data_19946
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19946
_Entry.PDB_ID 2MOL
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 19946
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 LEU N N 2 120.763 120.763 123.410 -2.647 19946
2 1 1 . 1 1 2 2 LEU HA H 2 4.384 4.384 4.224 0.160 19946
3 1 1 . 1 1 2 2 LEU CA C 2 53.827 53.827 55.108 -1.281 19946
4 1 1 . 1 1 2 2 LEU CB C 2 42.229 42.229 41.369 0.860 19946
5 1 1 . 1 1 2 2 LEU H H 2 7.888 7.888 8.412 -0.524 19946
6 1 1 . 1 1 3 3 THR N N 3 118.330 118.330 119.696 -1.366 19946
7 1 1 . 1 1 3 3 THR HA H 3 4.469 4.469 4.734 -0.265 19946
8 1 1 . 1 1 3 3 THR CA C 3 61.391 61.391 60.758 0.633 19946
9 1 1 . 1 1 3 3 THR CB C 3 69.496 69.496 71.692 -2.196 19946
10 1 1 . 1 1 3 3 THR H H 3 7.905 7.905 7.823 0.082 19946
11 1 1 . 1 1 4 4 THR N N 4 122.024 122.024 115.357 6.667 19946
12 1 1 . 1 1 4 4 THR HA H 4 5.171 5.171 5.688 -0.517 19946
13 1 1 . 1 1 4 4 THR CA C 4 61.595 61.595 59.358 2.237 19946
14 1 1 . 1 1 4 4 THR CB C 4 69.027 69.027 70.407 -1.380 19946
15 1 1 . 1 1 4 4 THR H H 4 8.504 8.504 8.381 0.123 19946
16 1 1 . 1 1 5 5 ILE N N 5 122.667 122.667 116.455 6.212 19946
17 1 1 . 1 1 5 5 ILE HA H 5 4.973 4.973 4.640 0.333 19946
18 1 1 . 1 1 5 5 ILE CA C 5 57.971 57.971 58.986 -1.015 19946
19 1 1 . 1 1 5 5 ILE CB C 5 41.458 41.458 41.267 0.192 19946
20 1 1 . 1 1 5 5 ILE H H 5 8.903 8.903 8.280 0.623 19946
21 1 1 . 1 1 6 6 SER N N 6 123.156 123.156 114.750 8.406 19946
22 1 1 . 1 1 6 6 SER HA H 6 4.785 4.785 4.949 -0.164 19946
23 1 1 . 1 1 6 6 SER H H 6 9.138 9.138 8.218 0.920 19946
24 1 1 . 1 1 7 7 PRO HA H 7 4.004 4.004 4.583 -0.579 19946
25 1 1 . 1 1 7 7 PRO CA C 7 65.510 65.510 63.359 2.151 19946
26 1 1 . 1 1 7 7 PRO CB C 7 30.924 30.924 30.173 0.751 19946
27 1 1 . 1 1 8 8 HIS N N 8 114.319 114.319 116.639 -2.320 19946
28 1 1 . 1 1 8 8 HIS HA H 8 3.989 3.989 4.647 -0.658 19946
29 1 1 . 1 1 8 8 HIS CA C 8 60.050 60.050 57.552 2.498 19946
30 1 1 . 1 1 8 8 HIS CB C 8 28.613 28.613 32.183 -3.570 19946
31 1 1 . 1 1 8 8 HIS H H 8 8.127 8.127 8.439 -0.312 19946
32 1 1 . 1 1 9 9 ASP N N 9 121.300 121.300 121.549 -0.249 19946
33 1 1 . 1 1 9 9 ASP HA H 9 4.301 4.301 4.673 -0.372 19946
34 1 1 . 1 1 9 9 ASP CA C 9 56.455 56.455 55.453 1.002 19946
35 1 1 . 1 1 9 9 ASP CB C 9 38.699 38.699 41.699 -3.000 19946
36 1 1 . 1 1 9 9 ASP H H 9 7.639 7.639 8.002 -0.363 19946
37 1 1 . 1 1 10 10 ALA N N 10 123.991 123.991 123.581 0.410 19946
38 1 1 . 1 1 10 10 ALA HA H 10 3.719 3.719 4.005 -0.286 19946
39 1 1 . 1 1 10 10 ALA CA C 10 54.331 54.331 54.892 -0.561 19946
40 1 1 . 1 1 10 10 ALA CB C 10 17.549 17.549 18.171 -0.622 19946
41 1 1 . 1 1 10 10 ALA H H 10 8.820 8.820 7.833 0.987 19946
42 1 1 . 1 1 11 11 GLN N N 11 118.128 118.128 116.708 1.420 19946
43 1 1 . 1 1 11 11 GLN HA H 11 3.933 3.933 4.191 -0.258 19946
44 1 1 . 1 1 11 11 GLN CA C 11 59.389 59.389 57.843 1.546 19946
45 1 1 . 1 1 11 11 GLN CB C 11 27.948 27.948 28.509 -0.561 19946
46 1 1 . 1 1 11 11 GLN H H 11 8.353 8.353 8.359 -0.006 19946
47 1 1 . 1 1 12 12 GLU N N 12 119.307 119.307 120.581 -1.274 19946
48 1 1 . 1 1 12 12 GLU HA H 12 4.023 4.023 4.294 -0.271 19946
49 1 1 . 1 1 12 12 GLU CA C 12 58.476 58.476 58.173 0.303 19946
50 1 1 . 1 1 12 12 GLU CB C 12 28.532 28.532 29.921 -1.389 19946
51 1 1 . 1 1 12 12 GLU H H 12 7.197 7.197 8.311 -1.114 19946
52 1 1 . 1 1 13 13 LEU N N 13 120.635 120.635 118.893 1.742 19946
53 1 1 . 1 1 13 13 LEU HA H 13 3.821 3.821 4.138 -0.317 19946
54 1 1 . 1 1 13 13 LEU CA C 13 57.065 57.065 57.591 -0.526 19946
55 1 1 . 1 1 13 13 LEU CB C 13 40.890 40.890 41.995 -1.105 19946
56 1 1 . 1 1 13 13 LEU H H 13 7.554 7.554 7.441 0.113 19946
57 1 1 . 1 1 14 14 ILE N N 14 123.021 123.021 119.314 3.707 19946
58 1 1 . 1 1 14 14 ILE HA H 14 3.827 3.827 4.017 -0.190 19946
59 1 1 . 1 1 14 14 ILE CA C 14 64.053 64.053 64.954 -0.901 19946
60 1 1 . 1 1 14 14 ILE CB C 14 38.115 38.115 37.785 0.330 19946
61 1 1 . 1 1 14 14 ILE H H 14 8.710 8.710 7.714 0.996 19946
62 1 1 . 1 1 15 15 ALA N N 15 124.504 124.504 119.396 5.108 19946
63 1 1 . 1 1 15 15 ALA HA H 15 4.115 4.115 4.224 -0.109 19946
64 1 1 . 1 1 15 15 ALA CA C 15 54.257 54.257 53.484 0.773 19946
65 1 1 . 1 1 15 15 ALA CB C 15 17.040 17.040 18.530 -1.490 19946
66 1 1 . 1 1 15 15 ALA H H 15 7.758 7.758 7.656 0.102 19946
67 1 1 . 1 1 16 16 ARG N N 16 115.990 115.990 117.557 -1.567 19946
68 1 1 . 1 1 16 16 ARG HA H 16 4.348 4.348 4.387 -0.039 19946
69 1 1 . 1 1 16 16 ARG CA C 16 55.416 55.416 56.269 -0.853 19946
70 1 1 . 1 1 16 16 ARG CB C 16 29.762 29.762 31.378 -1.616 19946
71 1 1 . 1 1 16 16 ARG H H 16 7.252 7.252 8.104 -0.852 19946
72 1 1 . 1 1 17 17 GLY N N 17 107.981 107.981 106.671 1.310 19946
73 1 1 . 1 1 17 17 GLY CA C 17 44.854 44.854 44.733 0.121 19946
74 1 1 . 1 1 17 17 GLY H H 17 7.748 7.748 7.809 -0.061 19946
75 1 1 . 1 1 18 18 ALA N N 18 123.914 123.914 122.199 1.715 19946
76 1 1 . 1 1 18 18 ALA HA H 18 4.221 4.221 4.835 -0.614 19946
77 1 1 . 1 1 18 18 ALA CA C 18 52.270 52.270 50.868 1.401 19946
78 1 1 . 1 1 18 18 ALA CB C 18 18.638 18.638 21.235 -2.597 19946
79 1 1 . 1 1 18 18 ALA H H 18 7.940 7.940 7.203 0.737 19946
80 1 1 . 1 1 19 19 LYS N N 19 119.436 119.436 123.819 -4.383 19946
81 1 1 . 1 1 19 19 LYS HA H 19 4.301 4.301 4.422 -0.121 19946
82 1 1 . 1 1 19 19 LYS CA C 19 53.105 53.105 55.851 -2.746 19946
83 1 1 . 1 1 19 19 LYS CB C 19 32.856 32.856 33.563 -0.707 19946
84 1 1 . 1 1 19 19 LYS H H 19 7.565 7.565 8.747 -1.182 19946
85 1 1 . 1 1 20 20 LEU N N 20 127.401 127.401 126.044 1.357 19946
86 1 1 . 1 1 20 20 LEU HA H 20 5.042 5.042 4.710 0.332 19946
87 1 1 . 1 1 20 20 LEU CA C 20 52.314 52.314 53.458 -1.144 19946
88 1 1 . 1 1 20 20 LEU CB C 20 43.234 43.234 43.502 -0.268 19946
