158 7.697 0.461 19498
2818 1 8 . 1 1 77 77 MET N N 77 118.749 118.749 114.836 3.913 19498
2819 1 8 . 1 1 77 77 MET HA H 77 4.071 4.071 3.883 0.188 19498
2820 1 8 . 1 1 77 77 MET CA C 77 55.827 55.827 57.547 -1.720 19498
2821 1 8 . 1 1 77 77 MET CB C 77 29.541 29.541 31.895 -2.354 19498
2822 1 8 . 1 1 77 77 MET H H 77 8.404 8.404 7.258 1.146 19498
2823 1 8 . 1 1 78 78 TYR N N 78 120.762 120.762 120.366 0.396 19498
2824 1 8 . 1 1 78 78 TYR HA H 78 3.662 3.662 3.988 -0.326 19498
2825 1 8 . 1 1 78 78 TYR CA C 78 62.640 62.640 61.877 0.763 19498
2826 1 8 . 1 1 78 78 TYR CB C 78 37.545 37.545 37.876 -0.331 19498
2827 1 8 . 1 1 78 78 TYR H H 78 8.322 8.322 7.582 0.740 19498
2828 1 8 . 1 1 79 79 ASP N N 79 116.578 116.578 116.288 0.290 19498
2829 1 8 . 1 1 79 79 ASP HA H 79 4.106 4.106 4.275 -0.169 19498
2830 1 8 . 1 1 79 79 ASP CA C 79 57.410 57.410 56.274 1.136 19498
2831 1 8 . 1 1 79 79 ASP CB C 79 40.503 40.503 40.243 0.260 19498
2832 1 8 . 1 1 79 79 ASP H H 79 7.460 7.460 7.959 -0.499 19498
2833 1 8 . 1 1 80 80 GLN N N 80 116.175 116.175 121.148 -4.973 19498
2834 1 8 . 1 1 80 80 GLN HA H 80 4.056 4.056 3.907 0.149 19498
2835 1 8 . 1 1 80 80 GLN CA C 80 57.629 57.629 58.309 -0.680 19498
2836 1 8 . 1 1 80 80 GLN CB C 80 29.662 29.662 28.724 0.939 19498
2837 1 8 . 1 1 80 80 GLN H H 80 7.552 7.552 7.636 -0.084 19498
2838 1 8 . 1 1 81 81 LEU N N 81 118.398 118.398 116.905 1.493 19498
2839 1 8 . 1 1 81 81 LEU HA H 81 4.233 4.233 4.443 -0.210 19498
2840 1 8 . 1 1 81 81 LEU CA C 81 55.461 55.461 56.283 -0.822 19498
2841 1 8 . 1 1 81 81 LEU CB C 81 42.406 42.406 41.730 0.676 19498
2842 1 8 . 1 1 81 81 LEU H H 81 7.957 7.957 7.681 0.276 19498
2843 1 8 . 1 1 82 82 LYS N N 82 119.114 119.114 117.999 1.115 19498
2844 1 8 . 1 1 82 82 LYS HA H 82 3.841 3.841 4.245 -0.404 19498
2845 1 8 . 1 1 82 82 LYS CA C 82 58.510 58.510 57.582 0.928 19498
2846 1 8 . 1 1 82 82 LYS CB C 82 30.922 30.922 32.528 -1.606 19498
2847 1 8 . 1 1 82 82 LYS H H 82 7.664 7.664 7.450 0.214 19498
2848 1 8 . 1 1 83 83 ASP N N 83 118.655 118.655 119.620 -0.965 19498
2849 1 8 . 1 1 83 83 ASP HA H 83 4.819 4.819 4.319 0.500 19498
2850 1 8 . 1 1 83 83 ASP CA C 83 53.886 53.886 55.278 -1.392 19498
2851 1 8 . 1 1 83 83 ASP CB C 83 40.986 40.986 40.829 0.157 19498
2852 1 8 . 1 1 83 83 ASP H H 83 7.862 7.862 7.449 0.413 19498
2853 1 8 . 1 1 84 84 TRP N N 84 121.757 121.757 121.108 0.649 19498
2854 1 8 . 1 1 84 84 TRP CA C 84 58.462 58.462 56.330 2.132 19498
2855 1 8 . 1 1 84 84 TRP CB C 84 28.934 28.934 29.164 -0.230 19498
2856 1 8 . 1 1 84 84 TRP H H 84 7.925 7.925 7.399 0.526 19498
2857 1 9 . 1 1 6 6 SER CA C 6 56.008 56.008 59.498 -3.490 19498
2858 1 9 . 1 1 7 7 GLY N N 7 109.496 109.496 110.079 -0.583 19498
2859 1 9 . 1 1 7 7 GLY CA C 7 46.042 46.042 44.622 1.420 19498
2860 1 9 . 1 1 7 7 GLY H H 7 8.432 8.432 8.396 0.036 19498
2861 1 9 . 1 1 8 8 ASN N N 8 119.432 119.432 118.174 1.258 19498
2862 1 9 . 1 1 8 8 ASN HA H 8 4.685 4.685 4.575 0.110 19498
2863 1 9 . 1 1 8 8 ASN CA C 8 53.922 53.922 53.018 0.904 19498
2864 1 9 . 1 1 8 8 ASN CB C 8 37.970 37.970 38.931 -0.961 19498
2865 1 9 . 1 1 8 8 ASN H H 8 8.367 8.367 7.460 0.907 19498
2866 1 9 . 1 1 9 9 LEU N N 9 123.537 123.537 120.495 3.042 19498
2867 1 9 . 1 1 9 9 LEU HA H 9 3.984 3.984 4.129 -0.145 19498
2868 1 9 . 1 1 9 9 LEU CA C 9 56.417 56.417 55.885 0.532 19498
2869 1 9 . 1 1 9 9 LEU CB C 9 41.566 41.566 41.048 0.518 19498
2870 1 9 . 1 1 9 9 LEU H H 9 7.922 7.922 8.011 -0.089 19498
2871 1 9 . 1 1 10 10 ALA N N 10 122.287 122.287 123.845 -1.558 19498
2872 1 9 . 1 1 10 10 ALA HA H 10 4.127 4.127 4.041 0.086 19498
2873 1 9 . 1 1 10 10 ALA CA C 10 55.912 55.912 55.030 0.882 19498
2874 1 9 . 1 1 10 10 ALA CB C 10 17.998 17.998 18.030 -0.032 19498
2875 1 9 . 1 1 10 10 ALA H H 10 8.064 8.064 8.090 -0.026 19498
2876 1 9 . 1 1 11 11 ALA N N 11 121.326 121.326 119.798 1.528 19498
2877 1 9 . 1 1 11 11 ALA HA H 11 4.207 4.207 4.262 -0.055 19498
2878 1 9 . 1 1 11 11 ALA CA C 11 54.960 54.960 53.871 1.089 19498
2879 1 9 . 1 1 11 11 ALA CB C 11 17.998 17.998 18.522 -0.524 19498
2880 1 9 . 1 1 11 11 ALA H H 11 8.143 8.143 7.837 0.306 19498
2881 1 9 . 1 1 12 12 PHE N N 12 122.913 122.913 119.792 3.121 19498
2882 1 9 . 1 1 12 12 PHE HA H 12 4.411 4.411 4.058 0.353 19498
2883 1 9 . 1 1 12 12 PHE CA C 12 61.007 61.007 61.609 -0.602 19498
2884 1 9 . 1 1 12 12 PHE CB C 12 39.499 39.499 39.329 0.170 19498
2885 1 9 . 1 1 12 12 PHE H H 12 7.779 7.779 7.839 -0.060 19498
2886 1 9 . 1 1 13 13 LYS N N 13 120.689 120.689 117.830 2.859 19498
2887 1 9 . 1 1 13 13 LYS HA H 13 3.861 3.861 4.067 -0.206 19498
2888 1 9 . 1 1 13 13 LYS CA C 13 59.099 59.099 58.778 0.321 19498
2889 1 9 . 1 1 13 13 LYS CB C 13 31.867 31.867 31.746 0.121 19498
2890 1 9 . 1 1 13 13 LYS H H 13 8.614 8.614 8.416 0.198 19498
2891 1 9 . 1 1 14 14 ALA N N 14 122.076 122.076 120.489 1.587 19498
2892 1 9 . 1 1 14 14 ALA HA H 14 3.182 3.182 4.182 -1.000 19498
2893 1 9 . 1 1 14 14 ALA CA C 14 55.108 55.108 54.562 0.546 19498
2894 1 9 . 1 1 14 14 ALA CB C 14 18.120 18.120 18.227 -0.107 19498
2895 1 9 . 1 1 14 14 ALA H H 14 8.178 8.178 7.493 0.685 19498
2896 1 9 . 1 1 15 15 ALA N N 15 121.714 121.714 119.746 1.968 19498
2897 1 9 . 1 1 15 15 ALA HA H 15 4.040 4.040 4.031 0.009 19498
2898 1 9 . 1 1 15 15 ALA CA C 15 55.158 55.158 54.267 0.890 19498
2899 1 9 . 1 1 15 15 ALA CB C 15 19.042 19.042 18.213 0.829 19498
2900 1 9 . 1 1 15 15 ALA H H 15 7.793 7.793 7.736 0.057 19498
2901 1 9 . 1 1 16 16 THR N N 16 111.959 111.959 114.372 -2.413 19498
2902 1 9 . 1 1 16 16 THR HA H 16 3.705 3.705 3.860 -0.155 19498
2903 1 9 . 1 1 16 16 THR CA C 16 66.762 66.762 67.653 -0.890 19498
2904 1 9 . 1 1 16 16 THR CB C 16 68.213 68.213 68.420 -0.207 19498
2905 1 9 . 1 1 16 16 THR H H 16 8.133 8.133 7.472 0.661 19498
2906 1 9 . 1 1 17 17 ASN N N 17 121.090 121.090 117.962 3.128 19498
2907 1 9 . 1 1 17 17 ASN HA H 17 4.520 4.520 4.529 -0.009 19498
2908 1 9 . 1 1 17 17 ASN CA C 17 56.191 56.191 55.476 0.715 19498
2909 1 9 . 1 1 17 17 ASN CB C 17 38.365 38.365 38.575 -0.210 19498
2910 1 9 . 1 1 17 17 ASN H H 17 8.152 8.152 8.031 0.121 19498
2911 1 9 . 1 1 18 18 LYS N N 18 119.978 119.978 119.172 0.806 19498
2912 1 9 . 1 1 18 18 LYS HA H 18 3.914 3.914 4.168 -0.254 19498
2913 1 9 . 1 1 18 18 LYS CA C 18 59.865 59.865 57.978 1.887 19498
2914 1 9 . 1 1 18 18 LYS CB C 18 30.999 30.999 31.983 -0.984 19498
2915 1 9 . 1 1 18 18 LYS H H 18 7.568 7.568 7.788 -0.220 19498
2916 1 9 . 1 1 19 19 LEU N N 19 117.558 117.558 120.407 -2.849 19498
2917 1 9 . 1 1 19 19 LEU HA H 19 4.135 4.135 4.181 -0.046 19498
2918 1 9 . 1 1 19 19 LEU CA C 19 58.001 58.001 57.948 0.053 19498
2919 1 9 . 1 1 19 19 LEU CB C 19 40.823 40.823 41.723 -0.900 19498
2920 1 9 . 1 1 19 19 LEU H H 19 7.001 7.001 7.650 -0.649 19498
2921 1 9 . 1 1 20 20 PHE N N 20 121.123 121.123 117.575 3.548 19498
2922 1 9 . 1 1 20 20 PHE HA H 20 4.873 4.873 4.201 0.672 19498
2923 1 9 . 1 1 20 20 PHE CA C 20 60.375 60.375 60.669 -0.294 19498
2924 1 9 . 1 1 20 20 PHE CB C 20 38.480 38.480 39.209 -0.729 19498
2925 1 9 . 1 1 20 20 PHE H H 20 8.193 8.193 7.677 0.516 19498
2926 1 9 . 1 1 21 21 GLN N N 21 118.591 118.591 116.108 2.483 19498
2927 1 9 . 1 1 21 21 GLN HA H 21 4.208 4.208 4.232 -0.024 19498
2928 1 9 . 1 1 21 21 GLN CA C 21 58.055 58.055 57.005 1.050 19498
2929 1 9 . 1 1 21 21 GLN CB C 21 28.284 28.284 28.987 -0.703 19498
2930 1 9 . 1 1 21 21 GLN H H 21 7.918 7.918 8.042 -0.124 19498
2931 1 9 . 1 1 22 22 LEU N N 22 118.477 118.477 119.484 -1.007 19498
2932 1 9 . 1 1 22 22 LEU HA H 22 4.534 4.534 4.449 0.085 19498
2933 1 9 . 1 1 22 22 LEU CA C 22 54.033 54.033 54.900 -0.867 19498
2934 1 9 . 1 1 22 22 LEU CB C 22 41.469 41.469 43.665 -2.196 19498
2935 1 9 . 1 1 22 22 LEU H H 22 7.561 7.561 7.556 0.005 19498
2936 1 9 . 1 1 23 23 ASP N N 23 115.410 115.410 118.527 -3.117 19498
2937 1 9 . 1 1 23 23 ASP HA H 23 4.280 4.280 4.154 0.126 19498
2938 1 9 . 1 1 23 23 ASP CA C 23 55.494 55.494 55.605 -0.111 19498
2939 1 9 . 1 1 23 23 ASP CB C 23 39.317 39.317 38.788 0.529 19498
2940 1 9 . 1 1 23 23 ASP H H 23 8.163 8.163 8.000 0.163 19498
2941 1 9 . 1 1 24 24 LEU N N 24 116.367 116.367 114.760 1.607 19498
2942 1 9 . 1 1 24 24 LEU HA H 24 4.790 4.790 4.794 -0.004 19498
2943 1 9 . 1 1 24 24 LEU CA C 24 53.030 53.030 53.427 -0.397 19498
2944 1 9 . 1 1 24 24 LEU CB C 24 43.867 43.867 43.744 0.123 19498
2945 1 9 . 1 1 24 24 LEU H H 24 7.136 7.136 7.372 -0.236 19498
2946 1 9 . 1 1 25 25 ALA N N 25 123.243 123.243 121.307 1.936 19498
2947 1 9 . 1 1 25 25 ALA HA H 25 4.480 4.480 4.747 -0.267 19498
2948 1 9 . 1 1 25 25 ALA CA C 25 50.890 50.890 51.634 -0.744 19498
2949 1 9 . 1 1 25 25 ALA CB C 25 21.655 21.655 21.449 0.206 19498
2950 1 9 . 1 1 25 25 ALA H H 25 8.931 8.931 8.396 0.535 19498
2951 1 9 . 1 1 26 26 VAL N N 26 119.587 119.587 119.899 -0.312 19498
2952 1 9 . 1 1 26 26 VAL HA H 26 4.889 4.889 4.511 0.378 19498
2953 1 9 . 1 1 26 26 VAL CA C 26 61.278 61.278 62.110 -0.832 19498
2954 1 9 . 1 1 26 26 VAL CB C 26 33.310 33.310 35.016 -1.706 19498
2955 1 9 . 1 1 26 26 VAL H H 26 7.575 7.575 8.264 -0.689 19498
2956 1 9 . 1 1 27 27 ILE N N 27 130.377 130.377 126.287 4.090 19498
2957 1 9 . 1 1 27 27 ILE HA H 27 4.489 4.489 4.884 -0.395 19498
2958 1 9 . 1 1 27 27 ILE CA C 27 60.177 60.177 59.916 0.261 19498
2959 1 9 . 1 1 27 27 ILE CB C 27 40.019 40.019 40.676 -0.657 19498
2960 1 9 . 1 1 27 27 ILE H H 27 9.437 9.437 8.311 1.126 19498
2961 1 9 . 1 1 28 28 TYR N N 28 126.844 126.844 120.219 6.625 19498