89 1 1 . 1 1 20 20 LEU H H 20 8.727 8.727 8.368 0.359 19946
90 1 1 . 1 1 21 21 ILE N N 21 128.186 128.186 127.926 0.260 19946
91 1 1 . 1 1 21 21 ILE HA H 21 4.547 4.547 4.312 0.235 19946
92 1 1 . 1 1 21 21 ILE CA C 21 59.589 59.589 60.079 -0.490 19946
93 1 1 . 1 1 21 21 ILE CB C 21 38.545 38.545 38.886 -0.341 19946
94 1 1 . 1 1 21 21 ILE H H 21 9.366 9.366 7.894 1.472 19946
95 1 1 . 1 1 22 22 ASP N N 22 129.968 129.968 127.297 2.671 19946
96 1 1 . 1 1 22 22 ASP HA H 22 3.803 3.803 4.808 -1.005 19946
97 1 1 . 1 1 22 22 ASP CA C 22 51.435 51.435 52.096 -0.661 19946
98 1 1 . 1 1 22 22 ASP CB C 22 42.062 42.062 40.431 1.631 19946
99 1 1 . 1 1 22 22 ASP H H 22 8.583 8.583 7.848 0.735 19946
100 1 1 . 1 1 23 23 ILE N N 23 116.266 116.266 115.887 0.379 19946
101 1 1 . 1 1 23 23 ILE HA H 23 5.229 5.229 4.096 1.133 19946
102 1 1 . 1 1 23 23 ILE CA C 23 59.374 59.374 60.416 -1.042 19946
103 1 1 . 1 1 23 23 ILE CB C 23 37.327 37.327 36.607 0.720 19946
104 1 1 . 1 1 23 23 ILE H H 23 7.836 7.836 7.885 -0.049 19946
105 1 1 . 1 1 24 24 ARG N N 24 125.001 125.001 120.398 4.603 19946
106 1 1 . 1 1 24 24 ARG HA H 24 4.116 4.116 4.526 -0.410 19946
107 1 1 . 1 1 24 24 ARG CA C 24 55.943 55.943 54.485 1.458 19946
108 1 1 . 1 1 24 24 ARG CB C 24 30.135 30.135 31.948 -1.813 19946
109 1 1 . 1 1 24 24 ARG H H 24 8.195 8.195 7.119 1.076 19946
110 1 1 . 1 1 25 25 ASP N N 25 112.839 112.839 120.060 -7.221 19946
111 1 1 . 1 1 25 25 ASP HA H 25 4.545 4.545 4.651 -0.105 19946
112 1 1 . 1 1 25 25 ASP CA C 25 53.870 53.870 54.679 -0.809 19946
113 1 1 . 1 1 25 25 ASP CB C 25 41.327 41.327 41.368 -0.041 19946
114 1 1 . 1 1 25 25 ASP H H 25 7.660 7.660 8.569 -0.909 19946
115 1 1 . 1 1 26 26 ALA N N 26 122.145 122.145 121.450 0.695 19946
116 1 1 . 1 1 26 26 ALA HA H 26 3.897 3.897 4.372 -0.475 19946
117 1 1 . 1 1 26 26 ALA CA C 26 54.958 54.958 52.967 1.991 19946
118 1 1 . 1 1 26 26 ALA CB C 26 17.520 17.520 20.363 -2.843 19946
119 1 1 . 1 1 26 26 ALA H H 26 8.766 8.766 8.277 0.489 19946
120 1 1 . 1 1 27 27 ASP N N 27 115.380 115.380 118.322 -2.942 19946
121 1 1 . 1 1 27 27 ASP HA H 27 4.299 4.299 4.520 -0.221 19946
122 1 1 . 1 1 27 27 ASP CA C 27 56.451 56.451 56.960 -0.509 19946
123 1 1 . 1 1 27 27 ASP CB C 27 39.156 39.156 40.645 -1.489 19946
124 1 1 . 1 1 27 27 ASP H H 27 8.686 8.686 8.382 0.304 19946
125 1 1 . 1 1 28 28 GLU N N 28 120.081 120.081 117.995 2.086 19946
126 1 1 . 1 1 28 28 GLU HA H 28 4.086 4.086 4.135 -0.049 19946
127 1 1 . 1 1 28 28 GLU CA C 28 58.389 58.389 58.399 -0.010 19946
128 1 1 . 1 1 28 28 GLU CB C 28 28.728 28.728 29.558 -0.830 19946
129 1 1 . 1 1 28 28 GLU H H 28 7.397 7.397 8.772 -1.375 19946
130 1 1 . 1 1 29 29 TYR N N 29 121.205 121.205 116.495 4.710 19946
131 1 1 . 1 1 29 29 TYR HA H 29 4.083 4.083 4.716 -0.633 19946
132 1 1 . 1 1 29 29 TYR CA C 29 60.378 60.378 57.929 2.449 19946
133 1 1 . 1 1 29 29 TYR CB C 29 38.699 38.699 39.327 -0.628 19946
134 1 1 . 1 1 29 29 TYR H H 29 7.506 7.506 7.440 0.066 19946
135 1 1 . 1 1 30 30 LEU N N 30 118.828 118.828 122.348 -3.520 19946
136 1 1 . 1 1 30 30 LEU HA H 30 3.850 3.850 4.011 -0.161 19946
137 1 1 . 1 1 30 30 LEU CA C 30 56.348 56.348 57.530 -1.182 19946
138 1 1 . 1 1 30 30 LEU CB C 30 41.220 41.220 41.950 -0.730 19946
139 1 1 . 1 1 30 30 LEU H H 30 8.211 8.211 7.453 0.758 19946
140 1 1 . 1 1 31 31 ARG N N 31 118.220 118.220 116.378 1.842 19946
141 1 1 . 1 1 31 31 ARG HA H 31 4.101 4.101 4.054 0.047 19946
142 1 1 . 1 1 31 31 ARG CA C 31 58.365 58.365 58.560 -0.195 19946
143 1 1 . 1 1 31 31 ARG CB C 31 30.074 30.074 30.328 -0.254 19946
144 1 1 . 1 1 31 31 ARG H H 31 7.120 7.120 8.424 -1.304 19946
145 1 1 . 1 1 32 32 GLU N N 32 117.980 117.980 116.626 1.354 19946
146 1 1 . 1 1 32 32 GLU HA H 32 4.884 4.884 4.849 0.035 19946
147 1 1 . 1 1 32 32 GLU CA C 32 55.339 55.339 54.931 0.408 19946
148 1 1 . 1 1 32 32 GLU CB C 32 31.698 31.698 33.207 -1.509 19946
149 1 1 . 1 1 32 32 GLU H H 32 7.506 7.506 8.126 -0.620 19946
150 1 1 . 1 1 33 33 HIS N N 33 118.257 118.257 115.227 3.030 19946
151 1 1 . 1 1 33 33 HIS HA H 33 4.643 4.643 4.928 -0.285 19946
152 1 1 . 1 1 33 33 HIS CA C 33 53.766 53.766 54.210 -0.444 19946
153 1 1 . 1 1 33 33 HIS CB C 33 29.940 29.940 31.287 -1.347 19946
154 1 1 . 1 1 33 33 HIS H H 33 8.269 8.269 8.227 0.042 19946
155 1 1 . 1 1 34 34 ILE N N 34 127.809 127.809 123.797 4.012 19946
156 1 1 . 1 1 34 34 ILE HA H 34 3.920 3.920 3.946 -0.026 19946
157 1 1 . 1 1 34 34 ILE CA C 34 59.648 59.648 61.719 -2.071 19946
158 1 1 . 1 1 34 34 ILE CB C 34 37.959 37.959 38.649 -0.690 19946
159 1 1 . 1 1 34 34 ILE H H 34 9.989 9.989 8.807 1.182 19946
160 1 1 . 1 1 35 35 PRO HA H 35 4.198 4.198 4.319 -0.121 19946
161 1 1 . 1 1 36 36 GLU N N 36 114.414 114.414 117.687 -3.273 19946
162 1 1 . 1 1 36 36 GLU HA H 36 4.082 4.082 4.098 -0.016 19946
163 1 1 . 1 1 36 36 GLU CA C 36 57.861 57.861 56.804 1.057 19946
164 1 1 . 1 1 36 36 GLU CB C 36 28.109 28.109 29.877 -1.768 19946
165 1 1 . 1 1 36 36 GLU H H 36 8.557 8.557 8.209 0.348 19946
166 1 1 . 1 1 37 37 ALA N N 37 122.882 122.882 121.489 1.393 19946
167 1 1 . 1 1 37 37 ALA HA H 37 4.439 4.439 4.111 0.328 19946
168 1 1 . 1 1 37 37 ALA CA C 37 52.005 52.005 53.202 -1.197 19946
169 1 1 . 1 1 37 37 ALA CB C 37 20.438 20.438 18.970 1.468 19946
170 1 1 . 1 1 37 37 ALA H H 37 8.096 8.096 8.166 -0.070 19946
171 1 1 . 1 1 38 38 ASP N N 38 124.471 124.471 118.661 5.810 19946
172 1 1 . 1 1 38 38 ASP HA H 38 4.844 4.844 4.714 0.130 19946
173 1 1 . 1 1 38 38 ASP CA C 38 52.614 52.614 53.974 -1.360 19946
174 1 1 . 1 1 38 38 ASP CB C 38 44.407 44.407 42.200 2.207 19946
175 1 1 . 1 1 38 38 ASP H H 38 9.004 9.004 9.342 -0.338 19946