2962 1 9 . 1 1 28 28 TYR HA H 28 5.709 5.709 5.626 0.083 19498
2963 1 9 . 1 1 28 28 TYR CA C 28 55.486 55.486 54.988 0.498 19498
2964 1 9 . 1 1 28 28 TYR CB C 28 42.019 42.019 41.004 1.015 19498
2965 1 9 . 1 1 28 28 TYR H H 28 8.531 8.531 8.282 0.249 19498
2966 1 9 . 1 1 29 29 ASP N N 29 122.875 122.875 121.990 0.885 19498
2967 1 9 . 1 1 29 29 ASP HA H 29 4.966 4.966 4.764 0.202 19498
2968 1 9 . 1 1 29 29 ASP CA C 29 53.659 53.659 53.747 -0.088 19498
2969 1 9 . 1 1 29 29 ASP CB C 29 44.660 44.660 42.803 1.857 19498
2970 1 9 . 1 1 29 29 ASP H H 29 8.614 8.614 8.575 0.039 19498
2971 1 9 . 1 1 30 30 ASP N N 30 119.325 119.325 123.834 -4.509 19498
2972 1 9 . 1 1 30 30 ASP HA H 30 5.447 5.447 4.522 0.925 19498
2973 1 9 . 1 1 30 30 ASP CA C 30 53.501 53.501 53.492 0.009 19498
2974 1 9 . 1 1 30 30 ASP CB C 30 43.921 43.921 42.286 1.635 19498
2975 1 9 . 1 1 30 30 ASP H H 30 8.607 8.607 8.108 0.499 19498
2976 1 9 . 1 1 31 31 TRP N N 31 120.552 120.552 119.332 1.220 19498
2977 1 9 . 1 1 31 31 TRP HA H 31 4.615 4.615 4.867 -0.252 19498
2978 1 9 . 1 1 31 31 TRP CA C 31 58.000 58.000 56.943 1.057 19498
2979 1 9 . 1 1 31 31 TRP CB C 31 31.500 31.500 29.502 1.998 19498
2980 1 9 . 1 1 31 31 TRP H H 31 8.673 8.673 7.882 0.791 19498
2981 1 9 . 1 1 32 32 TYR CA C 32 52.400 52.400 58.693 -6.293 19498
2982 1 9 . 1 1 32 32 TYR CB C 32 42.350 42.350 39.362 2.988 19498
2983 1 9 . 1 1 33 33 ASP CA C 33 52.400 52.400 55.329 -2.929 19498
2984 1 9 . 1 1 33 33 ASP CB C 33 42.350 42.350 39.555 2.795 19498
2985 1 9 . 1 1 34 34 ALA N N 34 126.709 126.709 120.787 5.922 19498
2986 1 9 . 1 1 34 34 ALA HA H 34 3.845 3.845 4.802 -0.957 19498
2987 1 9 . 1 1 34 34 ALA CA C 34 58.599 58.599 50.566 8.033 19498
2988 1 9 . 1 1 34 34 ALA CB C 34 18.610 18.610 19.918 -1.308 19498
2989 1 9 . 1 1 34 34 ALA H H 34 8.424 8.424 7.966 0.458 19498
2990 1 9 . 1 1 35 35 TYR N N 35 117.123 117.123 122.913 -5.790 19498
2991 1 9 . 1 1 35 35 TYR HA H 35 4.350 4.350 4.186 0.164 19498
2992 1 9 . 1 1 35 35 TYR CA C 35 60.466 60.466 59.988 0.478 19498
2993 1 9 . 1 1 35 35 TYR CB C 35 38.113 38.113 37.485 0.628 19498
2994 1 9 . 1 1 35 35 TYR H H 35 8.334 8.334 9.214 -0.880 19498
2995 1 9 . 1 1 36 36 THR N N 36 108.046 108.046 112.686 -4.640 19498
2996 1 9 . 1 1 36 36 THR HA H 36 4.018 4.018 4.106 -0.088 19498
2997 1 9 . 1 1 36 36 THR CA C 36 61.809 61.809 61.434 0.375 19498
2998 1 9 . 1 1 36 36 THR CB C 36 69.926 69.926 68.528 1.399 19498
2999 1 9 . 1 1 36 36 THR H H 36 7.563 7.563 7.336 0.227 19498
3000 1 9 . 1 1 37 37 ARG N N 37 118.456 118.456 122.423 -3.967 19498
3001 1 9 . 1 1 37 37 ARG CA C 37 57.001 57.001 54.663 2.338 19498
3002 1 9 . 1 1 37 37 ARG H H 37 7.952 7.952 7.737 0.215 19498
3003 1 9 . 1 1 40 40 CYS CA C 40 56.316 56.316 58.854 -2.538 19498
3004 1 9 . 1 1 40 40 CYS CB C 40 29.999 29.999 29.605 0.394 19498
3005 1 9 . 1 1 41 41 ILE N N 41 121.419 121.419 123.872 -2.453 19498
3006 1 9 . 1 1 41 41 ILE HA H 41 4.709 4.709 4.484 0.225 19498
3007 1 9 . 1 1 41 41 ILE CA C 41 60.462 60.462 60.174 0.288 19498
3008 1 9 . 1 1 41 41 ILE CB C 41 42.309 42.309 38.379 3.930 19498
3009 1 9 . 1 1 41 41 ILE H H 41 8.459 8.459 7.978 0.481 19498
3010 1 9 . 1 1 42 42 ARG N N 42 127.916 127.916 127.159 0.757 19498
3011 1 9 . 1 1 42 42 ARG CA C 42 54.501 54.501 54.761 -0.261 19498
3012 1 9 . 1 1 42 42 ARG CB C 42 33.204 33.204 32.606 0.598 19498
3013 1 9 . 1 1 42 42 ARG H H 42 9.004 9.004 8.366 0.638 19498
3014 1 9 . 1 1 43 43 LEU N N 43 124.715 124.715 126.409 -1.694 19498
3015 1 9 . 1 1 43 43 LEU HA H 43 5.538 5.538 4.727 0.811 19498
3016 1 9 . 1 1 43 43 LEU CA C 43 53.266 53.266 53.994 -0.728 19498
3017 1 9 . 1 1 43 43 LEU CB C 43 46.163 46.163 44.199 1.964 19498
3018 1 9 . 1 1 43 43 LEU H H 43 8.757 8.757 8.806 -0.049 19498
3019 1 9 . 1 1 44 44 ARG N N 44 123.499 123.499 127.951 -4.452 19498
3020 1 9 . 1 1 44 44 ARG HA H 44 5.004 5.004 4.913 0.091 19498
3021 1 9 . 1 1 44 44 ARG CA C 44 55.508 55.508 54.715 0.793 19498
3022 1 9 . 1 1 44 44 ARG CB C 44 34.543 34.543 32.814 1.729 19498
3023 1 9 . 1 1 44 44 ARG H H 44 9.366 9.366 9.084 0.282 19498
3024 1 9 . 1 1 45 45 ILE N N 45 122.919 122.919 127.785 -4.866 19498
3025 1 9 . 1 1 45 45 ILE HA H 45 5.260 5.260 4.576 0.684 19498
3026 1 9 . 1 1 45 45 ILE CA C 45 59.933 59.933 58.862 1.071 19498
3027 1 9 . 1 1 45 45 ILE CB C 45 39.751 39.751 38.792 0.959 19498
3028 1 9 . 1 1 45 45 ILE H H 45 8.938 8.938 8.581 0.357 19498
3029 1 9 . 1 1 46 46 GLU N N 46 126.745 126.745 126.280 0.465 19498
3030 1 9 . 1 1 46 46 GLU HA H 46 5.465 5.465 5.094 0.371 19498
3031 1 9 . 1 1 46 46 GLU CA C 46 53.707 53.707 54.219 -0.513 19498
3032 1 9 . 1 1 46 46 GLU CB C 46 35.276 35.276 32.147 3.129 19498
3033 1 9 . 1 1 46 46 GLU H H 46 9.097 9.097 8.724 0.373 19498
3034 1 9 . 1 1 47 47 ASP N N 47 117.988 117.988 119.350 -1.362 19498
3035 1 9 . 1 1 47 47 ASP HA H 47 4.976 4.976 4.971 0.005 19498
3036 1 9 . 1 1 47 47 ASP CA C 47 52.411 52.411 52.020 0.391 19498
3037 1 9 . 1 1 47 47 ASP CB C 47 41.609 41.609 43.935 -2.326 19498
3038 1 9 . 1 1 47 47 ASP H H 47 8.209 8.209 8.170 0.039 19498
3039 1 9 . 1 1 48 48 ARG N N 48 117.098 117.098 123.877 -6.779 19498
3040 1 9 . 1 1 48 48 ARG HA H 48 4.129 4.129 4.412 -0.283 19498
3041 1 9 . 1 1 48 48 ARG CA C 48 58.323 58.323 56.731 1.592 19498
3042 1 9 . 1 1 48 48 ARG CB C 48 29.511 29.511 28.638 0.873 19498
3043 1 9 . 1 1 48 48 ARG H H 48 8.872 8.872 8.641 0.231 19498
3044 1 9 . 1 1 49 49 SER N N 49 115.006 115.006 115.041 -0.035 19498
3045 1 9 . 1 1 49 49 SER HA H 49 4.614 4.614 4.581 0.033 19498
3046 1 9 . 1 1 49 49 SER CA C 49 58.411 58.411 57.748 0.663 19498
3047 1 9 . 1 1 49 49 SER CB C 49 63.806 63.806 63.286 0.520 19498
3048 1 9 . 1 1 49 49 SER H H 49 8.142 8.142 7.745 0.397 19498
3049 1 9 . 1 1 50 50 GLY N N 50 109.042 109.042 109.770 -0.728 19498
3050 1 9 . 1 1 50 50 GLY CA C 50 44.997 44.997 45.307 -0.310 19498
3051 1 9 . 1 1 50 50 GLY H H 50 8.035 8.035 7.954 0.081 19498
3052 1 9 . 1 1 51 51 ASN N N 51 119.842 119.842 117.711 2.131 19498
3053 1 9 . 1 1 51 51 ASN HA H 51 4.546 4.546 4.944 -0.398 19498
3054 1 9 . 1 1 51 51 ASN CA C 51 53.419 53.419 52.335 1.084 19498
3055 1 9 . 1 1 51 51 ASN CB C 51 38.422 38.422 42.051 -3.629 19498
3056 1 9 . 1 1 51 51 ASN H H 51 8.613 8.613 7.963 0.650 19498
3057 1 9 . 1 1 52 52 LEU N N 52 124.085 124.085 122.232 1.853 19498
3058 1 9 . 1 1 52 52 LEU HA H 52 4.142 4.142 4.593 -0.451 19498
3059 1 9 . 1 1 52 52 LEU CA C 52 56.023 56.023 54.644 1.379 19498
3060 1 9 . 1 1 52 52 LEU CB C 52 42.353 42.353 43.165 -0.812 19498
3061 1 9 . 1 1 52 52 LEU H H 52 8.631 8.631 8.508 0.123 19498
3062 1 9 . 1 1 53 53 ILE N N 53 129.362 129.362 123.499 5.863 19498
3063 1 9 . 1 1 53 53 ILE HA H 53 4.137 4.137 4.419 -0.282 19498
3064 1 9 . 1 1 53 53 ILE CA C 53 61.800 61.800 61.627 0.173 19498
3065 1 9 . 1 1 53 53 ILE CB C 53 37.256 37.256 39.079 -1.823 19498
3066 1 9 . 1 1 53 53 ILE H H 53 9.432 9.432 8.554 0.878 19498
3067 1 9 . 1 1 54 54 ASP N N 54 113.575 113.575 118.092 -4.517 19498
3068 1 9 . 1 1 54 54 ASP HA H 54 4.847 4.847 5.022 -0.175 19498
3069 1 9 . 1 1 54 54 ASP CA C 54 53.586 53.586 54.205 -0.619 19498
3070 1 9 . 1 1 54 54 ASP CB C 54 44.500 44.500 44.916 -0.416 19498
3071 1 9 . 1 1 54 54 ASP H H 54 7.761 7.761 8.416 -0.655 19498
3072 1 9 . 1 1 55 55 THR N N 55 115.783 115.783 115.742 0.041 19498
3073 1 9 . 1 1 55 55 THR HA H 55 5.427 5.427 5.061 0.366 19498
3074 1 9 . 1 1 55 55 THR CA C 55 59.185 59.185 61.674 -2.489 19498
3075 1 9 . 1 1 55 55 THR CB C 55 70.551 70.551 71.785 -1.234 19498
3076 1 9 . 1 1 55 55 THR H H 55 10.106 10.106 8.435 1.671 19498
3077 1 9 . 1 1 56 56 SER N N 56 119.808 119.808 118.295 1.513 19498
3078 1 9 . 1 1 56 56 SER HA H 56 4.135 4.135 4.615 -0.480 19498
3079 1 9 . 1 1 56 56 SER CA C 56 58.001 58.001 57.461 0.540 19498
3080 1 9 . 1 1 56 56 SER CB C 56 65.039 65.039 66.209 -1.170 19498
3081 1 9 . 1 1 56 56 SER H H 56 7.872 7.872 8.386 -0.514 19498
3082 1 9 . 1 1 57 57 THR N N 57 117.962 117.962 118.060 -0.098 19498
3083 1 9 . 1 1 57 57 THR HA H 57 4.964 4.964 4.737 0.227 19498
3084 1 9 . 1 1 57 57 THR CA C 57 61.001 61.001 61.976 -0.975 19498
3085 1 9 . 1 1 57 57 THR CB C 57 70.881 70.881 69.838 1.043 19498
3086 1 9 . 1 1 57 57 THR H H 57 7.524 7.524 8.052 -0.528 19498
3087 1 9 . 1 1 58 58 PHE N N 58 123.853 123.853 127.937 -4.084 19498
3088 1 9 . 1 1 58 58 PHE HA H 58 4.603 4.603 4.607 -0.004 19498
3089 1 9 . 1 1 58 58 PHE CA C 58 56.648 56.648 57.416 -0.768 19498
3090 1 9 . 1 1 58 58 PHE CB C 58 43.583 43.583 40.212 3.371 19498
3091 1 9 . 1 1 58 58 PHE H H 58 8.861 8.861 9.347 -0.486 19498
3092 1 9 . 1 1 59 59 TYR N N 59 117.898 117.898 119.277 -1.379 19498
3093 1 9 . 1 1 59 59 TYR HA H 59 5.328 5.328 5.013 0.315 19498
3094 1 9 . 1 1 59 59 TYR CA C 59 56.221 56.221 57.067 -0.846 19498
3095 1 9 . 1 1 59 59 TYR CB C 59 42.106 42.106 39.908 2.198 19498
3096 1 9 . 1 1 59 59 TYR H H 59 8.328 8.328 8.479 -0.151 19498
3097 1 9 . 1 1 60 60 HIS CA C 60 60.065 60.065 55.721 4.344 19498
3098 1 9 . 1 1 60 60 HIS CB C 60 34.284 34.284 31.249 3.035 19498
3099 1 9 . 1 1 61 61 HIS N N 61 121.880 121.880 119.387 2.493 19498
3100 1 9 . 1 1 61 61 HIS CA C 61 58.001 58.001 56.478 1.523 19498
3101 1 9 . 1 1 61 61 HIS CB C 61 29.999 29.999 30.583 -0.584 19498
3102 1 9 . 1 1 61 61 HIS H H 61 7.734 7.734 7.688 0.046 19498
3103 1 9 . 1 1 62 62 ASP N N 62 128.148 128.148 120.106 8.042 19498
3104 1 9 . 1 1 62 62 ASP HA H 62 4.870 4.870 4.353 0.517 19498
3105 1 9 . 1 1 62 62 ASP CA C 62 53.348 53.348 55.076 -1.728 19498
3106 1 9 . 1 1 62 62 ASP CB C 62 42.600 42.600 41.894 0.706 19498
3107 1 9 . 1 1 62 62 ASP H H 62 11.492 11.492 7.976 3.516 19498
3108 1 9 . 1 1 63 63 GLU N N 63 126.564 126.564 124.423 2.141 19498
3109 1 9 . 1 1 63 63 GLU HA H 63 3.795 3.795 3.949 -0.154 19498
3110 1 9 . 1 1 63 63 GLU CA C 63 59.863 59.863 59.475 0.388 19498
3111 1 9 . 1 1 63 63 GLU CB C 63 34.007 34.007 29.168 4.839 19498
3112 1 9 . 1 1 63 63 GLU H H 63 8.982 8.982 8.871 0.111 19498
3113 1 9 . 1 1 64 64 ASP N N 64 117.779 117.779 120.699 -2.920 19498
3114 1 9 . 1 1 64 64 ASP HA H 64 4.401 4.401 4.371 0.030 19498
3115 1 9 . 1 1 64 64 ASP CA C 64 57.664 57.664 57.260 0.404 19498
3116 1 9 . 1 1 64 64 ASP CB C 64 40.369 40.369 40.883 -0.514 19498
3117 1 9 . 1 1 64 64 ASP H H 64 8.272 8.272 8.107 0.165 19498
3118 1 9 . 1 1 65 65 VAL N N 65 121.948 121.948 119.701 2.247 19498
3119 1 9 . 1 1 65 65 VAL HA H 65 3.386 3.386 3.960 -0.574 19498
3120 1 9 . 1 1 65 65 VAL CA C 65 65.913 65.913 65.187 0.726 19498
3121 1 9 . 1 1 65 65 VAL CB C 65 31.465 31.465 31.912 -0.447 19498
3122 1 9 . 1 1 65 65 VAL H H 65 7.335 7.335 7.826 -0.491 19498
3123 1 9 . 1 1 66 66 LEU N N 66 120.747 120.747 121.633 -0.886 19498
3124 1 9 . 1 1 66 66 LEU HA H 66 3.905 3.905 3.989 -0.084 19498
3125 1 9 . 1 1 66 66 LEU CA C 66 58.076 58.076 58.207 -0.131 19498
3126 1 9 . 1 1 66 66 LEU CB C 66 42.160 42.160 40.700 1.460 19498
3127 1 9 . 1 1 66 66 LEU H H 66 8.164 8.164 7.344 0.820 19498
3128 1 9 . 1 1 67 67 PHE N N 67 116.553 116.553 115.602 0.951 19498
3129 1 9 . 1 1 67 67 PHE HA H 67 3.900 3.900 4.213 -0.313 19498
3130 1 9 . 1 1 67 67 PHE CA C 67 62.849 62.849 61.091 1.758 19498
3131 1 9 . 1 1 67 67 PHE CB C 67 38.003 38.003 38.179 -0.176 19498
3132 1 9 . 1 1 67 67 PHE H H 67 8.350 8.350 8.201 0.149 19498
3133 1 9 . 1 1 68 68 ASN N N 68 121.020 121.020 118.792 2.228 19498
3134 1 9 . 1 1 68 68 ASN HA H 68 4.415 4.415 4.454 -0.039 19498
3135 1 9 . 1 1 68 68 ASN CA C 68 56.725 56.725 56.128 0.597 19498
3136 1 9 . 1 1 68 68 ASN CB C 68 38.071 38.071 38.355 -0.284 19498
3137 1 9 . 1 1 68 68 ASN H H 68 8.001 8.001 7.806 0.195 19498
3138 1 9 . 1 1 69 69 MET N N 69 120.402 120.402 118.609 1.793 19498
3139 1 9 . 1 1 69 69 MET HA H 69 4.011 4.011 4.209 -0.198 19498
3140 1 9 . 1 1 69 69 MET CA C 69 59.605 59.605 58.904 0.701 19498
3141 1 9 . 1 1 69 69 MET CB C 69 31.867 31.867 32.731 -0.864 19498
3142 1 9 . 1 1 69 69 MET H H 69 8.465 8.465 7.505 0.960 19498
3143 1 9 . 1 1 70 70 CYS N N 70 117.496 117.496 116.835 0.661 19498
3144 1 9 . 1 1 70 70 CYS CA C 70 63.145 63.145 63.382 -0.237 19498
3145 1 9 . 1 1 70 70 CYS CB C 70 27.510 27.510 26.737 0.773 19498
3146 1 9 . 1 1 70 70 CYS H H 70 7.616 7.616 7.588 0.028 19498
3147 1 9 . 1 1 71 71 THR N N 71 118.640 118.640 115.265 3.375 19498
3148 1 9 . 1 1 71 71 THR HA H 71 4.270 4.270 4.044 0.226 19498
3149 1 9 . 1 1 71 71 THR CA C 71 67.980 67.980 67.001 0.979 19498
3150 1 9 . 1 1 71 71 THR CB C 71 67.949 67.949 68.517 -0.568 19498
3151 1 9 . 1 1 71 71 THR H H 71 8.509 8.509 7.785 0.724 19498
3152 1 9 . 1 1 72 72 ASP HA H 72 4.430 4.430 4.526 -0.096 19498
3153 1 9 . 1 1 72 72 ASP CA C 72 57.590 57.590 57.677 -0.087 19498
3154 1 9 . 1 1 72 72 ASP CB C 72 40.415 40.415 40.812 -0.397 19498
3155 1 9 . 1 1 73 73 TRP N N 73 121.657 121.657 121.488 0.169 19498
3156 1 9 . 1 1 73 73 TRP HA H 73 4.407 4.407 4.424 -0.017 19498
3157 1 9 . 1 1 73 73 TRP CA C 73 62.951 62.951 61.752 1.199 19498
3158 1 9 . 1 1 73 73 TRP CB C 73 29.114 29.114 30.074 -0.960 19498
3159 1 9 . 1 1 73 73 TRP H H 73 7.780 7.780 7.448 0.332 19498
3160 1 9 . 1 1 74 74 LEU N N 74 118.727 118.727 119.349 -0.622 19498
3161 1 9 . 1 1 74 74 LEU HA H 74 3.582 3.582 3.963 -0.381 19498
3162 1 9 . 1 1 74 74 LEU CA C 74 58.184 58.184 58.416 -0.232 19498
3163 1 9 . 1 1 74 74 LEU CB C 74 37.610 37.610 41.842 -4.232 19498
3164 1 9 . 1 1 74 74 LEU H H 74 8.490 8.490 7.941 0.549 19498
3165 1 9 . 1 1 75 75 ASN N N 75 117.962 117.962 117.475 0.487 19498
3166 1 9 . 1 1 75 75 ASN HA H 75 4.527 4.527 4.432 0.095 19498
3167 1 9 . 1 1 75 75 ASN CA C 75 56.501 56.501 56.355 0.146 19498
3168 1 9 . 1 1 75 75 ASN CB C 75 37.999 37.999 38.403 -0.404 19498
3169 1 9 . 1 1 75 75 ASN H H 75 8.639 8.639 8.129 0.510 19498
3170 1 9 . 1 1 76 76 HIS N N 76 120.823 120.823 118.675 2.148 19498
3171 1 9 . 1 1 76 76 HIS HA H 76 4.450 4.450 4.194 0.256 19498
3172 1 9 . 1 1 76 76 HIS CA C 76 58.737 58.737 59.353 -0.616 19498
3173 1 9 . 1 1 76 76 HIS CB C 76 28.007 28.007 29.837 -1.830 19498
3174 1 9 . 1 1 76 76 HIS H H 76 8.158 8.158 7.879 0.279 19498
3175 1 9 . 1 1 77 77 MET N N 77 118.749 118.749 114.674 4.075 19498
3176 1 9 . 1 1 77 77 MET HA H 77 4.071 4.071 4.155 -0.084 19498
3177 1 9 . 1 1 77 77 MET CA C 77 55.827 55.827 57.383 -1.556 19498
3178 1 9 . 1 1 77 77 MET CB C 77 29.541 29.541 31.917 -2.376 19498
3179 1 9 . 1 1 77 77 MET H H 77 8.404 8.404 7.337 1.067 19498
3180 1 9 . 1 1 78 78 TYR N N 78 120.762 120.762 120.494 0.268 19498
3181 1 9 . 1 1 78 78 TYR HA H 78 3.662 3.662 3.981 -0.319 19498
3182 1 9 . 1 1 78 78 TYR CA C 78 62.640 62.640 61.999 0.641 19498
3183 1 9 . 1 1 78 78 TYR CB C 78 37.545 37.545 37.743 -0.198 19498
3184 1 9 . 1 1 78 78 TYR H H 78 8.322 8.322 7.689 0.633 19498
3185 1 9 . 1 1 79 79 ASP N N 79 116.578 116.578 118.281 -1.703 19498
3186 1 9 . 1 1 79 79 ASP HA H 79 4.106 4.106 4.414 -0.308 19498
3187 1 9 . 1 1 79 79 ASP CA C 79 57.410 57.410 57.585 -0.175 19498
3188 1 9 . 1 1 79 79 ASP CB C 79 40.503 40.503 40.286 0.217 19498
3189 1 9 . 1 1 79 79 ASP H H 79 7.460 7.460 8.153 -0.693 19498
3190 1 9 . 1 1 80 80 GLN N N 80 116.175 116.175 119.058 -2.883 19498
3191 1 9 . 1 1 80 80 GLN HA H 80 4.056 4.056 4.042 0.014 19498
3192 1 9 . 1 1 80 80 GLN CA C 80 57.629 57.629 58.258 -0.628 19498
3193 1 9 . 1 1 80 80 GLN CB C 80 29.662 29.662 28.674 0.988 19498
3194 1 9 . 1 1 80 80 GLN H H 80 7.552 7.552 7.745 -0.193 19498
3195 1 9 . 1 1 81 81 LEU N N 81 118.398 118.398 115.517 2.881 19498
3196 1 9 . 1 1 81 81 LEU HA H 81 4.233 4.233 4.206 0.027 19498
3197 1 9 . 1 1 81 81 LEU CA C 81 55.461 55.461 55.134 0.327 19498
3198 1 9 . 1 1 81 81 LEU CB C 81 42.406 42.406 41.766 0.640 19498
3199 1 9 . 1 1 81 81 LEU H H 81 7.957 7.957 7.438 0.519 19498
3200 1 9 . 1 1 82 82 LYS N N 82 119.114 119.114 120.189 -1.075 19498
3201 1 9 . 1 1 82 82 LYS HA H 82 3.841 3.841 4.260 -0.419 19498
3202 1 9 . 1 1 82 82 LYS CA C 82 58.510 58.510 58.518 -0.008 19498
3203 1 9 . 1 1 82 82 LYS CB C 82 30.922 30.922 33.063 -2.141 19498
3204 1 9 . 1 1 82 82 LYS H H 82 7.664 7.664 7.747 -0.083 19498
3205 1 9 . 1 1 83 83 ASP N N 83 118.655 118.655 118.429 0.226 19498
3206 1 9 . 1 1 83 83 ASP HA H 83 4.819 4.819 4.809 0.010 19498
3207 1 9 . 1 1 83 83 ASP CA C 83 53.886 53.886 53.503 0.383 19498
3208 1 9 . 1 1 83 83 ASP CB C 83 40.986 40.986 41.284 -0.298 19498
3209 1 9 . 1 1 83 83 ASP H H 83 7.862 7.862 7.881 -0.019 19498
3210 1 9 . 1 1 84 84 TRP N N 84 121.757 121.757 120.816 0.941 19498
3211 1 9 . 1 1 84 84 TRP CA C 84 58.462 58.462 54.923 3.539 19498
3212 1 9 . 1 1 84 84 TRP CB C 84 28.934 28.934 26.506 2.429 19498
3213 1 9 . 1 1 84 84 TRP H H 84 7.925 7.925 8.226 -0.301 19498
3214 1 10 . 1 1 6 6 SER CA C 6 56.008 56.008 57.407 -1.399 19498
3215 1 10 . 1 1 7 7 GLY N N 7 109.496 109.496 108.291 1.205 19498
3216 1 10 . 1 1 7 7 GLY CA C 7 46.042 46.042 44.857 1.185 19498
3217 1 10 . 1 1 7 7 GLY H H 7 8.432 8.432 8.167 0.265 19498
3218 1 10 . 1 1 8 8 ASN N N 8 119.432 119.432 113.712 5.720 19498
3219 1 10 . 1 1 8 8 ASN HA H 8 4.685 4.685 4.398 0.287 19498
3220 1 10 . 1 1 8 8 ASN CA C 8 53.922 53.922 54.557 -0.635 19498
3221 1 10 . 1 1 8 8 ASN CB C 8 37.970 37.970 37.365 0.605 19498
3222 1 10 . 1 1 8 8 ASN H H 8 8.367 8.367 8.263 0.104 19498
3223 1 10 . 1 1 9 9 LEU N N 9 123.537 123.537 118.973 4.564 19498
3224 1 10 . 1 1 9 9 LEU HA H 9 3.984 3.984 4.252 -0.268 19498
3225 1 10 . 1 1 9 9 LEU CA C 9 56.417 56.417 54.609 1.808 19498
3226 1 10 . 1 1 9 9 LEU CB C 9 41.566 41.566 41.188 0.378 19498
3227 1 10 . 1 1 9 9 LEU H H 9 7.922 7.922 7.825 0.097 19498
3228 1 10 . 1 1 10 10 ALA N N 10 122.287 122.287 123.894 -1.607 19498
3229 1 10 . 1 1 10 10 ALA HA H 10 4.127 4.127 4.000 0.127 19498
3230 1 10 . 1 1 10 10 ALA CA C 10 55.912 55.912 55.191 0.721 19498
3231 1 10 . 1 1 10 10 ALA CB C 10 17.998 17.998 18.068 -0.070 19498
3232 1 10 . 1 1 10 10 ALA H H 10 8.064 8.064 8.163 -0.099 19498
3233 1 10 . 1 1 11 11 ALA N N 11 121.326 121.326 119.584 1.742 19498
3234 1 10 . 1 1 11 11 ALA HA H 11 4.207 4.207 4.219 -0.012 19498
3235 1 10 . 1 1 11 11 ALA CA C 11 54.960 54.960 53.893 1.067 19498
3236 1 10 . 1 1 11 11 ALA CB C 11 17.998 17.998 18.458 -0.460 19498
3237 1 10 . 1 1 11 11 ALA H H 11 8.143 8.143 8.265 -0.122 19498
3238 1 10 . 1 1 12 12 PHE N N 12 122.913 122.913 120.042 2.871 19498
3239 1 10 . 1 1 12 12 PHE HA H 12 4.411 4.411 4.190 0.221 19498
3240 1 10 . 1 1 12 12 PHE CA C 12 61.007 61.007 60.935 0.072 19498
3241 1 10 . 1 1 12 12 PHE CB C 12 39.499 39.499 39.237 0.262 19498
3242 1 10 . 1 1 12 12 PHE H H 12 7.779 7.779 8.157 -0.378 19498
3243 1 10 . 1 1 13 13 LYS N N 13 120.689 120.689 117.568 3.121 19498
3244 1 10 . 1 1 13 13 LYS HA H 13 3.861 3.861 4.057 -0.196 19498
3245 1 10 . 1 1 13 13 LYS CA C 13 59.099 59.099 59.404 -0.305 19498
3246 1 10 . 1 1 13 13 LYS CB C 13 31.867 31.867 32.310 -0.443 19498
3247 1 10 . 1 1 13 13 LYS H H 13 8.614 8.614 8.715 -0.101 19498
3248 1 10 . 1 1 14 14 ALA N N 14 122.076 122.076 120.919 1.157 19498
3249 1 10 . 1 1 14 14 ALA HA H 14 3.182 3.182 4.112 -0.930 19498