176 1 1 . 1 1 39 39 LEU N N 39 123.936 123.936 123.362 0.574 19946
177 1 1 . 1 1 39 39 LEU HA H 39 4.328 4.328 3.966 0.362 19946
178 1 1 . 1 1 39 39 LEU CA C 39 54.037 54.037 57.081 -3.045 19946
179 1 1 . 1 1 39 39 LEU CB C 39 41.220 41.220 41.841 -0.621 19946
180 1 1 . 1 1 39 39 LEU H H 39 8.125 8.125 8.704 -0.579 19946
181 1 1 . 1 1 40 40 ALA N N 40 131.297 131.297 127.142 4.155 19946
182 1 1 . 1 1 40 40 ALA HA H 40 4.408 4.408 4.489 -0.081 19946
183 1 1 . 1 1 40 40 ALA CA C 40 48.784 48.784 50.411 -1.627 19946
184 1 1 . 1 1 40 40 ALA CB C 40 17.979 17.979 19.361 -1.382 19946
185 1 1 . 1 1 40 40 ALA H H 40 8.654 8.654 8.008 0.646 19946
186 1 1 . 1 1 41 41 PRO HA H 41 4.101 4.101 4.591 -0.490 19946
187 1 1 . 1 1 41 41 PRO CA C 41 61.391 61.391 62.112 -0.721 19946
188 1 1 . 1 1 41 41 PRO CB C 41 32.097 32.097 32.559 -0.461 19946
189 1 1 . 1 1 42 42 LEU N N 42 125.312 125.312 119.222 6.090 19946
190 1 1 . 1 1 42 42 LEU HA H 42 3.871 3.871 3.926 -0.055 19946
191 1 1 . 1 1 42 42 LEU CA C 42 57.861 57.861 58.850 -0.989 19946
192 1 1 . 1 1 42 42 LEU CB C 42 40.941 40.941 41.115 -0.174 19946
193 1 1 . 1 1 42 42 LEU H H 42 8.285 8.285 8.606 -0.321 19946
194 1 1 . 1 1 43 43 SER N N 43 110.669 110.669 113.928 -3.259 19946
195 1 1 . 1 1 43 43 SER HA H 43 4.106 4.106 4.186 -0.080 19946
196 1 1 . 1 1 43 43 SER CA C 43 60.497 60.497 61.787 -1.290 19946
197 1 1 . 1 1 43 43 SER CB C 43 61.391 61.391 62.271 -0.880 19946
198 1 1 . 1 1 43 43 SER H H 43 8.453 8.453 8.297 0.156 19946
199 1 1 . 1 1 44 44 VAL N N 44 123.933 123.933 121.643 2.290 19946
200 1 1 . 1 1 44 44 VAL HA H 44 3.821 3.821 3.789 0.032 19946
201 1 1 . 1 1 44 44 VAL CA C 44 64.752 64.752 66.536 -1.784 19946
202 1 1 . 1 1 44 44 VAL CB C 44 31.135 31.135 31.704 -0.569 19946
203 1 1 . 1 1 44 44 VAL H H 44 7.156 7.156 8.305 -1.149 19946
204 1 1 . 1 1 45 45 LEU N N 45 121.150 121.150 119.027 2.123 19946
205 1 1 . 1 1 45 45 LEU HA H 45 3.767 3.767 4.417 -0.650 19946
206 1 1 . 1 1 45 45 LEU CA C 45 56.599 56.599 57.706 -1.107 19946
207 1 1 . 1 1 45 45 LEU CB C 45 40.890 40.890 41.203 -0.312 19946
208 1 1 . 1 1 45 45 LEU H H 45 7.997 7.997 8.853 -0.856 19946
209 1 1 . 1 1 46 46 GLU N N 46 116.256 116.256 118.752 -2.496 19946
210 1 1 . 1 1 46 46 GLU HA H 46 3.678 3.678 4.278 -0.600 19946
211 1 1 . 1 1 46 46 GLU CA C 46 58.365 58.365 58.081 0.284 19946
212 1 1 . 1 1 46 46 GLU CB C 46 29.622 29.622 29.968 -0.346 19946
213 1 1 . 1 1 46 46 GLU H H 46 8.501 8.501 8.215 0.286 19946
214 1 1 . 1 1 47 47 GLN N N 47 117.261 117.261 117.511 -0.250 19946
215 1 1 . 1 1 47 47 GLN HA H 47 4.216 4.216 4.162 0.054 19946
216 1 1 . 1 1 47 47 GLN CA C 47 56.852 56.852 58.131 -1.279 19946
217 1 1 . 1 1 47 47 GLN CB C 47 29.119 29.119 29.303 -0.184 19946
218 1 1 . 1 1 47 47 GLN H H 47 7.407 7.407 8.284 -0.877 19946
219 1 1 . 1 1 48 48 SER N N 48 111.890 111.890 111.935 -0.045 19946
220 1 1 . 1 1 48 48 SER HA H 48 4.641 4.641 4.444 0.197 19946
221 1 1 . 1 1 48 48 SER CA C 48 57.956 57.956 59.109 -1.153 19946
222 1 1 . 1 1 48 48 SER CB C 48 63.912 63.912 65.402 -1.490 19946
223 1 1 . 1 1 48 48 SER H H 48 8.566 8.566 8.123 0.443 19946
224 1 1 . 1 1 49 49 GLY N N 49 111.545 111.545 109.554 1.991 19946
225 1 1 . 1 1 49 49 GLY CA C 49 43.894 43.894 44.472 -0.578 19946
226 1 1 . 1 1 49 49 GLY H H 49 7.836 7.836 7.952 -0.116 19946
227 1 1 . 1 1 50 50 LEU N N 50 121.541 121.541 122.283 -0.742 19946
228 1 1 . 1 1 50 50 LEU HA H 50 4.239 4.239 4.534 -0.295 19946
229 1 1 . 1 1 50 50 LEU CA C 50 51.985 51.985 54.125 -2.140 19946
230 1 1 . 1 1 50 50 LEU CB C 50 42.648 42.648 42.299 0.349 19946
231 1 1 . 1 1 50 50 LEU H H 50 8.564 8.564 8.284 0.280 19946
232 1 1 . 1 1 51 51 PRO HA H 51 4.243 4.243 4.597 -0.354 19946
233 1 1 . 1 1 51 51 PRO CB C 51 31.639 31.639 29.668 1.971 19946
234 1 1 . 1 1 52 52 ALA N N 52 127.008 127.008 128.448 -1.440 19946
235 1 1 . 1 1 52 52 ALA HA H 52 3.790 3.790 3.973 -0.183 19946
236 1 1 . 1 1 52 52 ALA CA C 52 54.835 54.835 55.715 -0.880 19946
237 1 1 . 1 1 52 52 ALA CB C 52 17.715 17.715 18.512 -0.797 19946
238 1 1 . 1 1 52 52 ALA H H 52 8.564 8.564 8.489 0.075 19946
239 1 1 . 1 1 53 53 LYS N N 53 114.535 114.535 115.271 -0.736 19946
240 1 1 . 1 1 53 53 LYS HA H 53 4.106 4.106 4.123 -0.017 19946
241 1 1 . 1 1 53 53 LYS CA C 53 56.852 56.852 57.810 -0.958 19946
242 1 1 . 1 1 53 53 LYS CB C 53 31.386 31.386 31.705 -0.319 19946
243 1 1 . 1 1 53 53 LYS H H 53 8.364 8.364 8.696 -0.332 19946
244 1 1 . 1 1 54 54 LEU N N 54 118.515 118.515 117.620 0.895 19946
245 1 1 . 1 1 54 54 LEU HA H 54 4.247 4.247 4.562 -0.315 19946
246 1 1 . 1 1 54 54 LEU CA C 54 53.338 53.338 53.627 -0.289 19946
247 1 1 . 1 1 54 54 LEU CB C 54 40.890 40.890 41.998 -1.107 19946
248 1 1 . 1 1 54 54 LEU H H 54 7.745 7.745 7.633 0.112 19946
249 1 1 . 1 1 55 55 ARG N N 55 117.612 117.612 121.159 -3.547 19946
250 1 1 . 1 1 55 55 ARG HA H 55 3.927 3.927 4.648 -0.721 19946
251 1 1 . 1 1 55 55 ARG CA C 55 56.832 56.832 55.604 1.228 19946
252 1 1 . 1 1 55 55 ARG CB C 55 28.610 28.610 32.271 -3.661 19946
253 1 1 . 1 1 55 55 ARG H H 55 6.938 6.938 8.108 -1.170 19946
254 1 1 . 1 1 56 56 HIS N N 56 123.269 123.269 124.474 -1.205 19946
255 1 1 . 1 1 56 56 HIS HA H 56 4.614 4.614 4.755 -0.141 19946
256 1 1 . 1 1 56 56 HIS CA C 56 54.835 54.835 56.046 -1.211 19946
257 1 1 . 1 1 56 56 HIS CB C 56 32.648 32.648 31.314 1.334 19946
258 1 1 . 1 1 56 56 HIS H H 56 7.237 7.237 8.642 -1.405 19946
259 1 1 . 1 1 57 57 GLU N N 57 120.895 120.895 118.156 2.739 19946
260 1 1 . 1 1 57 57 GLU HA H 57 3.976 3.976 4.429 -0.453 19946
261 1 1 . 1 1 57 57 GLU CA C 57 58.871 58.871 56.749 2.122 19946
262 1 1 . 1 1 57 57 GLU CB C 57 29.158 29.158 31.759 -2.601 19946
263 1 1 . 1 1 57 57 GLU H H 57 7.625 7.625 8.565 -0.940 19946
264 1 1 . 1 1 58 58 GLN N N 58 118.485 118.485 119.051 -0.566 19946
265 1 1 . 1 1 58 58 GLN HA H 58 5.425 5.425 4.970 0.455 19946
266 1 1 . 1 1 58 58 GLN CA C 58 54.910 54.910 54.846 0.064 19946
267 1 1 . 1 1 58 58 GLN CB C 58 32.285 32.285 31.166 1.119 19946
268 1 1 . 1 1 58 58 GLN H H 58 8.335 8.335 8.222 0.113 19946
269 1 1 . 1 1 59 59 ILE N N 59 123.505 123.505 121.367 2.138 19946
270 1 1 . 1 1 59 59 ILE HA H 59 4.492 4.492 4.835 -0.343 19946
271 1 1 . 1 1 59 59 ILE CA C 59 58.869 58.869 59.764 -0.895 19946
272 1 1 . 1 1 59 59 ILE CB C 59 42.332 42.332 40.967 1.365 19946
273 1 1 . 1 1 59 59 ILE H H 59 8.704 8.704 8.839 -0.135 19946
274 1 1 . 1 1 60 60 ILE N N 60 126.464 126.464 122.239 4.225 19946
275 1 1 . 1 1 60 60 ILE HA H 60 4.954 4.954 4.729 0.225 19946
276 1 1 . 1 1 60 60 ILE CA C 60 57.357 57.357 59.811 -2.454 19946
277 1 1 . 1 1 60 60 ILE CB C 60 39.131 39.131 41.974 -2.843 19946
278 1 1 . 1 1 60 60 ILE H H 60 9.006 9.006 8.165 0.841 19946
279 1 1 . 1 1 61 61 PHE N N 61 124.441 124.441 123.507 0.934 19946
280 1 1 . 1 1 61 61 PHE HA H 61 5.795 5.795 5.072 0.723 19946
281 1 1 . 1 1 61 61 PHE CA C 61 56.131 56.131 57.243 -1.112 19946
282 1 1 . 1 1 61 61 PHE CB C 61 42.879 42.879 41.268 1.611 19946
283 1 1 . 1 1 61 61 PHE H H 61 8.938 8.938 8.861 0.077 19946
284 1 1 . 1 1 62 62 HIS N N 62 117.494 117.494 123.976 -6.482 19946
285 1 1 . 1 1 62 62 HIS HA H 62 5.928 5.928 4.835 1.093 19946
286 1 1 . 1 1 62 62 HIS CA C 62 53.322 53.322 57.148 -3.826 19946
287 1 1 . 1 1 62 62 HIS CB C 62 35.673 35.673 34.205 1.468 19946
288 1 1 . 1 1 62 62 HIS H H 62 9.230 9.230 8.118 1.112 19946
289 1 1 . 1 1 63 63 CYS N N 63 120.220 120.220 120.499 -0.279 19946
290 1 1 . 1 1 63 63 CYS HA H 63 5.033 5.033 4.495 0.538 19946
291 1 1 . 1 1 63 63 CYS CA C 63 56.131 56.131 59.248 -3.117 19946
292 1 1 . 1 1 63 63 CYS CB C 63 28.109 28.109 26.856 1.253 19946
293 1 1 . 1 1 63 63 CYS H H 63 8.131 8.131 8.495 -0.364 19946
294 1 1 . 1 1 65 65 ALA N N 65 119.272 119.272 122.232 -2.960 19946
295 1 1 . 1 1 65 65 ALA HA H 65 5.063 5.063 4.670 0.393 19946
296 1 1 . 1 1 65 65 ALA CA C 65 49.793 49.793 51.526 -1.733 19946
297 1 1 . 1 1 65 65 ALA CB C 65 19.775 19.775 18.729 1.046 19946
298 1 1 . 1 1 65 65 ALA H H 65 8.967 8.967 8.408 0.559 19946
299 1 1 . 1 1 66 66 GLY N N 66 113.296 113.296 107.861 5.435 19946
300 1 1 . 1 1 66 66 GLY CA C 66 44.934 44.934 45.370 -0.437 19946
301 1 1 . 1 1 66 66 GLY H H 66 8.778 8.778 7.968 0.810 19946
302 1 1 . 1 1 67 67 LYS N N 67 121.300 121.300 122.934 -1.634 19946
303 1 1 . 1 1 67 67 LYS HA H 67 4.211 4.211 4.557 -0.346 19946
304 1 1 . 1 1 67 67 LYS H H 67 8.111 8.111 8.637 -0.526 19946
305 1 1 . 1 1 68 68 ARG N N 68 126.092 126.092 121.838 4.254 19946
306 1 1 . 1 1 68 68 ARG H H 68 9.067 9.067 8.079 0.988 19946
307 1 1 . 1 1 69 69 THR N N 69 117.153 117.153 117.563 -0.410 19946
308 1 1 . 1 1 69 69 THR HA H 69 3.576 3.576 4.347 -0.771 19946
309 1 1 . 1 1 69 69 THR CA C 69 65.397 65.397 63.925 1.472 19946
310 1 1 . 1 1 69 69 THR CB C 69 66.938 66.938 69.156 -2.218 19946
311 1 1 . 1 1 69 69 THR H H 69 10.233 10.233 8.495 1.738 19946
312 1 1 . 1 1 70 70 SER N N 70 113.686 113.686 117.061 -3.375 19946
313 1 1 . 1 1 70 70 SER HA H 70 4.091 4.091 4.197 -0.106 19946
314 1 1 . 1 1 70 70 SER CA C 70 61.391 61.391 60.870 0.520 19946
315 1 1 . 1 1 70 70 SER CB C 70 65.425 65.425 62.883 2.542 19946
316 1 1 . 1 1 70 70 SER H H 70 7.322 7.322 8.540 -1.218 19946
317 1 1 . 1 1 71 71 ASN N N 71 118.257 118.257 117.877 0.380 19946
318 1 1 . 1 1 71 71 ASN HA H 71 4.177 4.177 4.493 -0.316 19946
319 1 1 . 1 1 71 71 ASN CA C 71 54.736 54.736 55.873 -1.137 19946
320 1 1 . 1 1 71 71 ASN CB C 71 38.391 38.391 38.488 -0.097 19946
321 1 1 . 1 1 71 71 ASN H H 71 7.863 7.863 8.371 -0.508 19946
322 1 1 . 1 1 72 72 ASN N N 72 115.529 115.529 115.887 -0.358 19946
323 1 1 . 1 1 72 72 ASN HA H 72 5.127 5.127 5.130 -0.003 19946
324 1 1 . 1 1 72 72 ASN CA C 72 52.173 52.173 52.191 -0.017 19946
325 1 1 . 1 1 72 72 ASN CB C 72 39.165 39.165 38.380 0.785 19946
326 1 1 . 1 1 72 72 ASN H H 72 7.238 7.238 7.925 -0.687 19946
327 1 1 . 1 1 73 73 ALA N N 73 125.388 125.388 122.154 3.234 19946
328 1 1 . 1 1 73 73 ALA HA H 73 3.639 3.639 4.388 -0.749 19946
329 1 1 . 1 1 73 73 ALA CA C 73 56.133 56.133 53.450 2.683 19946
330 1 1 . 1 1 73 73 ALA CB C 73 18.528 18.528 19.635 -1.107 19946
331 1 1 . 1 1 73 73 ALA H H 73 7.081 7.081 7.335 -0.254 19946
332 1 1 . 1 1 74 74 ASP N N 74 115.501 115.501 119.804 -4.303 19946
333 1 1 . 1 1 74 74 ASP HA H 74 4.135 4.135 4.374 -0.239 19946
334 1 1 . 1 1 74 74 ASP CA C 74 55.891 55.891 56.367 -0.477 19946
335 1 1 . 1 1 74 74 ASP CB C 74 38.699 38.699 39.818 -1.119 19946
336 1 1 . 1 1 74 74 ASP H H 74 8.346 8.346 8.268 0.078 19946
337 1 1 . 1 1 75 75 LYS N N 75 122.469 122.469 120.784 1.685 19946
338 1 1 . 1 1 75 75 LYS HA H 75 4.024 4.024 3.996 0.028 19946
339 1 1 . 1 1 75 75 LYS CA C 75 57.861 57.861 58.687 -0.826 19946
340 1 1 . 1 1 75 75 LYS CB C 75 31.660 31.660 32.288 -0.628 19946
341 1 1 . 1 1 75 75 LYS H H 75 7.583 7.583 8.343 -0.760 19946
342 1 1 . 1 1 76 76 LEU N N 76 119.196 119.196 118.610 0.586 19946
343 1 1 . 1 1 76 76 LEU HA H 76 3.570 3.570 3.978 -0.408 19946
344 1 1 . 1 1 76 76 LEU CA C 76 56.852 56.852 57.295 -0.443 19946
345 1 1 . 1 1 76 76 LEU CB C 76 39.245 39.245 41.626 -2.381 19946
346 1 1 . 1 1 76 76 LEU H H 76 8.069 8.069 7.555 0.514 19946
347 1 1 . 1 1 77 77 ALA N N 77 120.302 120.302 120.614 -0.312 19946
348 1 1 . 1 1 77 77 ALA HA H 77 3.985 3.985 3.768 0.217 19946
349 1 1 . 1 1 77 77 ALA CA C 77 53.794 53.794 53.897 -0.103 19946