3250 1 10 . 1 1 14 14 ALA CA C 14 55.108 55.108 54.809 0.299 19498
3251 1 10 . 1 1 14 14 ALA CB C 14 18.120 18.120 18.121 -0.001 19498
3252 1 10 . 1 1 14 14 ALA H H 14 8.178 8.178 7.789 0.389 19498
3253 1 10 . 1 1 15 15 ALA N N 15 121.714 121.714 119.145 2.569 19498
3254 1 10 . 1 1 15 15 ALA HA H 15 4.040 4.040 4.002 0.038 19498
3255 1 10 . 1 1 15 15 ALA CA C 15 55.158 55.158 54.516 0.642 19498
3256 1 10 . 1 1 15 15 ALA CB C 15 19.042 19.042 18.099 0.943 19498
3257 1 10 . 1 1 15 15 ALA H H 15 7.793 7.793 7.709 0.084 19498
3258 1 10 . 1 1 16 16 THR N N 16 111.959 111.959 114.817 -2.858 19498
3259 1 10 . 1 1 16 16 THR HA H 16 3.705 3.705 3.988 -0.283 19498
3260 1 10 . 1 1 16 16 THR CA C 16 66.762 66.762 66.763 -0.001 19498
3261 1 10 . 1 1 16 16 THR CB C 16 68.213 68.213 68.622 -0.409 19498
3262 1 10 . 1 1 16 16 THR H H 16 8.133 8.133 7.328 0.805 19498
3263 1 10 . 1 1 17 17 ASN N N 17 121.090 121.090 119.789 1.301 19498
3264 1 10 . 1 1 17 17 ASN HA H 17 4.520 4.520 4.543 -0.023 19498
3265 1 10 . 1 1 17 17 ASN CA C 17 56.191 56.191 55.609 0.582 19498
3266 1 10 . 1 1 17 17 ASN CB C 17 38.365 38.365 38.492 -0.127 19498
3267 1 10 . 1 1 17 17 ASN H H 17 8.152 8.152 8.008 0.144 19498
3268 1 10 . 1 1 18 18 LYS N N 18 119.978 119.978 118.815 1.163 19498
3269 1 10 . 1 1 18 18 LYS HA H 18 3.914 3.914 3.895 0.019 19498
3270 1 10 . 1 1 18 18 LYS CA C 18 59.865 59.865 58.746 1.119 19498
3271 1 10 . 1 1 18 18 LYS CB C 18 30.999 30.999 31.777 -0.778 19498
3272 1 10 . 1 1 18 18 LYS H H 18 7.568 7.568 7.545 0.023 19498
3273 1 10 . 1 1 19 19 LEU N N 19 117.558 117.558 119.245 -1.687 19498
3274 1 10 . 1 1 19 19 LEU HA H 19 4.135 4.135 4.239 -0.104 19498
3275 1 10 . 1 1 19 19 LEU CA C 19 58.001 58.001 57.748 0.253 19498
3276 1 10 . 1 1 19 19 LEU CB C 19 40.823 40.823 41.992 -1.169 19498
3277 1 10 . 1 1 19 19 LEU H H 19 7.001 7.001 7.713 -0.712 19498
3278 1 10 . 1 1 20 20 PHE N N 20 121.123 121.123 117.619 3.504 19498
3279 1 10 . 1 1 20 20 PHE HA H 20 4.873 4.873 4.274 0.599 19498
3280 1 10 . 1 1 20 20 PHE CA C 20 60.375 60.375 60.605 -0.230 19498
3281 1 10 . 1 1 20 20 PHE CB C 20 38.480 38.480 38.989 -0.509 19498
3282 1 10 . 1 1 20 20 PHE H H 20 8.193 8.193 8.077 0.116 19498
3283 1 10 . 1 1 21 21 GLN N N 21 118.591 118.591 117.198 1.393 19498
3284 1 10 . 1 1 21 21 GLN HA H 21 4.208 4.208 3.961 0.247 19498
3285 1 10 . 1 1 21 21 GLN CA C 21 58.055 58.055 58.016 0.039 19498
3286 1 10 . 1 1 21 21 GLN CB C 21 28.284 28.284 28.864 -0.580 19498
3287 1 10 . 1 1 21 21 GLN H H 21 7.918 7.918 7.785 0.133 19498
3288 1 10 . 1 1 22 22 LEU N N 22 118.477 118.477 117.778 0.699 19498
3289 1 10 . 1 1 22 22 LEU HA H 22 4.534 4.534 4.516 0.018 19498
3290 1 10 . 1 1 22 22 LEU CA C 22 54.033 54.033 54.308 -0.275 19498
3291 1 10 . 1 1 22 22 LEU CB C 22 41.469 41.469 43.248 -1.779 19498
3292 1 10 . 1 1 22 22 LEU H H 22 7.561 7.561 7.596 -0.035 19498
3293 1 10 . 1 1 23 23 ASP N N 23 115.410 115.410 116.399 -0.989 19498
3294 1 10 . 1 1 23 23 ASP HA H 23 4.280 4.280 4.147 0.133 19498
3295 1 10 . 1 1 23 23 ASP CA C 23 55.494 55.494 55.552 -0.058 19498
3296 1 10 . 1 1 23 23 ASP CB C 23 39.317 39.317 39.082 0.235 19498
3297 1 10 . 1 1 23 23 ASP H H 23 8.163 8.163 7.577 0.586 19498
3298 1 10 . 1 1 24 24 LEU N N 24 116.367 116.367 113.793 2.574 19498
3299 1 10 . 1 1 24 24 LEU HA H 24 4.790 4.790 4.823 -0.033 19498
3300 1 10 . 1 1 24 24 LEU CA C 24 53.030 53.030 53.150 -0.120 19498
3301 1 10 . 1 1 24 24 LEU CB C 24 43.867 43.867 44.596 -0.729 19498
3302 1 10 . 1 1 24 24 LEU H H 24 7.136 7.136 7.831 -0.695 19498
3303 1 10 . 1 1 25 25 ALA N N 25 123.243 123.243 120.373 2.870 19498
3304 1 10 . 1 1 25 25 ALA HA H 25 4.480 4.480 4.899 -0.419 19498
3305 1 10 . 1 1 25 25 ALA CA C 25 50.890 50.890 51.849 -0.959 19498
3306 1 10 . 1 1 25 25 ALA CB C 25 21.655 21.655 21.986 -0.331 19498
3307 1 10 . 1 1 25 25 ALA H H 25 8.931 8.931 8.264 0.667 19498
3308 1 10 . 1 1 26 26 VAL N N 26 119.587 119.587 121.387 -1.800 19498
3309 1 10 . 1 1 26 26 VAL HA H 26 4.889 4.889 5.274 -0.385 19498
3310 1 10 . 1 1 26 26 VAL CA C 26 61.278 61.278 59.959 1.319 19498
3311 1 10 . 1 1 26 26 VAL CB C 26 33.310 33.310 34.937 -1.627 19498
3312 1 10 . 1 1 26 26 VAL H H 26 7.575 7.575 8.392 -0.817 19498
3313 1 10 . 1 1 27 27 ILE N N 27 130.377 130.377 124.893 5.484 19498
3314 1 10 . 1 1 27 27 ILE HA H 27 4.489 4.489 4.860 -0.371 19498
3315 1 10 . 1 1 27 27 ILE CA C 27 60.177 60.177 60.156 0.021 19498
3316 1 10 . 1 1 27 27 ILE CB C 27 40.019 40.019 40.223 -0.204 19498
3317 1 10 . 1 1 27 27 ILE H H 27 9.437 9.437 9.088 0.349 19498
3318 1 10 . 1 1 28 28 TYR N N 28 126.844 126.844 121.544 5.300 19498
3319 1 10 . 1 1 28 28 TYR HA H 28 5.709 5.709 5.849 -0.140 19498
3320 1 10 . 1 1 28 28 TYR CA C 28 55.486 55.486 55.160 0.326 19498
3321 1 10 . 1 1 28 28 TYR CB C 28 42.019 42.019 41.013 1.006 19498
3322 1 10 . 1 1 28 28 TYR H H 28 8.531 8.531 8.265 0.266 19498
3323 1 10 . 1 1 29 29 ASP N N 29 122.875 122.875 122.215 0.660 19498
3324 1 10 . 1 1 29 29 ASP HA H 29 4.966 4.966 5.042 -0.076 19498
3325 1 10 . 1 1 29 29 ASP CA C 29 53.659 53.659 53.877 -0.217 19498
3326 1 10 . 1 1 29 29 ASP CB C 29 44.660 44.660 44.750 -0.090 19498
3327 1 10 . 1 1 29 29 ASP H H 29 8.614 8.614 8.474 0.140 19498
3328 1 10 . 1 1 30 30 ASP N N 30 119.325 119.325 122.676 -3.351 19498
3329 1 10 . 1 1 30 30 ASP HA H 30 5.447 5.447 4.998 0.449 19498
3330 1 10 . 1 1 30 30 ASP CA C 30 53.501 53.501 53.937 -0.436 19498
3331 1 10 . 1 1 30 30 ASP CB C 30 43.921 43.921 44.236 -0.315 19498
3332 1 10 . 1 1 30 30 ASP H H 30 8.607 8.607 8.336 0.271 19498
3333 1 10 . 1 1 31 31 TRP N N 31 120.552 120.552 123.632 -3.080 19498
3334 1 10 . 1 1 31 31 TRP HA H 31 4.615 4.615 4.227 0.388 19498
3335 1 10 . 1 1 31 31 TRP CA C 31 58.000 58.000 57.746 0.254 19498
3336 1 10 . 1 1 31 31 TRP CB C 31 31.500 31.500 28.346 3.154 19498
3337 1 10 . 1 1 31 31 TRP H H 31 8.673 8.673 8.254 0.419 19498
3338 1 10 . 1 1 32 32 TYR CA C 32 52.400 52.400 56.138 -3.738 19498
3339 1 10 . 1 1 32 32 TYR CB C 32 42.350 42.350 38.465 3.885 19498
3340 1 10 . 1 1 33 33 ASP CA C 33 52.400 52.400 55.181 -2.781 19498
3341 1 10 . 1 1 33 33 ASP CB C 33 42.350 42.350 40.632 1.718 19498
3342 1 10 . 1 1 34 34 ALA N N 34 126.709 126.709 126.452 0.257 19498
3343 1 10 . 1 1 34 34 ALA HA H 34 3.845 3.845 4.318 -0.473 19498
3344 1 10 . 1 1 34 34 ALA CA C 34 58.599 58.599 52.026 6.573 19498
3345 1 10 . 1 1 34 34 ALA CB C 34 18.610 18.610 18.973 -0.363 19498
3346 1 10 . 1 1 34 34 ALA H H 34 8.424 8.424 8.030 0.394 19498
3347 1 10 . 1 1 35 35 TYR N N 35 117.123 117.123 124.429 -7.306 19498
3348 1 10 . 1 1 35 35 TYR HA H 35 4.350 4.350 4.200 0.150 19498
3349 1 10 . 1 1 35 35 TYR CA C 35 60.466 60.466 60.810 -0.344 19498
3350 1 10 . 1 1 35 35 TYR CB C 35 38.113 38.113 38.514 -0.401 19498
3351 1 10 . 1 1 35 35 TYR H H 35 8.334 8.334 8.781 -0.447 19498
3352 1 10 . 1 1 36 36 THR N N 36 108.046 108.046 109.060 -1.014 19498
3353 1 10 . 1 1 36 36 THR HA H 36 4.018 4.018 4.106 -0.088 19498
3354 1 10 . 1 1 36 36 THR CA C 36 61.809 61.809 62.773 -0.964 19498
3355 1 10 . 1 1 36 36 THR CB C 36 69.926 69.926 68.737 1.189 19498
3356 1 10 . 1 1 36 36 THR H H 36 7.563 7.563 8.083 -0.520 19498
3357 1 10 . 1 1 37 37 ARG N N 37 118.456 118.456 119.680 -1.224 19498
3358 1 10 . 1 1 37 37 ARG CA C 37 57.001 57.001 56.949 0.052 19498
3359 1 10 . 1 1 37 37 ARG H H 37 7.952 7.952 7.529 0.423 19498
3360 1 10 . 1 1 40 40 CYS CA C 40 56.316 56.316 56.538 -0.222 19498
3361 1 10 . 1 1 40 40 CYS CB C 40 29.999 29.999 31.160 -1.161 19498
3362 1 10 . 1 1 41 41 ILE N N 41 121.419 121.419 119.155 2.264 19498
3363 1 10 . 1 1 41 41 ILE HA H 41 4.709 4.709 4.828 -0.119 19498
3364 1 10 . 1 1 41 41 ILE CA C 41 60.462 60.462 60.857 -0.395 19498
3365 1 10 . 1 1 41 41 ILE CB C 41 42.309 42.309 41.714 0.595 19498
3366 1 10 . 1 1 41 41 ILE H H 41 8.459 8.459 8.256 0.203 19498
3367 1 10 . 1 1 42 42 ARG N N 42 127.916 127.916 125.945 1.971 19498
3368 1 10 . 1 1 42 42 ARG CA C 42 54.501 54.501 54.748 -0.247 19498
3369 1 10 . 1 1 42 42 ARG CB C 42 33.204 33.204 34.250 -1.046 19498
3370 1 10 . 1 1 42 42 ARG H H 42 9.004 9.004 8.293 0.711 19498
3371 1 10 . 1 1 43 43 LEU N N 43 124.715 124.715 125.952 -1.237 19498
3372 1 10 . 1 1 43 43 LEU HA H 43 5.538 5.538 5.066 0.472 19498
3373 1 10 . 1 1 43 43 LEU CA C 43 53.266 53.266 54.378 -1.112 19498
3374 1 10 . 1 1 43 43 LEU CB C 43 46.163 46.163 43.959 2.204 19498
3375 1 10 . 1 1 43 43 LEU H H 43 8.757 8.757 9.220 -0.463 19498
3376 1 10 . 1 1 44 44 ARG N N 44 123.499 123.499 125.442 -1.943 19498
3377 1 10 . 1 1 44 44 ARG HA H 44 5.004 5.004 4.898 0.106 19498
3378 1 10 . 1 1 44 44 ARG CA C 44 55.508 55.508 54.724 0.784 19498
3379 1 10 . 1 1 44 44 ARG CB C 44 34.543 34.543 33.611 0.932 19498
3380 1 10 . 1 1 44 44 ARG H H 44 9.366 9.366 9.304 0.062 19498
3381 1 10 . 1 1 45 45 ILE N N 45 122.919 122.919 127.121 -4.202 19498
3382 1 10 . 1 1 45 45 ILE HA H 45 5.260 5.260 4.841 0.419 19498
3383 1 10 . 1 1 45 45 ILE CA C 45 59.933 59.933 59.218 0.715 19498
3384 1 10 . 1 1 45 45 ILE CB C 45 39.751 39.751 38.277 1.474 19498
3385 1 10 . 1 1 45 45 ILE H H 45 8.938 8.938 8.917 0.021 19498
3386 1 10 . 1 1 46 46 GLU N N 46 126.745 126.745 126.811 -0.066 19498
3387 1 10 . 1 1 46 46 GLU HA H 46 5.465 5.465 4.706 0.759 19498
3388 1 10 . 1 1 46 46 GLU CA C 46 53.707 53.707 54.583 -0.876 19498
3389 1 10 . 1 1 46 46 GLU CB C 46 35.276 35.276 34.219 1.057 19498
3390 1 10 . 1 1 46 46 GLU H H 46 9.097 9.097 8.092 1.005 19498
3391 1 10 . 1 1 47 47 ASP N N 47 117.988 117.988 123.976 -5.988 19498
3392 1 10 . 1 1 47 47 ASP HA H 47 4.976 4.976 4.808 0.168 19498
3393 1 10 . 1 1 47 47 ASP CA C 47 52.411 52.411 53.380 -0.970 19498
3394 1 10 . 1 1 47 47 ASP CB C 47 41.609 41.609 42.984 -1.375 19498
3395 1 10 . 1 1 47 47 ASP H H 47 8.209 8.209 8.821 -0.612 19498
3396 1 10 . 1 1 48 48 ARG N N 48 117.098 117.098 121.946 -4.848 19498
3397 1 10 . 1 1 48 48 ARG HA H 48 4.129 4.129 4.379 -0.250 19498
3398 1 10 . 1 1 48 48 ARG CA C 48 58.323 58.323 56.691 1.632 19498
3399 1 10 . 1 1 48 48 ARG CB C 48 29.511 29.511 29.518 -0.007 19498
3400 1 10 . 1 1 48 48 ARG H H 48 8.872 8.872 8.779 0.093 19498
3401 1 10 . 1 1 49 49 SER N N 49 115.006 115.006 114.468 0.538 19498
3402 1 10 . 1 1 49 49 SER HA H 49 4.614 4.614 4.629 -0.015 19498
3403 1 10 . 1 1 49 49 SER CA C 49 58.411 58.411 57.720 0.691 19498
3404 1 10 . 1 1 49 49 SER CB C 49 63.806 63.806 63.479 0.327 19498
3405 1 10 . 1 1 49 49 SER H H 49 8.142 8.142 8.018 0.124 19498
3406 1 10 . 1 1 50 50 GLY N N 50 109.042 109.042 110.568 -1.526 19498
3407 1 10 . 1 1 50 50 GLY CA C 50 44.997 44.997 45.282 -0.285 19498
3408 1 10 . 1 1 50 50 GLY H H 50 8.035 8.035 7.843 0.192 19498
3409 1 10 . 1 1 51 51 ASN N N 51 119.842 119.842 119.997 -0.155 19498
3410 1 10 . 1 1 51 51 ASN HA H 51 4.546 4.546 4.654 -0.108 19498
3411 1 10 . 1 1 51 51 ASN CA C 51 53.419 53.419 54.378 -0.959 19498
3412 1 10 . 1 1 51 51 ASN CB C 51 38.422 38.422 39.107 -0.685 19498
3413 1 10 . 1 1 51 51 ASN H H 51 8.613 8.613 8.419 0.194 19498
3414 1 10 . 1 1 52 52 LEU N N 52 124.085 124.085 118.304 5.781 19498
3415 1 10 . 1 1 52 52 LEU HA H 52 4.142 4.142 4.731 -0.589 19498
3416 1 10 . 1 1 52 52 LEU CA C 52 56.023 56.023 54.387 1.636 19498
3417 1 10 . 1 1 52 52 LEU CB C 52 42.353 42.353 43.610 -1.257 19498
3418 1 10 . 1 1 52 52 LEU H H 52 8.631 8.631 8.325 0.306 19498
3419 1 10 . 1 1 53 53 ILE N N 53 129.362 129.362 122.518 6.844 19498
3420 1 10 . 1 1 53 53 ILE HA H 53 4.137 4.137 4.351 -0.214 19498
3421 1 10 . 1 1 53 53 ILE CA C 53 61.800 61.800 61.901 -0.101 19498
3422 1 10 . 1 1 53 53 ILE CB C 53 37.256 37.256 38.716 -1.460 19498
3423 1 10 . 1 1 53 53 ILE H H 53 9.432 9.432 8.560 0.872 19498
3424 1 10 . 1 1 54 54 ASP N N 54 113.575 113.575 116.939 -3.364 19498
3425 1 10 . 1 1 54 54 ASP HA H 54 4.847 4.847 4.931 -0.084 19498
3426 1 10 . 1 1 54 54 ASP CA C 54 53.586 53.586 54.230 -0.644 19498
3427 1 10 . 1 1 54 54 ASP CB C 54 44.500 44.500 43.782 0.718 19498
3428 1 10 . 1 1 54 54 ASP H H 54 7.761 7.761 7.699 0.062 19498
3429 1 10 . 1 1 55 55 THR N N 55 115.783 115.783 113.299 2.484 19498
3430 1 10 . 1 1 55 55 THR HA H 55 5.427 5.427 5.289 0.138 19498
3431 1 10 . 1 1 55 55 THR CA C 55 59.185 59.185 60.876 -1.691 19498
3432 1 10 . 1 1 55 55 THR CB C 55 70.551 70.551 71.952 -1.401 19498
3433 1 10 . 1 1 55 55 THR H H 55 10.106 10.106 8.223 1.883 19498
3434 1 10 . 1 1 56 56 SER N N 56 119.808 119.808 118.170 1.638 19498
3435 1 10 . 1 1 56 56 SER HA H 56 4.135 4.135 4.549 -0.414 19498
3436 1 10 . 1 1 56 56 SER CA C 56 58.001 58.001 57.329 0.672 19498
3437 1 10 . 1 1 56 56 SER CB C 56 65.039 65.039 65.013 0.027 19498
3438 1 10 . 1 1 56 56 SER H H 56 7.872 7.872 9.110 -1.238 19498
3439 1 10 . 1 1 57 57 THR N N 57 117.962 117.962 122.355 -4.393 19498
3440 1 10 . 1 1 57 57 THR HA H 57 4.964 4.964 4.631 0.333 19498
3441 1 10 . 1 1 57 57 THR CA C 57 61.001 61.001 61.602 -0.601 19498
3442 1 10 . 1 1 57 57 THR CB C 57 70.881 70.881 70.474 0.407 19498
3443 1 10 . 1 1 57 57 THR H H 57 7.524 7.524 8.117 -0.593 19498
3444 1 10 . 1 1 58 58 PHE N N 58 123.853 123.853 127.207 -3.354 19498
3445 1 10 . 1 1 58 58 PHE HA H 58 4.603 4.603 4.690 -0.087 19498
3446 1 10 . 1 1 58 58 PHE CA C 58 56.648 56.648 57.316 -0.668 19498
3447 1 10 . 1 1 58 58 PHE CB C 58 43.583 43.583 41.143 2.440 19498
3448 1 10 . 1 1 58 58 PHE H H 58 8.861 8.861 8.331 0.530 19498
3449 1 10 . 1 1 59 59 TYR N N 59 117.898 117.898 119.778 -1.880 19498
3450 1 10 . 1 1 59 59 TYR HA H 59 5.328 5.328 4.913 0.415 19498
3451 1 10 . 1 1 59 59 TYR CA C 59 56.221 56.221 56.182 0.039 19498
3452 1 10 . 1 1 59 59 TYR CB C 59 42.106 42.106 39.411 2.695 19498
3453 1 10 . 1 1 59 59 TYR H H 59 8.328 8.328 8.129 0.199 19498
3454 1 10 . 1 1 60 60 HIS CA C 60 60.065 60.065 55.210 4.855 19498
3455 1 10 . 1 1 60 60 HIS CB C 60 34.284 34.284 32.774 1.510 19498
3456 1 10 . 1 1 61 61 HIS N N 61 121.880 121.880 119.105 2.775 19498
3457 1 10 . 1 1 61 61 HIS CA C 61 58.001 58.001 55.391 2.610 19498
3458 1 10 . 1 1 61 61 HIS CB C 61 29.999 29.999 29.005 0.994 19498
3459 1 10 . 1 1 61 61 HIS H H 61 7.734 7.734 8.614 -0.880 19498
3460 1 10 . 1 1 62 62 ASP N N 62 128.148 128.148 122.478 5.670 19498
3461 1 10 . 1 1 62 62 ASP HA H 62 4.870 4.870 4.684 0.186 19498
3462 1 10 . 1 1 62 62 ASP CA C 62 53.348 53.348 53.918 -0.570 19498
3463 1 10 . 1 1 62 62 ASP CB C 62 42.600 42.600 42.622 -0.022 19498
3464 1 10 . 1 1 62 62 ASP H H 62 11.492 11.492 7.920 3.572 19498
3465 1 10 . 1 1 63 63 GLU N N 63 126.564 126.564 126.799 -0.235 19498
3466 1 10 . 1 1 63 63 GLU HA H 63 3.795 3.795 3.982 -0.187 19498
3467 1 10 . 1 1 63 63 GLU CA C 63 59.863 59.863 59.831 0.032 19498
3468 1 10 . 1 1 63 63 GLU CB C 63 34.007 34.007 30.038 3.969 19498
3469 1 10 . 1 1 63 63 GLU H H 63 8.982 8.982 8.851 0.131 19498
3470 1 10 . 1 1 64 64 ASP N N 64 117.779 117.779 119.237 -1.458 19498
3471 1 10 . 1 1 64 64 ASP HA H 64 4.401 4.401 4.542 -0.141 19498
3472 1 10 . 1 1 64 64 ASP CA C 64 57.664 57.664 57.147 0.517 19498
3473 1 10 . 1 1 64 64 ASP CB C 64 40.369 40.369 41.023 -0.654 19498
3474 1 10 . 1 1 64 64 ASP H H 64 8.272 8.272 7.934 0.338 19498
3475 1 10 . 1 1 65 65 VAL N N 65 121.948 121.948 121.254 0.694 19498
3476 1 10 . 1 1 65 65 VAL HA H 65 3.386 3.386 3.726 -0.340 19498
3477 1 10 . 1 1 65 65 VAL CA C 65 65.913 65.913 66.233 -0.320 19498
3478 1 10 . 1 1 65 65 VAL CB C 65 31.465 31.465 31.654 -0.189 19498
3479 1 10 . 1 1 65 65 VAL H H 65 7.335 7.335 8.603 -1.268 19498
3480 1 10 . 1 1 66 66 LEU N N 66 120.747 120.747 121.063 -0.316 19498
3481 1 10 . 1 1 66 66 LEU HA H 66 3.905 3.905 3.923 -0.018 19498
3482 1 10 . 1 1 66 66 LEU CA C 66 58.076 58.076 58.218 -0.142 19498
3483 1 10 . 1 1 66 66 LEU CB C 66 42.160 42.160 40.741 1.419 19498
3484 1 10 . 1 1 66 66 LEU H H 66 8.164 8.164 8.031 0.133 19498
3485 1 10 . 1 1 67 67 PHE N N 67 116.553 116.553 117.659 -1.106 19498
3486 1 10 . 1 1 67 67 PHE HA H 67 3.900 3.900 4.037 -0.137 19498
3487 1 10 . 1 1 67 67 PHE CA C 67 62.849 62.849 62.434 0.415 19498
3488 1 10 . 1 1 67 67 PHE CB C 67 38.003 38.003 38.182 -0.179 19498
3489 1 10 . 1 1 67 67 PHE H H 67 8.350 8.350 7.592 0.758 19498
3490 1 10 . 1 1 68 68 ASN N N 68 121.020 121.020 118.044 2.976 19498
3491 1 10 . 1 1 68 68 ASN HA H 68 4.415 4.415 4.368 0.047 19498
3492 1 10 . 1 1 68 68 ASN CA C 68 56.725 56.725 56.621 0.104 19498
3493 1 10 . 1 1 68 68 ASN CB C 68 38.071 38.071 38.914 -0.844 19498
3494 1 10 . 1 1 68 68 ASN H H 68 8.001 8.001 7.950 0.051 19498
3495 1 10 . 1 1 69 69 MET N N 69 120.402 120.402 118.895 1.507 19498
3496 1 10 . 1 1 69 69 MET HA H 69 4.011 4.011 4.031 -0.020 19498
3497 1 10 . 1 1 69 69 MET CA C 69 59.605 59.605 59.427 0.178 19498
3498 1 10 . 1 1 69 69 MET CB C 69 31.867 31.867 32.338 -0.471 19498
3499 1 10 . 1 1 69 69 MET H H 69 8.465 8.465 8.365 0.100 19498
3500 1 10 . 1 1 70 70 CYS N N 70 117.496 117.496 116.375 1.121 19498
3501 1 10 . 1 1 70 70 CYS CA C 70 63.145 63.145 63.513 -0.368 19498
3502 1 10 . 1 1 70 70 CYS CB C 70 27.510 27.510 27.127 0.383 19498
3503 1 10 . 1 1 70 70 CYS H H 70 7.616 7.616 7.576 0.040 19498
3504 1 10 . 1 1 71 71 THR N N 71 118.640 118.640 115.482 3.158 19498
3505 1 10 . 1 1 71 71 THR HA H 71 4.270 4.270 4.058 0.212 19498
3506 1 10 . 1 1 71 71 THR CA C 71 67.980 67.980 65.806 2.174 19498
3507 1 10 . 1 1 71 71 THR CB C 71 67.949 67.949 68.539 -0.590 19498
3508 1 10 . 1 1 71 71 THR H H 71 8.509 8.509 7.781 0.728 19498
3509 1 10 . 1 1 72 72 ASP HA H 72 4.430 4.430 4.444 -0.014 19498
3510 1 10 . 1 1 72 72 ASP CA C 72 57.590 57.590 58.262 -0.672 19498
3511 1 10 . 1 1 72 72 ASP CB C 72 40.415 40.415 40.843 -0.428 19498
3512 1 10 . 1 1 73 73 TRP N N 73 121.657 121.657 121.086 0.571 19498
3513 1 10 . 1 1 73 73 TRP HA H 73 4.407 4.407 4.341 0.066 19498
3514 1 10 . 1 1 73 73 TRP CA C 73 62.951 62.951 61.620 1.331 19498
3515 1 10 . 1 1 73 73 TRP CB C 73 29.114 29.114 29.717 -0.603 19498
3516 1 10 . 1 1 73 73 TRP H H 73 7.780 7.780 7.569 0.211 19498
3517 1 10 . 1 1 74 74 LEU N N 74 118.727 118.727 118.136 0.591 19498
3518 1 10 . 1 1 74 74 LEU HA H 74 3.582 3.582 3.735 -0.153 19498
3519 1 10 . 1 1 74 74 LEU CA C 74 58.184 58.184 57.736 0.448 19498
3520 1 10 . 1 1 74 74 LEU CB C 74 37.610 37.610 41.448 -3.838 19498
3521 1 10 . 1 1 74 74 LEU H H 74 8.490 8.490 7.732 0.758 19498
3522 1 10 . 1 1 75 75 ASN N N 75 117.962 117.962 117.599 0.363 19498
3523 1 10 . 1 1 75 75 ASN HA H 75 4.527 4.527 4.735 -0.208 19498
3524 1 10 . 1 1 75 75 ASN CA C 75 56.501 56.501 55.758 0.743 19498
3525 1 10 . 1 1 75 75 ASN CB C 75 37.999 37.999 38.463 -0.464 19498
3526 1 10 . 1 1 75 75 ASN H H 75 8.639 8.639 7.861 0.778 19498
3527 1 10 . 1 1 76 76 HIS N N 76 120.823 120.823 119.481 1.342 19498
3528 1 10 . 1 1 76 76 HIS HA H 76 4.450 4.450 4.262 0.188 19498
3529 1 10 . 1 1 76 76 HIS CA C 76 58.737 58.737 59.062 -0.325 19498
3530 1 10 . 1 1 76 76 HIS CB C 76 28.007 28.007 29.677 -1.670 19498
3531 1 10 . 1 1 76 76 HIS H H 76 8.158 8.158 7.849 0.309 19498
3532 1 10 . 1 1 77 77 MET N N 77 118.749 118.749 116.634 2.115 19498
3533 1 10 . 1 1 77 77 MET HA H 77 4.071 4.071 3.467 0.604 19498