350 1 1 . 1 1 77 77 ALA CB C 77 17.353 17.353 18.304 -0.951 19946
351 1 1 . 1 1 77 77 ALA H H 77 8.063 8.063 8.007 0.056 19946
352 1 1 . 1 1 78 78 ALA N N 78 119.602 119.602 117.840 1.762 19946
353 1 1 . 1 1 78 78 ALA HA H 78 4.138 4.138 4.231 -0.093 19946
354 1 1 . 1 1 78 78 ALA CA C 78 54.049 54.049 52.938 1.111 19946
355 1 1 . 1 1 78 78 ALA CB C 78 17.520 17.520 19.312 -1.792 19946
356 1 1 . 1 1 78 78 ALA H H 78 7.274 7.274 7.330 -0.056 19946
357 1 1 . 1 1 79 79 ILE N N 79 118.809 118.809 119.384 -0.575 19946
358 1 1 . 1 1 79 79 ILE HA H 79 3.798 3.798 3.773 0.025 19946
359 1 1 . 1 1 79 79 ILE CA C 79 63.354 63.354 63.248 0.106 19946
360 1 1 . 1 1 79 79 ILE CB C 79 38.422 38.422 38.798 -0.376 19946
361 1 1 . 1 1 79 79 ILE H H 79 8.170 8.170 7.669 0.501 19946
362 1 1 . 1 1 80 80 ALA N N 80 118.736 118.736 118.975 -0.239 19946
363 1 1 . 1 1 80 80 ALA HA H 80 4.412 4.412 4.395 0.017 19946
364 1 1 . 1 1 80 80 ALA CA C 80 50.801 50.801 51.025 -0.224 19946
365 1 1 . 1 1 80 80 ALA CB C 80 19.537 19.537 18.226 1.311 19946
366 1 1 . 1 1 80 80 ALA H H 80 7.857 7.857 7.432 0.425 19946
367 1 1 . 1 1 81 81 ALA N N 81 124.485 124.485 122.517 1.968 19946
368 1 1 . 1 1 81 81 ALA HA H 81 4.353 4.353 4.958 -0.605 19946
369 1 1 . 1 1 81 81 ALA CA C 81 51.305 51.305 49.439 1.866 19946
370 1 1 . 1 1 81 81 ALA CB C 81 16.511 16.511 18.871 -2.360 19946
371 1 1 . 1 1 81 81 ALA H H 81 7.191 7.191 7.015 0.176 19946
372 1 1 . 1 1 82 82 PRO CA C 82 62.903 62.903 63.176 -0.273 19946
373 1 1 . 1 1 83 83 ALA N N 83 128.367 128.367 124.945 3.422 19946
374 1 1 . 1 1 83 83 ALA HA H 83 4.058 4.058 4.477 -0.419 19946
375 1 1 . 1 1 83 83 ALA CA C 83 52.314 52.314 51.930 0.384 19946
376 1 1 . 1 1 83 83 ALA CB C 83 19.001 19.001 21.889 -2.888 19946
377 1 1 . 1 1 83 83 ALA H H 83 8.472 8.472 8.191 0.281 19946
378 1 1 . 1 1 84 84 GLU N N 84 122.108 122.108 120.902 1.206 19946
379 1 1 . 1 1 84 84 GLU HA H 84 4.164 4.164 4.551 -0.388 19946
380 1 1 . 1 1 84 84 GLU CA C 84 55.937 55.937 55.765 0.172 19946
381 1 1 . 1 1 84 84 GLU CB C 84 30.213 30.213 30.115 0.098 19946
382 1 1 . 1 1 84 84 GLU H H 84 8.106 8.106 8.356 -0.250 19946
383 1 1 . 1 1 85 85 ILE N N 85 122.808 122.808 123.337 -0.529 19946
384 1 1 . 1 1 85 85 ILE HA H 85 5.211 5.211 5.318 -0.107 19946
385 1 1 . 1 1 85 85 ILE CA C 85 58.365 58.365 58.384 -0.019 19946
386 1 1 . 1 1 85 85 ILE CB C 85 39.707 39.707 38.605 1.102 19946
387 1 1 . 1 1 85 85 ILE H H 85 7.850 7.850 7.864 -0.014 19946
388 1 1 . 1 1 86 86 PHE N N 86 122.937 122.937 121.499 1.438 19946
389 1 1 . 1 1 86 86 PHE HA H 86 5.388 5.388 5.035 0.353 19946
390 1 1 . 1 1 86 86 PHE CA C 86 54.509 54.509 57.043 -2.534 19946
391 1 1 . 1 1 86 86 PHE CB C 86 42.878 42.878 43.986 -1.108 19946
392 1 1 . 1 1 86 86 PHE H H 86 9.004 9.004 8.091 0.913 19946
393 1 1 . 1 1 87 87 LEU N N 87 120.712 120.712 118.675 2.037 19946
394 1 1 . 1 1 87 87 LEU HA H 87 5.295 5.295 5.312 -0.017 19946
395 1 1 . 1 1 87 87 LEU CA C 87 51.810 51.810 53.171 -1.361 19946
396 1 1 . 1 1 87 87 LEU CB C 87 42.059 42.059 45.101 -3.042 19946
397 1 1 . 1 1 87 87 LEU H H 87 8.785 8.785 9.111 -0.326 19946
398 1 1 . 1 1 88 88 LEU N N 88 124.779 124.779 121.441 3.338 19946
399 1 1 . 1 1 88 88 LEU HA H 88 4.434 4.434 4.486 -0.052 19946
400 1 1 . 1 1 88 88 LEU CA C 88 54.331 54.331 53.411 0.920 19946
401 1 1 . 1 1 88 88 LEU CB C 88 42.648 42.648 44.037 -1.389 19946
402 1 1 . 1 1 88 88 LEU H H 88 8.243 8.243 7.797 0.446 19946
403 1 1 . 1 1 89 89 GLU N N 89 112.478 112.478 126.853 -14.375 19946
404 1 1 . 1 1 89 89 GLU HA H 89 3.881 3.881 3.953 -0.072 19946
405 1 1 . 1 1 89 89 GLU H H 89 9.343 9.343 8.154 1.189 19946
406 1 1 . 1 1 90 90 ASP N N 90 120.709 120.709 124.403 -3.694 19946
407 1 1 . 1 1 90 90 ASP HA H 90 4.168 4.168 4.377 -0.209 19946
408 1 1 . 1 1 90 90 ASP H H 90 9.062 9.062 8.571 0.491 19946
409 1 1 . 1 1 91 91 GLY N N 91 105.049 105.049 111.251 -6.202 19946
410 1 1 . 1 1 91 91 GLY CA C 91 46.263 46.263 44.895 1.368 19946
411 1 1 . 1 1 91 91 GLY H H 91 7.848 7.848 8.165 -0.317 19946
412 1 1 . 1 1 92 92 ILE N N 92 122.127 122.127 122.669 -0.542 19946
413 1 1 . 1 1 92 92 ILE HA H 92 3.811 3.811 4.022 -0.211 19946
414 1 1 . 1 1 92 92 ILE CA C 92 62.656 62.656 63.193 -0.537 19946
415 1 1 . 1 1 92 92 ILE CB C 92 37.243 37.243 38.073 -0.830 19946
416 1 1 . 1 1 92 92 ILE H H 92 8.077 8.077 8.486 -0.409 19946
417 1 1 . 1 1 93 93 ASP N N 93 127.038 127.038 119.268 7.770 19946
418 1 1 . 1 1 93 93 ASP HA H 93 4.452 4.452 4.346 0.106 19946
419 1 1 . 1 1 93 93 ASP CA C 93 57.357 57.357 57.652 -0.295 19946
420 1 1 . 1 1 93 93 ASP CB C 93 38.194 38.194 40.394 -2.200 19946
421 1 1 . 1 1 93 93 ASP H H 93 9.094 9.094 8.438 0.655 19946
422 1 1 . 1 1 94 94 GLY N N 94 111.411 111.411 109.671 1.740 19946
423 1 1 . 1 1 94 94 GLY CA C 94 44.750 44.750 46.678 -1.928 19946
424 1 1 . 1 1 94 94 GLY H H 94 8.047 8.047 8.498 -0.451 19946
425 1 1 . 1 1 95 95 TRP N N 95 127.574 127.574 125.790 1.784 19946
426 1 1 . 1 1 95 95 TRP HA H 95 3.738 3.738 4.349 -0.611 19946
427 1 1 . 1 1 95 95 TRP CA C 95 60.852 60.852 59.093 1.759 19946
428 1 1 . 1 1 95 95 TRP CB C 95 28.613 28.613 29.385 -0.772 19946
429 1 1 . 1 1 95 95 TRP H H 95 7.918 7.918 8.099 -0.181 19946
430 1 1 . 1 1 96 96 LYS N N 96 117.374 117.374 119.513 -2.139 19946
431 1 1 . 1 1 96 96 LYS HA H 96 4.079 4.079 4.052 0.027 19946
432 1 1 . 1 1 96 96 LYS CA C 96 59.091 59.091 56.990 2.101 19946
433 1 1 . 1 1 96 96 LYS H H 96 8.625 8.625 8.761 -0.136 19946
434 1 1 . 1 1 97 97 LYS N N 97 123.490 123.490 120.548 2.942 19946
435 1 1 . 1 1 97 97 LYS HA H 97 4.021 4.021 4.087 -0.066 19946
436 1 1 . 1 1 97 97 LYS CB C 97 31.542 31.542 32.337 -0.795 19946
437 1 1 . 1 1 97 97 LYS H H 97 8.233 8.233 7.899 0.334 19946