3534 1 10 . 1 1 77 77 MET CA C 77 55.827 55.827 58.593 -2.766 19498
3535 1 10 . 1 1 77 77 MET CB C 77 29.541 29.541 31.863 -2.322 19498
3536 1 10 . 1 1 77 77 MET H H 77 8.404 8.404 7.219 1.185 19498
3537 1 10 . 1 1 78 78 TYR N N 78 120.762 120.762 117.986 2.776 19498
3538 1 10 . 1 1 78 78 TYR HA H 78 3.662 3.662 4.038 -0.376 19498
3539 1 10 . 1 1 78 78 TYR CA C 78 62.640 62.640 61.553 1.087 19498
3540 1 10 . 1 1 78 78 TYR CB C 78 37.545 37.545 37.471 0.074 19498
3541 1 10 . 1 1 78 78 TYR H H 78 8.322 8.322 7.473 0.849 19498
3542 1 10 . 1 1 79 79 ASP N N 79 116.578 116.578 117.556 -0.978 19498
3543 1 10 . 1 1 79 79 ASP HA H 79 4.106 4.106 4.356 -0.250 19498
3544 1 10 . 1 1 79 79 ASP CA C 79 57.410 57.410 57.226 0.184 19498
3545 1 10 . 1 1 79 79 ASP CB C 79 40.503 40.503 40.791 -0.288 19498
3546 1 10 . 1 1 79 79 ASP H H 79 7.460 7.460 7.858 -0.398 19498
3547 1 10 . 1 1 80 80 GLN N N 80 116.175 116.175 119.186 -3.011 19498
3548 1 10 . 1 1 80 80 GLN HA H 80 4.056 4.056 4.303 -0.247 19498
3549 1 10 . 1 1 80 80 GLN CA C 80 57.629 57.629 57.596 0.033 19498
3550 1 10 . 1 1 80 80 GLN CB C 80 29.662 29.662 29.027 0.635 19498
3551 1 10 . 1 1 80 80 GLN H H 80 7.552 7.552 7.250 0.302 19498
3552 1 10 . 1 1 81 81 LEU N N 81 118.398 118.398 120.485 -2.087 19498
3553 1 10 . 1 1 81 81 LEU HA H 81 4.233 4.233 4.087 0.146 19498
3554 1 10 . 1 1 81 81 LEU CA C 81 55.461 55.461 57.588 -2.127 19498
3555 1 10 . 1 1 81 81 LEU CB C 81 42.406 42.406 41.848 0.558 19498
3556 1 10 . 1 1 81 81 LEU H H 81 7.957 7.957 7.709 0.248 19498
3557 1 10 . 1 1 82 82 LYS N N 82 119.114 119.114 119.370 -0.256 19498
3558 1 10 . 1 1 82 82 LYS HA H 82 3.841 3.841 4.026 -0.185 19498
3559 1 10 . 1 1 82 82 LYS CA C 82 58.510 58.510 58.916 -0.406 19498
3560 1 10 . 1 1 82 82 LYS CB C 82 30.922 30.922 32.271 -1.349 19498
3561 1 10 . 1 1 82 82 LYS H H 82 7.664 7.664 8.045 -0.381 19498
3562 1 10 . 1 1 83 83 ASP N N 83 118.655 118.655 118.649 0.006 19498
3563 1 10 . 1 1 83 83 ASP HA H 83 4.819 4.819 4.516 0.303 19498
3564 1 10 . 1 1 83 83 ASP CA C 83 53.886 53.886 55.888 -2.002 19498
3565 1 10 . 1 1 83 83 ASP CB C 83 40.986 40.986 41.068 -0.082 19498
3566 1 10 . 1 1 83 83 ASP H H 83 7.862 7.862 7.851 0.011 19498
3567 1 10 . 1 1 84 84 TRP N N 84 121.757 121.757 121.533 0.224 19498
3568 1 10 . 1 1 84 84 TRP CA C 84 58.462 58.462 57.623 0.839 19498
3569 1 10 . 1 1 84 84 TRP CB C 84 28.934 28.934 30.508 -1.574 19498
3570 1 10 . 1 1 84 84 TRP H H 84 7.925 7.925 7.586 0.339 19498
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 71 2.866 -0.364 2.863 19498
2 1 1 "Average Difference" HA 69 0.308 -0.030 0.308 19498
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19498
4 1 1 "Average Difference" CA 77 1.383 -0.040 1.391 19498
5 1 1 "Average Difference" CB 73 1.402 -0.090 1.409 19498
6 1 1 "Average Difference" HN 71 0.683 -0.158 0.669 19498
7 1 2 "Average Difference" N 71 3.192 -0.216 3.207 19498
8 1 2 "Average Difference" HA 69 0.299 -0.026 0.300 19498
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19498
10 1 2 "Average Difference" CA 77 1.431 0.015 1.440 19498
11 1 2 "Average Difference" CB 73 1.490 -0.138 1.494 19498
12 1 2 "Average Difference" HN 71 0.719 -0.192 0.698 19498
13 1 3 "Average Difference" N 71 2.517 -0.395 2.504 19498
14 1 3 "Average Difference" HA 69 0.304 -0.012 0.306 19498
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19498
16 1 3 "Average Difference" CA 77 1.418 -0.059 1.426 19498
17 1 3 "Average Difference" CB 73 1.399 -0.069 1.407 19498
18 1 3 "Average Difference" HN 71 0.691 -0.175 0.674 19498
19 1 4 "Average Difference" N 71 2.845 -0.366 2.842 19498
20 1 4 "Average Difference" HA 69 0.328 0.007 0.330 19498
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19498
22 1 4 "Average Difference" CA 77 1.439 -0.098 1.445 19498
23 1 4 "Average Difference" CB 73 1.442 0.010 1.452 19498
24 1 4 "Average Difference" HN 71 0.657 -0.160 0.641 19498
25 1 5 "Average Difference" N 71 2.858 -0.100 2.876 19498
26 1 5 "Average Difference" HA 69 0.353 -0.025 0.354 19498
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19498
28 1 5 "Average Difference" CA 77 1.519 -0.175 1.518 19498
29 1 5 "Average Difference" CB 73 1.430 -0.105 1.436 19498
30 1 5 "Average Difference" HN 71 0.743 -0.212 0.717 19498
31 1 6 "Average Difference" N 71 2.957 -0.530 2.929 19498
32 1 6 "Average Difference" HA 69 0.323 -0.018 0.325 19498
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19498
34 1 6 "Average Difference" CA 77 1.580 -0.181 1.580 19498
35 1 6 "Average Difference" CB 73 1.422 -0.078 1.430 19498
36 1 6 "Average Difference" HN 71 0.675 -0.217 0.644 19498
37 1 7 "Average Difference" N 71 2.890 -0.422 2.880 19498
38 1 7 "Average Difference" HA 69 0.315 0.017 0.317 19498
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19498
40 1 7 "Average Difference" CA 77 1.367 -0.180 1.364 19498
41 1 7 "Average Difference" CB 73 1.305 -0.018 1.314 19498
42 1 7 "Average Difference" HN 71 0.657 -0.186 0.635 19498
43 1 8 "Average Difference" N 71 3.167 -0.335 3.172 19498
44 1 8 "Average Difference" HA 69 0.349 -0.054 0.348 19498
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19498
46 1 8 "Average Difference" CA 77 1.429 -0.100 1.435 19498
47 1 8 "Average Difference" CB 73 1.422 -0.210 1.416 19498
48 1 8 "Average Difference" HN 71 0.698 -0.271 0.648 19498
49 1 9 "Average Difference" N 71 2.977 -0.311 2.981 19498
50 1 9 "Average Difference" HA 69 0.355 0.021 0.357 19498
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19498
52 1 9 "Average Difference" CA 77 1.689 -0.208 1.687 19498
53 1 9 "Average Difference" CB 73 1.660 -0.188 1.660 19498
54 1 9 "Average Difference" HN 71 0.663 -0.246 0.620 19498
55 1 10 "Average Difference" N 71 2.892 -0.398 2.884 19498
56 1 10 "Average Difference" HA 69 0.302 -0.000 0.304 19498
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19498
58 1 10 "Average Difference" CA 77 1.411 -0.092 1.417 19498
59 1 10 "Average Difference" CB 73 1.322 -0.020 1.331 19498
60 1 10 "Average Difference" HN 71 0.693 -0.186 0.673 19498
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 19498
_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 6 6 SER CA C 6 56.008 56.008 57.872 -1.864 19498
2 1 . 1 1 7 7 GLY N N 7 109.496 109.496 109.759 -0.264 19498
3 1 . 1 1 7 7 GLY CA C 7 46.042 46.042 45.613 0.429 19498
4 1 . 1 1 7 7 GLY H H 7 8.432 8.432 8.527 -0.095 19498
5 1 . 1 1 8 8 ASN N N 8 119.432 119.432 117.817 1.615 19498
6 1 . 1 1 8 8 ASN HA H 8 4.685 4.685 4.565 0.120 19498
7 1 . 1 1 8 8 ASN CA C 8 53.922 53.922 53.771 0.151 19498
8 1 . 1 1 8 8 ASN CB C 8 37.970 37.970 38.263 -0.293 19498
9 1 . 1 1 8 8 ASN H H 8 8.367 8.367 8.058 0.309 19498
10 1 . 1 1 9 9 LEU N N 9 123.537 123.537 119.631 3.906 19498
11 1 . 1 1 9 9 LEU HA H 9 3.984 3.984 4.324 -0.339 19498
12 1 . 1 1 9 9 LEU CA C 9 56.417 56.417 55.012 1.405 19498
13 1 . 1 1 9 9 LEU CB C 9 41.566 41.566 41.622 -0.056 19498
14 1 . 1 1 9 9 LEU H H 9 7.922 7.922 7.722 0.200 19498
15 1 . 1 1 10 10 ALA N N 10 122.287 122.287 123.763 -1.476 19498
16 1 . 1 1 10 10 ALA HA H 10 4.127 4.127 4.006 0.121 19498
17 1 . 1 1 10 10 ALA CA C 10 55.912 55.912 55.267 0.644 19498
18 1 . 1 1 10 10 ALA CB C 10 17.998 17.998 18.141 -0.143 19498
19 1 . 1 1 10 10 ALA H H 10 8.064 8.064 7.999 0.065 19498
20 1 . 1 1 11 11 ALA N N 11 121.326 121.326 119.888 1.439 19498
21 1 . 1 1 11 11 ALA HA H 11 4.207 4.207 4.179 0.028 19498
22 1 . 1 1 11 11 ALA CA C 11 54.960 54.960 54.102 0.858 19498
23 1 . 1 1 11 11 ALA CB C 11 17.998 17.998 18.423 -0.425 19498
24 1 . 1 1 11 11 ALA H H 11 8.143 8.143 8.142 0.001 19498
25 1 . 1 1 12 12 PHE N N 12 122.913 122.913 119.525 3.388 19498
26 1 . 1 1 12 12 PHE HA H 12 4.411 4.411 4.130 0.281 19498
27 1 . 1 1 12 12 PHE CA C 12 61.007 61.007 61.166 -0.159 19498
28 1 . 1 1 12 12 PHE CB C 12 39.499 39.499 39.211 0.288 19498
29 1 . 1 1 12 12 PHE H H 12 7.779 7.779 8.076 -0.297 19498
30 1 . 1 1 13 13 LYS N N 13 120.689 120.689 118.105 2.585 19498
31 1 . 1 1 13 13 LYS HA H 13 3.861 3.861 4.054 -0.193 19498
32 1 . 1 1 13 13 LYS CA C 13 59.099 59.099 58.841 0.258 19498
33 1 . 1 1 13 13 LYS CB C 13 31.867 31.867 31.861 0.006 19498
34 1 . 1 1 13 13 LYS H H 13 8.614 8.614 8.525 0.089 19498
35 1 . 1 1 14 14 ALA N N 14 122.076 122.076 121.076 1.000 19498
36 1 . 1 1 14 14 ALA HA H 14 3.182 3.182 4.133 -0.951 19498
37 1 . 1 1 14 14 ALA CA C 14 55.108 55.108 54.687 0.421 19498
38 1 . 1 1 14 14 ALA CB C 14 18.120 18.120 18.067 0.053 19498
39 1 . 1 1 14 14 ALA H H 14 8.178 8.178 7.638 0.540 19498
40 1 . 1 1 15 15 ALA N N 15 121.714 121.714 119.864 1.850 19498
41 1 . 1 1 15 15 ALA HA H 15 4.040 4.040 4.007 0.033 19498
42 1 . 1 1 15 15 ALA CA C 15 55.158 55.158 54.477 0.681 19498
43 1 . 1 1 15 15 ALA CB C 15 19.042 19.042 18.192 0.850 19498
44 1 . 1 1 15 15 ALA H H 15 7.793 7.793 7.630 0.163 19498
45 1 . 1 1 16 16 THR N N 16 111.959 111.959 114.807 -2.848 19498
46 1 . 1 1 16 16 THR HA H 16 3.705 3.705 3.868 -0.163 19498
47 1 . 1 1 16 16 THR CA C 16 66.762 66.762 67.203 -0.441 19498
48 1 . 1 1 16 16 THR CB C 16 68.213 68.213 68.491 -0.278 19498
49 1 . 1 1 16 16 THR H H 16 8.133 8.133 7.633 0.500 19498
50 1 . 1 1 17 17 ASN N N 17 121.090 121.090 118.535 2.555 19498
51 1 . 1 1 17 17 ASN HA H 17 4.520 4.520 4.567 -0.047 19498
52 1 . 1 1 17 17 ASN CA C 17 56.191 56.191 55.800 0.391 19498
53 1 . 1 1 17 17 ASN CB C 17 38.365 38.365 38.570 -0.205 19498
54 1 . 1 1 17 17 ASN H H 17 8.152 8.152 7.902 0.249 19498
55 1 . 1 1 18 18 LYS N N 18 119.978 119.978 119.186 0.792 19498
56 1 . 1 1 18 18 LYS HA H 18 3.914 3.914 4.063 -0.149 19498
57 1 . 1 1 18 18 LYS CA C 18 59.865 59.865 58.314 1.551 19498
58 1 . 1 1 18 18 LYS CB C 18 30.999 30.999 31.818 -0.819 19498
59 1 . 1 1 18 18 LYS H H 18 7.568 7.568 7.579 -0.011 19498
60 1 . 1 1 19 19 LEU N N 19 117.558 117.558 119.550 -1.992 19498
61 1 . 1 1 19 19 LEU HA H 19 4.135 4.135 4.164 -0.029 19498
62 1 . 1 1 19 19 LEU CA C 19 58.001 58.001 57.776 0.225 19498
63 1 . 1 1 19 19 LEU CB C 19 40.823 40.823 41.783 -0.960 19498
64 1 . 1 1 19 19 LEU H H 19 7.001 7.001 7.632 -0.631 19498
65 1 . 1 1 20 20 PHE N N 20 121.123 121.123 118.049 3.074 19498
66 1 . 1 1 20 20 PHE HA H 20 4.873 4.873 4.200 0.673 19498
67 1 . 1 1 20 20 PHE CA C 20 60.375 60.375 60.961 -0.586 19498
68 1 . 1 1 20 20 PHE CB C 20 38.480 38.480 38.926 -0.447 19498
69 1 . 1 1 20 20 PHE H H 20 8.193 8.193 7.716 0.477 19498
70 1 . 1 1 21 21 GLN N N 21 118.591 118.591 116.476 2.115 19498
71 1 . 1 1 21 21 GLN HA H 21 4.208 4.208 4.101 0.107 19498
72 1 . 1 1 21 21 GLN CA C 21 58.055 58.055 57.691 0.364 19498
73 1 . 1 1 21 21 GLN CB C 21 28.284 28.284 28.808 -0.524 19498
74 1 . 1 1 21 21 GLN H H 21 7.918 7.918 7.909 0.009 19498
75 1 . 1 1 22 22 LEU N N 22 118.477 118.477 118.168 0.309 19498
76 1 . 1 1 22 22 LEU HA H 22 4.534 4.534 4.479 0.055 19498
77 1 . 1 1 22 22 LEU CA C 22 54.033 54.033 54.378 -0.345 19498
78 1 . 1 1 22 22 LEU CB C 22 41.469 41.469 43.025 -1.556 19498
79 1 . 1 1 22 22 LEU H H 22 7.561 7.561 7.535 0.026 19498
80 1 . 1 1 23 23 ASP N N 23 115.410 115.410 117.876 -2.466 19498
81 1 . 1 1 23 23 ASP HA H 23 4.280 4.280 4.152 0.128 19498
82 1 . 1 1 23 23 ASP CA C 23 55.494 55.494 55.484 0.010 19498
83 1 . 1 1 23 23 ASP CB C 23 39.317 39.317 39.041 0.276 19498
84 1 . 1 1 23 23 ASP H H 23 8.163 8.163 7.779 0.384 19498
85 1 . 1 1 24 24 LEU N N 24 116.367 116.367 114.870 1.497 19498
86 1 . 1 1 24 24 LEU HA H 24 4.790 4.790 4.832 -0.042 19498
87 1 . 1 1 24 24 LEU CA C 24 53.030 53.030 53.291 -0.261 19498
88 1 . 1 1 24 24 LEU CB C 24 43.867 43.867 44.064 -0.197 19498
89 1 . 1 1 24 24 LEU H H 24 7.136 7.136 7.586 -0.450 19498
90 1 . 1 1 25 25 ALA N N 25 123.243 123.243 120.957 2.286 19498
91 1 . 1 1 25 25 ALA HA H 25 4.480 4.480 4.767 -0.287 19498
92 1 . 1 1 25 25 ALA CA C 25 50.890 50.890 51.580 -0.690 19498
93 1 . 1 1 25 25 ALA CB C 25 21.655 21.655 21.689 -0.034 19498
94 1 . 1 1 25 25 ALA H H 25 8.931 8.931 8.357 0.574 19498
95 1 . 1 1 26 26 VAL N N 26 119.587 119.587 120.797 -1.210 19498
96 1 . 1 1 26 26 VAL HA H 26 4.889 4.889 4.736 0.153 19498
97 1 . 1 1 26 26 VAL CA C 26 61.278 61.278 61.210 0.068 19498
98 1 . 1 1 26 26 VAL CB C 26 33.310 33.310 34.782 -1.472 19498
99 1 . 1 1 26 26 VAL H H 26 7.575 7.575 8.318 -0.743 19498
100 1 . 1 1 27 27 ILE N N 27 130.377 130.377 124.735 5.642 19498
101 1 . 1 1 27 27 ILE HA H 27 4.489 4.489 4.791 -0.302 19498
102 1 . 1 1 27 27 ILE CA C 27 60.177 60.177 60.373 -0.196 19498
103 1 . 1 1 27 27 ILE CB C 27 40.019 40.019 40.323 -0.304 19498
104 1 . 1 1 27 27 ILE H H 27 9.437 9.437 8.584 0.853 19498
105 1 . 1 1 28 28 TYR N N 28 126.844 126.844 121.809 5.035 19498
106 1 . 1 1 28 28 TYR HA H 28 5.709 5.709 5.674 0.035 19498
107 1 . 1 1 28 28 TYR CA C 28 55.486 55.486 55.061 0.425 19498
108 1 . 1 1 28 28 TYR CB C 28 42.019 42.019 40.798 1.221 19498
109 1 . 1 1 28 28 TYR H H 28 8.531 8.531 8.181 0.350 19498
110 1 . 1 1 29 29 ASP N N 29 122.875 122.875 122.541 0.334 19498
111 1 . 1 1 29 29 ASP HA H 29 4.966 4.966 4.789 0.177 19498
112 1 . 1 1 29 29 ASP CA C 29 53.659 53.659 53.882 -0.223 19498
113 1 . 1 1 29 29 ASP CB C 29 44.660 44.660 43.609 1.051 19498
114 1 . 1 1 29 29 ASP H H 29 8.614 8.614 8.687 -0.073 19498
115 1 . 1 1 30 30 ASP N N 30 119.325 119.325 122.121 -2.796 19498
116 1 . 1 1 30 30 ASP HA H 30 5.447 5.447 4.828 0.619 19498
117 1 . 1 1 30 30 ASP CA C 30 53.501 53.501 53.747 -0.246 19498
118 1 . 1 1 30 30 ASP CB C 30 43.921 43.921 42.741 1.180 19498
119 1 . 1 1 30 30 ASP H H 30 8.607 8.607 8.335 0.272 19498
120 1 . 1 1 31 31 TRP N N 31 120.552 120.552 123.167 -2.615 19498
121 1 . 1 1 31 31 TRP HA H 31 4.615 4.615 4.591 0.025 19498
122 1 . 1 1 31 31 TRP CA C 31 58.000 58.000 57.633 0.367 19498
123 1 . 1 1 31 31 TRP CB C 31 31.500 31.500 29.508 1.993 19498
124 1 . 1 1 31 31 TRP H H 31 8.673 8.673 8.470 0.203 19498
125 1 . 1 1 32 32 TYR CA C 32 52.400 52.400 57.418 -5.018 19498
126 1 . 1 1 32 32 TYR CB C 32 42.350 42.350 39.176 3.174 19498
127 1 . 1 1 33 33 ASP CA C 33 52.400 52.400 54.413 -2.013 19498
128 1 . 1 1 33 33 ASP CB C 33 42.350 42.350 41.129 1.221 19498
129 1 . 1 1 34 34 ALA N N 34 126.709 126.709 122.725 3.984 19498
130 1 . 1 1 34 34 ALA HA H 34 3.845 3.845 4.392 -0.547 19498
131 1 . 1 1 34 34 ALA CA C 34 58.599 58.599 51.837 6.762 19498
132 1 . 1 1 34 34 ALA CB C 34 18.610 18.610 19.426 -0.816 19498
133 1 . 1 1 34 34 ALA H H 34 8.424 8.424 7.812 0.612 19498
134 1 . 1 1 35 35 TYR N N 35 117.123 117.123 121.137 -4.014 19498
135 1 . 1 1 35 35 TYR HA H 35 4.350 4.350 4.373 -0.023 19498
136 1 . 1 1 35 35 TYR CA C 35 60.466 60.466 59.574 0.892 19498
137 1 . 1 1 35 35 TYR CB C 35 38.113 38.113 38.569 -0.456 19498
138 1 . 1 1 35 35 TYR H H 35 8.334 8.334 8.591 -0.257 19498
139 1 . 1 1 36 36 THR N N 36 108.046 108.046 111.727 -3.681 19498
140 1 . 1 1 36 36 THR HA H 36 4.018 4.018 4.158 -0.140 19498
141 1 . 1 1 36 36 THR CA C 36 61.809 61.809 62.034 -0.225 19498
142 1 . 1 1 36 36 THR CB C 36 69.926 69.926 68.387 1.539 19498
143 1 . 1 1 36 36 THR H H 36 7.563 7.563 7.899 -0.336 19498
144 1 . 1 1 37 37 ARG N N 37 118.456 118.456 120.242 -1.786 19498
145 1 . 1 1 37 37 ARG CA C 37 57.001 57.001 56.172 0.829 19498
146 1 . 1 1 37 37 ARG H H 37 7.952 7.952 7.716 0.236 19498
147 1 . 1 1 40 40 CYS CA C 40 56.316 56.316 57.495 -1.179 19498
148 1 . 1 1 40 40 CYS CB C 40 29.999 29.999 30.473 -0.474 19498
149 1 . 1 1 41 41 ILE N N 41 121.419 121.419 122.965 -1.546 19498
150 1 . 1 1 41 41 ILE HA H 41 4.709 4.709 4.601 0.108 19498
151 1 . 1 1 41 41 ILE CA C 41 60.462 60.462 60.663 -0.202 19498
152 1 . 1 1 41 41 ILE CB C 41 42.309 42.309 40.687 1.622 19498
153 1 . 1 1 41 41 ILE H H 41 8.459 8.459 8.427 0.032 19498
154 1 . 1 1 42 42 ARG N N 42 127.916 127.916 126.694 1.222 19498
155 1 . 1 1 42 42 ARG CA C 42 54.501 54.501 54.723 -0.222 19498
156 1 . 1 1 42 42 ARG CB C 42 33.204 33.204 33.273 -0.069 19498
157 1 . 1 1 42 42 ARG H H 42 9.004 9.004 8.718 0.286 19498
158 1 . 1 1 43 43 LEU N N 43 124.715 124.715 126.099 -1.384 19498
159 1 . 1 1 43 43 LEU HA H 43 5.538 5.538 4.891 0.647 19498
160 1 . 1 1 43 43 LEU CA C 43 53.266 53.266 54.240 -0.974 19498
161 1 . 1 1 43 43 LEU CB C 43 46.163 46.163 44.039 2.124 19498
162 1 . 1 1 43 43 LEU H H 43 8.757 8.757 8.967 -0.210 19498
163 1 . 1 1 44 44 ARG N N 44 123.499 123.499 126.451 -2.952 19498
164 1 . 1 1 44 44 ARG HA H 44 5.004 5.004 4.862 0.142 19498
165 1 . 1 1 44 44 ARG CA C 44 55.508 55.508 54.804 0.704 19498
166 1 . 1 1 44 44 ARG CB C 44 34.543 34.543 33.263 1.280 19498
167 1 . 1 1 44 44 ARG H H 44 9.366 9.366 9.125 0.241 19498
168 1 . 1 1 45 45 ILE N N 45 122.919 122.919 127.045 -4.126 19498
169 1 . 1 1 45 45 ILE HA H 45 5.260 5.260 4.658 0.602 19498
170 1 . 1 1 45 45 ILE CA C 45 59.933 59.933 59.022 0.911 19498
171 1 . 1 1 45 45 ILE CB C 45 39.751 39.751 39.070 0.681 19498
172 1 . 1 1 45 45 ILE H H 45 8.938 8.938 8.651 0.287 19498
173 1 . 1 1 46 46 GLU N N 46 126.745 126.745 125.391 1.354 19498
174 1 . 1 1 46 46 GLU HA H 46 5.465 5.465 4.816 0.649 19498
175 1 . 1 1 46 46 GLU CA C 46 53.707 53.707 54.736 -1.030 19498
176 1 . 1 1 46 46 GLU CB C 46 35.276 35.276 33.463 1.813 19498
177 1 . 1 1 46 46 GLU H H 46 9.097 9.097 8.512 0.585 19498
178 1 . 1 1 47 47 ASP N N 47 117.988 117.988 121.700 -3.712 19498
179 1 . 1 1 47 47 ASP HA H 47 4.976 4.976 4.757 0.219 19498
180 1 . 1 1 47 47 ASP CA C 47 52.411 52.411 53.253 -0.842 19498
181 1 . 1 1 47 47 ASP CB C 47 41.609 41.609 43.021 -1.412 19498
182 1 . 1 1 47 47 ASP H H 47 8.209 8.209 8.681 -0.472 19498
183 1 . 1 1 48 48 ARG N N 48 117.098 117.098 121.530 -4.432 19498
184 1 . 1 1 48 48 ARG HA H 48 4.129 4.129 4.332 -0.204 19498
185 1 . 1 1 48 48 ARG CA C 48 58.323 58.323 57.256 1.067 19498
186 1 . 1 1 48 48 ARG CB C 48 29.511 29.511 29.595 -0.084 19498
187 1 . 1 1 48 48 ARG H H 48 8.872 8.872 8.675 0.197 19498
188 1 . 1 1 49 49 SER N N 49 115.006 115.006 114.499 0.507 19498
189 1 . 1 1 49 49 SER HA H 49 4.614 4.614 4.573 0.041 19498
190 1 . 1 1 49 49 SER CA C 49 58.411 58.411 58.236 0.175 19498
191 1 . 1 1 49 49 SER CB C 49 63.806 63.806 63.820 -0.014 19498
192 1 . 1 1 49 49 SER H H 49 8.142 8.142 8.115 0.027 19498
193 1 . 1 1 50 50 GLY N N 50 109.042 109.042 109.827 -0.785 19498
194 1 . 1 1 50 50 GLY CA C 50 44.997 44.997 45.363 -0.366 19498
195 1 . 1 1 50 50 GLY H H 50 8.035 8.035 8.076 -0.041 19498
196 1 . 1 1 51 51 ASN N N 51 119.842 119.842 119.596 0.246 19498
197 1 . 1 1 51 51 ASN HA H 51 4.546 4.546 4.823 -0.277 19498
198 1 . 1 1 51 51 ASN CA C 51 53.419 53.419 52.957 0.463 19498
199 1 . 1 1 51 51 ASN CB C 51 38.422 38.422 39.961 -1.539 19498
200 1 . 1 1 51 51 ASN H H 51 8.613 8.613 8.130 0.483 19498
201 1 . 1 1 52 52 LEU N N 52 124.085 124.085 121.049 3.036 19498
202 1 . 1 1 52 52 LEU HA H 52 4.142 4.142 4.530 -0.388 19498
203 1 . 1 1 52 52 LEU CA C 52 56.023 56.023 55.275 0.748 19498
204 1 . 1 1 52 52 LEU CB C 52 42.353 42.353 42.719 -0.366 19498
205 1 . 1 1 52 52 LEU H H 52 8.631 8.631 8.332 0.299 19498
206 1 . 1 1 53 53 ILE N N 53 129.362 129.362 122.159 7.203 19498