438 1 1 . 1 1 98 98 ALA N N 98 120.321 120.321 119.127 1.194 19946
439 1 1 . 1 1 98 98 ALA HA H 98 4.248 4.248 4.418 -0.170 19946
440 1 1 . 1 1 98 98 ALA CA C 98 51.305 51.305 50.856 0.449 19946
441 1 1 . 1 1 98 98 ALA CB C 98 17.744 17.744 19.090 -1.346 19946
442 1 1 . 1 1 98 98 ALA H H 98 7.480 7.480 7.146 0.334 19946
443 1 1 . 1 1 99 99 GLY N N 99 106.984 106.984 109.052 -2.068 19946
444 1 1 . 1 1 99 99 GLY CA C 99 44.246 44.246 46.026 -1.780 19946
445 1 1 . 1 1 99 99 GLY H H 99 7.867 7.867 8.054 -0.187 19946
446 1 1 . 1 1 100 100 LEU N N 100 122.993 122.993 120.891 2.102 19946
447 1 1 . 1 1 100 100 LEU HA H 100 4.277 4.277 4.394 -0.117 19946
448 1 1 . 1 1 100 100 LEU CA C 100 52.314 52.314 50.438 1.876 19946
449 1 1 . 1 1 100 100 LEU CB C 100 36.786 36.786 42.176 -5.390 19946
450 1 1 . 1 1 100 100 LEU H H 100 6.958 6.958 7.033 -0.075 19946
451 1 1 . 1 1 101 101 PRO HA H 101 4.492 4.492 4.575 -0.083 19946
452 1 1 . 1 1 101 101 PRO CB C 101 32.097 32.097 32.096 0.001 19946
453 1 1 . 1 1 102 102 VAL N N 102 111.514 111.514 115.213 -3.699 19946
454 1 1 . 1 1 102 102 VAL HA H 102 4.367 4.367 4.519 -0.152 19946
455 1 1 . 1 1 102 102 VAL CA C 102 58.869 58.869 59.788 -0.919 19946
456 1 1 . 1 1 102 102 VAL CB C 102 35.351 35.351 32.454 2.897 19946
457 1 1 . 1 1 102 102 VAL H H 102 7.988 7.988 7.927 0.061 19946
458 1 1 . 1 1 103 103 ALA N N 103 126.676 126.676 122.624 4.052 19946
459 1 1 . 1 1 103 103 ALA HA H 103 4.524 4.524 4.252 0.272 19946
460 1 1 . 1 1 103 103 ALA CA C 103 49.793 49.793 51.321 -1.528 19946
461 1 1 . 1 1 103 103 ALA CB C 103 18.600 18.600 18.675 -0.075 19946
462 1 1 . 1 1 103 103 ALA H H 103 8.919 8.919 8.385 0.534 19946
463 1 1 . 1 1 104 104 VAL N N 104 121.148 121.148 123.144 -1.996 19946
464 1 1 . 1 1 104 104 VAL HA H 104 4.475 4.475 4.591 -0.116 19946
465 1 1 . 1 1 104 104 VAL CA C 104 59.374 59.374 59.554 -0.180 19946
466 1 1 . 1 1 104 104 VAL CB C 104 33.884 33.884 33.668 0.216 19946
467 1 1 . 1 1 104 104 VAL H H 104 8.241 8.241 7.852 0.389 19946
468 1 1 . 1 1 105 105 ASN N N 105 123.816 123.816 118.444 5.372 19946
469 1 1 . 1 1 105 105 ASN HA H 105 4.674 4.674 4.520 0.154 19946
470 1 1 . 1 1 105 105 ASN CA C 105 53.200 53.200 55.252 -2.053 19946
471 1 1 . 1 1 105 105 ASN CB C 105 37.959 37.959 38.746 -0.787 19946
472 1 1 . 1 1 105 105 ASN H H 105 8.150 8.150 8.426 -0.276 19946
473 1 1 . 1 1 106 106 LYS N N 106 123.804 123.804 119.464 4.340 19946
474 1 1 . 1 1 106 106 LYS H H 106 8.340 8.340 7.885 0.455 19946
475 1 2 . 1 1 2 2 LEU N N 2 120.763 120.763 121.407 -0.644 19946
476 1 2 . 1 1 2 2 LEU HA H 2 4.384 4.384 4.186 0.198 19946
477 1 2 . 1 1 2 2 LEU CA C 2 53.827 53.827 55.841 -2.014 19946
478 1 2 . 1 1 2 2 LEU CB C 2 42.229 42.229 39.924 2.305 19946
479 1 2 . 1 1 2 2 LEU H H 2 7.888 7.888 8.610 -0.722 19946
480 1 2 . 1 1 3 3 THR N N 3 118.330 118.330 119.800 -1.470 19946
481 1 2 . 1 1 3 3 THR HA H 3 4.469 4.469 4.775 -0.306 19946
482 1 2 . 1 1 3 3 THR CA C 3 61.391 61.391 60.749 0.642 19946
483 1 2 . 1 1 3 3 THR CB C 3 69.496 69.496 71.092 -1.596 19946
484 1 2 . 1 1 3 3 THR H H 3 7.905 7.905 8.198 -0.293 19946
485 1 2 . 1 1 4 4 THR N N 4 122.024 122.024 116.249 5.775 19946
486 1 2 . 1 1 4 4 THR HA H 4 5.171 5.171 5.226 -0.055 19946
487 1 2 . 1 1 4 4 THR CA C 4 61.595 61.595 61.750 -0.155 19946
488 1 2 . 1 1 4 4 THR CB C 4 69.027 69.027 70.150 -1.123 19946
489 1 2 . 1 1 4 4 THR H H 4 8.504 8.504 8.362 0.142 19946
490 1 2 . 1 1 5 5 ILE N N 5 122.667 122.667 122.236 0.431 19946
491 1 2 . 1 1 5 5 ILE HA H 5 4.973 4.973 4.754 0.219 19946
492 1 2 . 1 1 5 5 ILE CA C 5 57.971 57.971 58.893 -0.922 19946
493 1 2 . 1 1 5 5 ILE CB C 5 41.458 41.458 41.978 -0.520 19946
494 1 2 . 1 1 5 5 ILE H H 5 8.903 8.903 8.340 0.563 19946
495 1 2 . 1 1 6 6 SER N N 6 123.156 123.156 114.887 8.269 19946
496 1 2 . 1 1 6 6 SER HA H 6 4.785 4.785 4.984 -0.199 19946
497 1 2 . 1 1 6 6 SER H H 6 9.138 9.138 8.342 0.796 19946
498 1 2 . 1 1 7 7 PRO HA H 7 4.004 4.004 4.669 -0.665 19946
499 1 2 . 1 1 7 7 PRO CA C 7 65.510 65.510 63.588 1.922 19946
500 1 2 . 1 1 7 7 PRO CB C 7 30.924 30.924 30.214 0.710 19946
501 1 2 . 1 1 8 8 HIS N N 8 114.319 114.319 118.195 -3.876 19946
502 1 2 . 1 1 8 8 HIS HA H 8 3.989 3.989 4.804 -0.815 19946
503 1 2 . 1 1 8 8 HIS CA C 8 60.050 60.050 57.754 2.296 19946
504 1 2 . 1 1 8 8 HIS CB C 8 28.613 28.613 32.082 -3.469 19946
505 1 2 . 1 1 8 8 HIS H H 8 8.127 8.127 8.561 -0.434 19946
506 1 2 . 1 1 9 9 ASP N N 9 121.300 121.300 119.342 1.958 19946
507 1 2 . 1 1 9 9 ASP HA H 9 4.301 4.301 4.731 -0.430 19946
508 1 2 . 1 1 9 9 ASP CA C 9 56.455 56.455 55.046 1.409 19946
509 1 2 . 1 1 9 9 ASP CB C 9 38.699 38.699 42.597 -3.898 19946
510 1 2 . 1 1 9 9 ASP H H 9 7.639 7.639 8.104 -0.465 19946
511 1 2 . 1 1 10 10 ALA N N 10 123.991 123.991 122.974 1.017 19946
512 1 2 . 1 1 10 10 ALA HA H 10 3.719 3.719 4.194 -0.475 19946
513 1 2 . 1 1 10 10 ALA CA C 10 54.331 54.331 54.937 -0.606 19946
514 1 2 . 1 1 10 10 ALA CB C 10 17.549 17.549 18.675 -1.126 19946
515 1 2 . 1 1 10 10 ALA H H 10 8.820 8.820 7.485 1.335 19946
516 1 2 . 1 1 11 11 GLN N N 11 118.128 118.128 116.303 1.825 19946
517 1 2 . 1 1 11 11 GLN HA H 11 3.933 3.933 4.160 -0.227 19946
518 1 2 . 1 1 11 11 GLN CA C 11 59.389 59.389 58.028 1.361 19946
519 1 2 . 1 1 11 11 GLN CB C 11 27.948 27.948 28.181 -0.233 19946
520 1 2 . 1 1 11 11 GLN H H 11 8.353 8.353 8.845 -0.492 19946
521 1 2 . 1 1 12 12 GLU N N 12 119.307 119.307 120.817 -1.510 19946
522 1 2 . 1 1 12 12 GLU HA H 12 4.023 4.023 4.235 -0.212 19946
523 1 2 . 1 1 12 12 GLU CA C 12 58.476 58.476 58.739 -0.263 19946
524 1 2 . 1 1 12 12 GLU CB C 12 28.532 28.532 29.997 -1.464 19946