207 1 . 1 1 53 53 ILE HA H 53 4.137 4.137 4.353 -0.216 19498
208 1 . 1 1 53 53 ILE CA C 53 61.800 61.800 61.735 0.065 19498
209 1 . 1 1 53 53 ILE CB C 53 37.256 37.256 38.887 -1.631 19498
210 1 . 1 1 53 53 ILE H H 53 9.432 9.432 8.566 0.866 19498
211 1 . 1 1 54 54 ASP N N 54 113.575 113.575 117.415 -3.840 19498
212 1 . 1 1 54 54 ASP HA H 54 4.847 4.847 4.952 -0.105 19498
213 1 . 1 1 54 54 ASP CA C 54 53.586 53.586 54.223 -0.637 19498
214 1 . 1 1 54 54 ASP CB C 54 44.500 44.500 44.151 0.349 19498
215 1 . 1 1 54 54 ASP H H 54 7.761 7.761 8.013 -0.252 19498
216 1 . 1 1 55 55 THR N N 55 115.783 115.783 114.130 1.653 19498
217 1 . 1 1 55 55 THR HA H 55 5.427 5.427 5.082 0.345 19498
218 1 . 1 1 55 55 THR CA C 55 59.185 59.185 61.156 -1.971 19498
219 1 . 1 1 55 55 THR CB C 55 70.551 70.551 71.555 -1.004 19498
220 1 . 1 1 55 55 THR H H 55 10.106 10.106 8.316 1.790 19498
221 1 . 1 1 56 56 SER N N 56 119.808 119.808 118.870 0.939 19498
222 1 . 1 1 56 56 SER HA H 56 4.135 4.135 4.533 -0.398 19498
223 1 . 1 1 56 56 SER CA C 56 58.001 58.001 57.341 0.660 19498
224 1 . 1 1 56 56 SER CB C 56 65.039 65.039 64.987 0.052 19498
225 1 . 1 1 56 56 SER H H 56 7.872 7.872 8.787 -0.915 19498
226 1 . 1 1 57 57 THR N N 57 117.962 117.962 120.605 -2.643 19498
227 1 . 1 1 57 57 THR HA H 57 4.964 4.964 4.697 0.267 19498
228 1 . 1 1 57 57 THR CA C 57 61.001 61.001 61.810 -0.809 19498
229 1 . 1 1 57 57 THR CB C 57 70.881 70.881 70.205 0.676 19498
230 1 . 1 1 57 57 THR H H 57 7.524 7.524 8.055 -0.531 19498
231 1 . 1 1 58 58 PHE N N 58 123.853 123.853 127.120 -3.267 19498
232 1 . 1 1 58 58 PHE HA H 58 4.603 4.603 4.718 -0.115 19498
233 1 . 1 1 58 58 PHE CA C 58 56.648 56.648 57.347 -0.699 19498
234 1 . 1 1 58 58 PHE CB C 58 43.583 43.583 41.095 2.488 19498
235 1 . 1 1 58 58 PHE H H 58 8.861 8.861 8.976 -0.115 19498
236 1 . 1 1 59 59 TYR N N 59 117.898 117.898 120.757 -2.859 19498
237 1 . 1 1 59 59 TYR HA H 59 5.328 5.328 4.986 0.342 19498
238 1 . 1 1 59 59 TYR CA C 59 56.221 56.221 57.017 -0.796 19498
239 1 . 1 1 59 59 TYR CB C 59 42.106 42.106 39.886 2.220 19498
240 1 . 1 1 59 59 TYR H H 59 8.328 8.328 8.494 -0.165 19498
241 1 . 1 1 60 60 HIS CA C 60 60.065 60.065 55.976 4.089 19498
242 1 . 1 1 60 60 HIS CB C 60 34.284 34.284 31.636 2.649 19498
243 1 . 1 1 61 61 HIS N N 61 121.880 121.880 121.551 0.329 19498
244 1 . 1 1 61 61 HIS CA C 61 58.001 58.001 55.879 2.122 19498
245 1 . 1 1 61 61 HIS CB C 61 29.999 29.999 29.755 0.244 19498
246 1 . 1 1 61 61 HIS H H 61 7.734 7.734 8.286 -0.552 19498
247 1 . 1 1 62 62 ASP N N 62 128.148 128.148 122.488 5.660 19498
248 1 . 1 1 62 62 ASP HA H 62 4.870 4.870 4.583 0.287 19498
249 1 . 1 1 62 62 ASP CA C 62 53.348 53.348 54.470 -1.122 19498
250 1 . 1 1 62 62 ASP CB C 62 42.600 42.600 42.554 0.046 19498
251 1 . 1 1 62 62 ASP H H 62 11.492 11.492 7.986 3.506 19498
252 1 . 1 1 63 63 GLU N N 63 126.564 126.564 123.897 2.667 19498
253 1 . 1 1 63 63 GLU HA H 63 3.795 3.795 3.920 -0.125 19498
254 1 . 1 1 63 63 GLU CA C 63 59.863 59.863 59.606 0.257 19498
255 1 . 1 1 63 63 GLU CB C 63 34.007 34.007 29.712 4.295 19498
256 1 . 1 1 63 63 GLU H H 63 8.982 8.982 8.808 0.174 19498
257 1 . 1 1 64 64 ASP N N 64 117.779 117.779 119.779 -2.000 19498
258 1 . 1 1 64 64 ASP HA H 64 4.401 4.401 4.474 -0.073 19498
259 1 . 1 1 64 64 ASP CA C 64 57.664 57.664 57.284 0.380 19498
260 1 . 1 1 64 64 ASP CB C 64 40.369 40.369 40.789 -0.420 19498
261 1 . 1 1 64 64 ASP H H 64 8.272 8.272 8.061 0.211 19498
262 1 . 1 1 65 65 VAL N N 65 121.948 121.948 120.368 1.580 19498
263 1 . 1 1 65 65 VAL HA H 65 3.386 3.386 3.801 -0.415 19498
264 1 . 1 1 65 65 VAL CA C 65 65.913 65.913 65.625 0.288 19498
265 1 . 1 1 65 65 VAL CB C 65 31.465 31.465 31.765 -0.300 19498
266 1 . 1 1 65 65 VAL H H 65 7.335 7.335 8.069 -0.734 19498
267 1 . 1 1 66 66 LEU N N 66 120.747 120.747 121.183 -0.436 19498
268 1 . 1 1 66 66 LEU HA H 66 3.905 3.905 3.903 0.002 19498
269 1 . 1 1 66 66 LEU CA C 66 58.076 58.076 58.103 -0.027 19498
270 1 . 1 1 66 66 LEU CB C 66 42.160 42.160 40.750 1.410 19498
271 1 . 1 1 66 66 LEU H H 66 8.164 8.164 7.709 0.455 19498
272 1 . 1 1 67 67 PHE N N 67 116.553 116.553 117.270 -0.717 19498
273 1 . 1 1 67 67 PHE HA H 67 3.900 3.900 4.080 -0.180 19498
274 1 . 1 1 67 67 PHE CA C 67 62.849 62.849 62.039 0.810 19498
275 1 . 1 1 67 67 PHE CB C 67 38.003 38.003 38.006 -0.003 19498
276 1 . 1 1 67 67 PHE H H 67 8.350 8.350 7.868 0.482 19498
277 1 . 1 1 68 68 ASN N N 68 121.020 121.020 118.521 2.499 19498
278 1 . 1 1 68 68 ASN HA H 68 4.415 4.415 4.435 -0.020 19498
279 1 . 1 1 68 68 ASN CA C 68 56.725 56.725 56.351 0.374 19498
280 1 . 1 1 68 68 ASN CB C 68 38.071 38.071 38.557 -0.486 19498
281 1 . 1 1 68 68 ASN H H 68 8.001 8.001 7.845 0.157 19498
282 1 . 1 1 69 69 MET N N 69 120.402 120.402 118.768 1.634 19498
283 1 . 1 1 69 69 MET HA H 69 4.011 4.011 4.121 -0.111 19498
284 1 . 1 1 69 69 MET CA C 69 59.605 59.605 59.297 0.308 19498
285 1 . 1 1 69 69 MET CB C 69 31.867 31.867 32.555 -0.688 19498
286 1 . 1 1 69 69 MET H H 69 8.465 8.465 7.912 0.553 19498
287 1 . 1 1 70 70 CYS N N 70 117.496 117.496 117.010 0.486 19498
288 1 . 1 1 70 70 CYS CA C 70 63.145 63.145 63.611 -0.466 19498
289 1 . 1 1 70 70 CYS CB C 70 27.510 27.510 27.070 0.440 19498
290 1 . 1 1 70 70 CYS H H 70 7.616 7.616 7.710 -0.094 19498
291 1 . 1 1 71 71 THR N N 71 118.640 118.640 115.213 3.427 19498
292 1 . 1 1 71 71 THR HA H 71 4.270 4.270 4.089 0.181 19498
293 1 . 1 1 71 71 THR CA C 71 67.980 67.980 66.215 1.765 19498
294 1 . 1 1 71 71 THR CB C 71 67.949 67.949 68.545 -0.596 19498
295 1 . 1 1 71 71 THR H H 71 8.509 8.509 8.042 0.467 19498
296 1 . 1 1 72 72 ASP HA H 72 4.430 4.430 4.472 -0.042 19498
297 1 . 1 1 72 72 ASP CA C 72 57.590 57.590 57.718 -0.128 19498
298 1 . 1 1 72 72 ASP CB C 72 40.415 40.415 40.819 -0.404 19498
299 1 . 1 1 73 73 TRP N N 73 121.657 121.657 121.223 0.434 19498
300 1 . 1 1 73 73 TRP HA H 73 4.407 4.407 4.383 0.024 19498
301 1 . 1 1 73 73 TRP CA C 73 62.951 62.951 61.652 1.299 19498
302 1 . 1 1 73 73 TRP CB C 73 29.114 29.114 29.838 -0.724 19498
303 1 . 1 1 73 73 TRP H H 73 7.780 7.780 7.627 0.154 19498
304 1 . 1 1 74 74 LEU N N 74 118.727 118.727 118.492 0.235 19498
305 1 . 1 1 74 74 LEU HA H 74 3.582 3.582 3.795 -0.213 19498
306 1 . 1 1 74 74 LEU CA C 74 58.184 58.184 57.957 0.227 19498
307 1 . 1 1 74 74 LEU CB C 74 37.610 37.610 41.609 -3.999 19498
308 1 . 1 1 74 74 LEU H H 74 8.490 8.490 7.763 0.727 19498
309 1 . 1 1 75 75 ASN N N 75 117.962 117.962 116.886 1.076 19498
310 1 . 1 1 75 75 ASN HA H 75 4.527 4.527 4.547 -0.020 19498
311 1 . 1 1 75 75 ASN CA C 75 56.501 56.501 55.817 0.683 19498
312 1 . 1 1 75 75 ASN CB C 75 37.999 37.999 38.424 -0.425 19498
313 1 . 1 1 75 75 ASN H H 75 8.639 8.639 7.952 0.687 19498
314 1 . 1 1 76 76 HIS N N 76 120.823 120.823 119.245 1.578 19498
315 1 . 1 1 76 76 HIS HA H 76 4.450 4.450 4.209 0.241 19498
316 1 . 1 1 76 76 HIS CA C 76 58.737 58.737 59.264 -0.528 19498
317 1 . 1 1 76 76 HIS CB C 76 28.007 28.007 29.782 -1.775 19498
318 1 . 1 1 76 76 HIS H H 76 8.158 8.158 7.702 0.457 19498
319 1 . 1 1 77 77 MET N N 77 118.749 118.749 115.549 3.201 19498
320 1 . 1 1 77 77 MET HA H 77 4.071 4.071 3.792 0.279 19498
321 1 . 1 1 77 77 MET CA C 77 55.827 55.827 57.631 -1.804 19498
322 1 . 1 1 77 77 MET CB C 77 29.541 29.541 31.865 -2.324 19498
323 1 . 1 1 77 77 MET H H 77 8.404 8.404 7.220 1.184 19498
324 1 . 1 1 78 78 TYR N N 78 120.762 120.762 119.719 1.043 19498
325 1 . 1 1 78 78 TYR HA H 78 3.662 3.662 3.989 -0.327 19498
326 1 . 1 1 78 78 TYR CA C 78 62.640 62.640 61.608 1.032 19498
327 1 . 1 1 78 78 TYR CB C 78 37.545 37.545 37.632 -0.087 19498
328 1 . 1 1 78 78 TYR H H 78 8.322 8.322 7.513 0.809 19498
329 1 . 1 1 79 79 ASP N N 79 116.578 116.578 117.314 -0.735 19498
330 1 . 1 1 79 79 ASP HA H 79 4.106 4.106 4.350 -0.244 19498
331 1 . 1 1 79 79 ASP CA C 79 57.410 57.410 57.149 0.261 19498
332 1 . 1 1 79 79 ASP CB C 79 40.503 40.503 40.637 -0.134 19498
333 1 . 1 1 79 79 ASP H H 79 7.460 7.460 8.101 -0.641 19498
334 1 . 1 1 80 80 GLN N N 80 116.175 116.175 119.146 -2.971 19498
335 1 . 1 1 80 80 GLN HA H 80 4.056 4.056 4.084 -0.028 19498
336 1 . 1 1 80 80 GLN CA C 80 57.629 57.629 58.251 -0.622 19498
337 1 . 1 1 80 80 GLN CB C 80 29.662 29.662 28.740 0.922 19498
338 1 . 1 1 80 80 GLN H H 80 7.552 7.552 7.780 -0.228 19498
339 1 . 1 1 81 81 LEU N N 81 118.398 118.398 117.476 0.922 19498
340 1 . 1 1 81 81 LEU HA H 81 4.233 4.233 4.192 0.041 19498
341 1 . 1 1 81 81 LEU CA C 81 55.461 55.461 56.238 -0.777 19498
342 1 . 1 1 81 81 LEU CB C 81 42.406 42.406 41.663 0.743 19498
343 1 . 1 1 81 81 LEU H H 81 7.957 7.957 7.591 0.366 19498
344 1 . 1 1 82 82 LYS N N 82 119.114 119.114 118.457 0.657 19498
345 1 . 1 1 82 82 LYS HA H 82 3.841 3.841 4.161 -0.320 19498
346 1 . 1 1 82 82 LYS CA C 82 58.510 58.510 58.448 0.062 19498
347 1 . 1 1 82 82 LYS CB C 82 30.922 30.922 32.503 -1.581 19498
348 1 . 1 1 82 82 LYS H H 82 7.664 7.664 7.601 0.063 19498
349 1 . 1 1 83 83 ASP N N 83 118.655 118.655 118.454 0.201 19498
350 1 . 1 1 83 83 ASP HA H 83 4.819 4.819 4.547 0.272 19498
351 1 . 1 1 83 83 ASP CA C 83 53.886 53.886 55.386 -1.500 19498
352 1 . 1 1 83 83 ASP CB C 83 40.986 40.986 41.331 -0.345 19498
353 1 . 1 1 83 83 ASP H H 83 7.862 7.862 7.766 0.096 19498
354 1 . 1 1 84 84 TRP N N 84 121.757 121.757 120.992 0.765 19498
355 1 . 1 1 84 84 TRP CA C 84 58.462 58.462 56.375 2.087 19498
356 1 . 1 1 84 84 TRP CB C 84 28.934 28.934 29.363 -0.429 19498
357 1 . 1 1 84 84 TRP H H 84 7.925 7.925 7.613 0.312 19498
stop_
save_