525 1 2 . 1 1 12 12 GLU H H 12 7.197 7.197 7.685 -0.488 19946
526 1 2 . 1 1 13 13 LEU N N 13 120.635 120.635 118.714 1.921 19946
527 1 2 . 1 1 13 13 LEU HA H 13 3.821 3.821 4.118 -0.297 19946
528 1 2 . 1 1 13 13 LEU CA C 13 57.065 57.065 58.154 -1.089 19946
529 1 2 . 1 1 13 13 LEU CB C 13 40.890 40.890 41.508 -0.618 19946
530 1 2 . 1 1 13 13 LEU H H 13 7.554 7.554 7.468 0.086 19946
531 1 2 . 1 1 14 14 ILE N N 14 123.021 123.021 119.645 3.376 19946
532 1 2 . 1 1 14 14 ILE HA H 14 3.827 3.827 3.931 -0.104 19946
533 1 2 . 1 1 14 14 ILE CA C 14 64.053 64.053 65.128 -1.075 19946
534 1 2 . 1 1 14 14 ILE CB C 14 38.115 38.115 37.853 0.262 19946
535 1 2 . 1 1 14 14 ILE H H 14 8.710 8.710 8.147 0.563 19946
536 1 2 . 1 1 15 15 ALA N N 15 124.504 124.504 120.451 4.053 19946
537 1 2 . 1 1 15 15 ALA HA H 15 4.115 4.115 4.164 -0.049 19946
538 1 2 . 1 1 15 15 ALA CA C 15 54.257 54.257 54.065 0.192 19946
539 1 2 . 1 1 15 15 ALA CB C 15 17.040 17.040 18.374 -1.334 19946
540 1 2 . 1 1 15 15 ALA H H 15 7.758 7.758 7.863 -0.105 19946
541 1 2 . 1 1 16 16 ARG N N 16 115.990 115.990 116.518 -0.528 19946
542 1 2 . 1 1 16 16 ARG HA H 16 4.348 4.348 4.347 0.001 19946
543 1 2 . 1 1 16 16 ARG CA C 16 55.416 55.416 56.939 -1.523 19946
544 1 2 . 1 1 16 16 ARG CB C 16 29.762 29.762 30.964 -1.202 19946
545 1 2 . 1 1 16 16 ARG H H 16 7.252 7.252 7.655 -0.403 19946
546 1 2 . 1 1 17 17 GLY N N 17 107.981 107.981 105.319 2.662 19946
547 1 2 . 1 1 17 17 GLY CA C 17 44.854 44.854 44.996 -0.142 19946
548 1 2 . 1 1 17 17 GLY H H 17 7.748 7.748 7.521 0.227 19946
549 1 2 . 1 1 18 18 ALA N N 18 123.914 123.914 126.330 -2.416 19946
550 1 2 . 1 1 18 18 ALA HA H 18 4.221 4.221 4.240 -0.019 19946
551 1 2 . 1 1 18 18 ALA CA C 18 52.270 52.270 53.021 -0.751 19946
552 1 2 . 1 1 18 18 ALA CB C 18 18.638 18.638 19.240 -0.602 19946
553 1 2 . 1 1 18 18 ALA H H 18 7.940 7.940 7.817 0.123 19946
554 1 2 . 1 1 19 19 LYS N N 19 119.436 119.436 123.602 -4.166 19946
555 1 2 . 1 1 19 19 LYS HA H 19 4.301 4.301 4.136 0.165 19946
556 1 2 . 1 1 19 19 LYS CA C 19 53.105 53.105 56.019 -2.914 19946
557 1 2 . 1 1 19 19 LYS CB C 19 32.856 32.856 34.246 -1.390 19946
558 1 2 . 1 1 19 19 LYS H H 19 7.565 7.565 8.407 -0.842 19946
559 1 2 . 1 1 20 20 LEU N N 20 127.401 127.401 122.291 5.110 19946
560 1 2 . 1 1 20 20 LEU HA H 20 5.042 5.042 4.389 0.653 19946
561 1 2 . 1 1 20 20 LEU CA C 20 52.314 52.314 54.107 -1.793 19946
562 1 2 . 1 1 20 20 LEU CB C 20 43.234 43.234 44.038 -0.803 19946
563 1 2 . 1 1 20 20 LEU H H 20 8.727 8.727 8.295 0.432 19946
564 1 2 . 1 1 21 21 ILE N N 21 128.186 128.186 124.995 3.191 19946
565 1 2 . 1 1 21 21 ILE HA H 21 4.547 4.547 4.576 -0.029 19946
566 1 2 . 1 1 21 21 ILE CA C 21 59.589 59.589 58.576 1.013 19946
567 1 2 . 1 1 21 21 ILE CB C 21 38.545 38.545 41.049 -2.504 19946
568 1 2 . 1 1 21 21 ILE H H 21 9.366 9.366 7.815 1.551 19946
569 1 2 . 1 1 22 22 ASP N N 22 129.968 129.968 123.086 6.882 19946
570 1 2 . 1 1 22 22 ASP HA H 22 3.803 3.803 5.021 -1.218 19946
571 1 2 . 1 1 22 22 ASP CA C 22 51.435 51.435 52.580 -1.145 19946
572 1 2 . 1 1 22 22 ASP CB C 22 42.062 42.062 44.885 -2.823 19946
573 1 2 . 1 1 22 22 ASP H H 22 8.583 8.583 7.843 0.740 19946
574 1 2 . 1 1 23 23 ILE N N 23 116.266 116.266 116.908 -0.642 19946
575 1 2 . 1 1 23 23 ILE HA H 23 5.229 5.229 4.369 0.860 19946
576 1 2 . 1 1 23 23 ILE CA C 23 59.374 59.374 60.770 -1.396 19946
577 1 2 . 1 1 23 23 ILE CB C 23 37.327 37.327 37.353 -0.026 19946
578 1 2 . 1 1 23 23 ILE H H 23 7.836 7.836 7.899 -0.063 19946
579 1 2 . 1 1 24 24 ARG N N 24 125.001 125.001 120.126 4.875 19946
580 1 2 . 1 1 24 24 ARG HA H 24 4.116 4.116 4.439 -0.323 19946
581 1 2 . 1 1 24 24 ARG CA C 24 55.943 55.943 55.010 0.933 19946
582 1 2 . 1 1 24 24 ARG CB C 24 30.135 30.135 31.786 -1.651 19946
583 1 2 . 1 1 24 24 ARG H H 24 8.195 8.195 7.478 0.717 19946
584 1 2 . 1 1 25 25 ASP N N 25 112.839 112.839 119.813 -6.974 19946
585 1 2 . 1 1 25 25 ASP HA H 25 4.545 4.545 4.745 -0.200 19946
586 1 2 . 1 1 25 25 ASP CA C 25 53.870 53.870 54.236 -0.366 19946
587 1 2 . 1 1 25 25 ASP CB C 25 41.327 41.327 42.465 -1.138 19946
588 1 2 . 1 1 25 25 ASP H H 25 7.660 7.660 8.341 -0.681 19946
589 1 2 . 1 1 26 26 ALA N N 26 122.145 122.145 121.950 0.195 19946
590 1 2 . 1 1 26 26 ALA HA H 26 3.897 3.897 4.311 -0.414 19946
591 1 2 . 1 1 26 26 ALA CA C 26 54.958 54.958 55.011 -0.053 19946
592 1 2 . 1 1 26 26 ALA CB C 26 17.520 17.520 19.556 -2.036 19946
593 1 2 . 1 1 26 26 ALA H H 26 8.766 8.766 8.435 0.331 19946
594 1 2 . 1 1 27 27 ASP N N 27 115.380 115.380 119.332 -3.952 19946
595 1 2 . 1 1 27 27 ASP HA H 27 4.299 4.299 4.279 0.020 19946
596 1 2 . 1 1 27 27 ASP CA C 27 56.451 56.451 56.876 -0.425 19946
597 1 2 . 1 1 27 27 ASP CB C 27 39.156 39.156 40.324 -1.168 19946
598 1 2 . 1 1 27 27 ASP H H 27 8.686 8.686 8.601 0.085 19946
599 1 2 . 1 1 28 28 GLU N N 28 120.081 120.081 116.524 3.557 19946
600 1 2 . 1 1 28 28 GLU HA H 28 4.086 4.086 4.081 0.005 19946
601 1 2 . 1 1 28 28 GLU CA C 28 58.389 58.389 58.266 0.123 19946
602 1 2 . 1 1 28 28 GLU CB C 28 28.728 28.728 28.697 0.031 19946
603 1 2 . 1 1 28 28 GLU H H 28 7.397 7.397 8.562 -1.165 19946
604 1 2 . 1 1 29 29 TYR N N 29 121.205 121.205 120.838 0.367 19946
605 1 2 . 1 1 29 29 TYR HA H 29 4.083 4.083 4.846 -0.763 19946
606 1 2 . 1 1 29 29 TYR CA C 29 60.378 60.378 57.256 3.122 19946
607 1 2 . 1 1 29 29 TYR CB C 29 38.699 38.699 38.576 0.123 19946
608 1 2 . 1 1 29 29 TYR H H 29 7.506 7.506 8.125 -0.619 19946
609 1 2 . 1 1 30 30 LEU N N 30 118.828 118.828 121.223 -2.395 19946
610 1 2 . 1 1 30 30 LEU HA H 30 3.850 3.850 3.849 0.001 19946
611 1 2 . 1 1 30 30 LEU CA C 30 56.348 56.348 56.857 -0.509 19946
612 1 2 . 1 1 30 30 LEU CB C 30 41.220 41.220 42.263 -1.043 19946
613 1 2 . 1 1 30 30 LEU H H 30 8.211 8.211 7.842 0.369 19946
614 1 2 . 1 1 31 31 ARG N N 31 118.220 118.220 118.282 -0.062 19946
615 1 2 . 1 1 31 31 ARG HA H 31 4.101 4.101 4.267 -0.166 19946
616 1 2 . 1 1 31 31 ARG CA C 31 58.365 58.365 56.444 1.921 19946
617 1 2 . 1 1 31 31 ARG CB C 31 30.074 30.074 31.767 -1.693 19946
618 1 2 . 1 1 31 31 ARG H H 31 7.120 7.120 7.722 -0.602 19946
619 1 2 . 1 1 32 32 GLU N N 32 117.980 117.980 117.708 0.272 19946
620 1 2 . 1 1 32 32 GLU HA H 32 4.884 4.884 4.325 0.559 19946
621 1 2 . 1 1 32 32 GLU CA C 32 55.339 55.339 56.136 -0.797 19946
622 1 2 . 1 1 32 32 GLU CB C 32 31.698 31.698 31.094 0.604 19946
623 1 2 . 1 1 32 32 GLU H H 32 7.506 7.506 8.155 -0.649 19946
624 1 2 . 1 1 33 33 HIS N N 33 118.257 118.257 118.532 -0.275 19946
625 1 2 . 1 1 33 33 HIS HA H 33 4.643 4.643 5.050 -0.407 19946
626 1 2 . 1 1 33 33 HIS CA C 33 53.766 53.766 54.816 -1.050 19946
627 1 2 . 1 1 33 33 HIS CB C 33 29.940 29.940 32.931 -2.991 19946
628 1 2 . 1 1 33 33 HIS H H 33 8.269 8.269 8.671 -0.402 19946
629 1 2 . 1 1 34 34 ILE N N 34 127.809 127.809 119.165 8.644 19946
630 1 2 . 1 1 34 34 ILE HA H 34 3.920 3.920 4.272 -0.352 19946
631 1 2 . 1 1 34 34 ILE CA C 34 59.648 59.648 57.875 1.773 19946
632 1 2 . 1 1 34 34 ILE CB C 34 37.959 37.959 41.825 -3.865 19946
633 1 2 . 1 1 34 34 ILE H H 34 9.989 9.989 7.771 2.218 19946
634 1 2 . 1 1 35 35 PRO HA H 35 4.198 4.198 4.266 -0.068 19946
635 1 2 . 1 1 36 36 GLU N N 36 114.414 114.414 121.258 -6.844 19946
636 1 2 . 1 1 36 36 GLU HA H 36 4.082 4.082 3.755 0.327 19946
637 1 2 . 1 1 36 36 GLU CA C 36 57.861 57.861 57.159 0.702 19946
638 1 2 . 1 1 36 36 GLU CB C 36 28.109 28.109 29.274 -1.165 19946
639 1 2 . 1 1 36 36 GLU H H 36 8.557 8.557 8.048 0.509 19946
640 1 2 . 1 1 37 37 ALA N N 37 122.882 122.882 126.396 -3.514 19946
641 1 2 . 1 1 37 37 ALA HA H 37 4.439 4.439 4.533 -0.094 19946
642 1 2 . 1 1 37 37 ALA CA C 37 52.005 52.005 51.348 0.657 19946
643 1 2 . 1 1 37 37 ALA CB C 37 20.438 20.438 21.413 -0.975 19946
644 1 2 . 1 1 37 37 ALA H H 37 8.096 8.096 8.039 0.057 19946
645 1 2 . 1 1 38 38 ASP N N 38 124.471 124.471 118.500 5.971 19946
646 1 2 . 1 1 38 38 ASP HA H 38 4.844 4.844 4.856 -0.012 19946
647 1 2 . 1 1 38 38 ASP CA C 38 52.614 52.614 53.827 -1.213 19946
648 1 2 . 1 1 38 38 ASP CB C 38 44.407 44.407 44.348 0.059 19946
649 1 2 . 1 1 38 38 ASP H H 38 9.004 9.004 8.140 0.864 19946
650 1 2 . 1 1 39 39 LEU N N 39 123.936 123.936 122.348 1.588 19946
651 1 2 . 1 1 39 39 LEU HA H 39 4.328 4.328 4.581 -0.253 19946
652 1 2 . 1 1 39 39 LEU CA C 39 54.037 54.037 55.600 -1.563 19946
653 1 2 . 1 1 39 39 LEU CB C 39 41.220 41.220 42.219 -0.999 19946
654 1 2 . 1 1 39 39 LEU H H 39 8.125 8.125 8.263 -0.138 19946
655 1 2 . 1 1 40 40 ALA N N 40 131.297 131.297 126.548 4.749 19946
656 1 2 . 1 1 40 40 ALA HA H 40 4.408 4.408 4.488 -0.080 19946
657 1 2 . 1 1 40 40 ALA CA C 40 48.784 48.784 50.893 -2.109 19946
658 1 2 . 1 1 40 40 ALA CB C 40 17.979 17.979 19.515 -1.536 19946
659 1 2 . 1 1 40 40 ALA H H 40 8.654 8.654 8.714 -0.060 19946
660 1 2 . 1 1 41 41 PRO HA H 41 4.101 4.101 4.615 -0.514 19946
661 1 2 . 1 1 41 41 PRO CA C 41 61.391 61.391 62.249 -0.858 19946
662 1 2 . 1 1 41 41 PRO CB C 41 32.097 32.097 33.017 -0.920 19946
663 1 2 . 1 1 42 42 LEU N N 42 125.312 125.312 120.387 4.925 19946
664 1 2 . 1 1 42 42 LEU HA H 42 3.871 3.871 3.882 -0.011 19946
665 1 2 . 1 1 42 42 LEU CA C 42 57.861 57.861 58.814 -0.953 19946
666 1 2 . 1 1 42 42 LEU CB C 42 40.941 40.941 41.133 -0.192 19946
667 1 2 . 1 1 42 42 LEU H H 42 8.285 8.285 8.611 -0.326 19946
668 1 2 . 1 1 43 43 SER N N 43 110.669 110.669 113.856 -3.187 19946
669 1 2 . 1 1 43 43 SER HA H 43 4.106 4.106 4.127 -0.021 19946
670 1 2 . 1 1 43 43 SER CA C 43 60.497 60.497 61.711 -1.214 19946
671 1 2 . 1 1 43 43 SER CB C 43 61.391 61.391 62.572 -1.181 19946
672 1 2 . 1 1 43 43 SER H H 43 8.453 8.453 8.310 0.143 19946
673 1 2 . 1 1 44 44 VAL N N 44 123.933 123.933 121.486 2.447 19946
674 1 2 . 1 1 44 44 VAL HA H 44 3.821 3.821 3.781 0.040 19946
675 1 2 . 1 1 44 44 VAL CA C 44 64.752 64.752 65.952 -1.200 19946
676 1 2 . 1 1 44 44 VAL CB C 44 31.135 31.135 31.436 -0.301 19946
677 1 2 . 1 1 44 44 VAL H H 44 7.156 7.156 7.811 -0.655 19946
678 1 2 . 1 1 45 45 LEU N N 45 121.150 121.150 119.783 1.367 19946
679 1 2 . 1 1 45 45 LEU HA H 45 3.767 3.767 3.975 -0.208 19946
680 1 2 . 1 1 45 45 LEU CA C 45 56.599 56.599 58.211 -1.612 19946
681 1 2 . 1 1 45 45 LEU CB C 45 40.890 40.890 41.355 -0.465 19946
682 1 2 . 1 1 45 45 LEU H H 45 7.997 7.997 9.010 -1.013 19946
683 1 2 . 1 1 46 46 GLU N N 46 116.256 116.256 118.582 -2.326 19946
684 1 2 . 1 1 46 46 GLU HA H 46 3.678 3.678 4.239 -0.561 19946
685 1 2 . 1 1 46 46 GLU CA C 46 58.365 58.365 58.507 -0.142 19946
686 1 2 . 1 1 46 46 GLU CB C 46 29.622 29.622 29.859 -0.237 19946
687 1 2 . 1 1 46 46 GLU H H 46 8.501 8.501 8.128 0.373 19946
688 1 2 . 1 1 47 47 GLN N N 47 117.261 117.261 117.779 -0.518 19946
689 1 2 . 1 1 47 47 GLN HA H 47 4.216 4.216 4.215 0.001 19946
690 1 2 . 1 1 47 47 GLN CA C 47 56.852 56.852 57.860 -1.008 19946
691 1 2 . 1 1 47 47 GLN CB C 47 29.119 29.119 29.419 -0.300 19946
692 1 2 . 1 1 47 47 GLN H H 47 7.407 7.407 8.177 -0.770 19946
693 1 2 . 1 1 48 48 SER N N 48 111.890 111.890 113.157 -1.267 19946
694 1 2 . 1 1 48 48 SER HA H 48 4.641 4.641 4.490 0.151 19946
695 1 2 . 1 1 48 48 SER CA C 48 57.956 57.956 58.532 -0.576 19946
696 1 2 . 1 1 48 48 SER CB C 48 63.912 63.912 64.745 -0.833 19946
697 1 2 . 1 1 48 48 SER H H 48 8.566 8.566 8.410 0.156 19946
698 1 2 . 1 1 49 49 GLY N N 49 111.545 111.545 109.173 2.372 19946
699 1 2 . 1 1 49 49 GLY CA C 49 43.894 43.894 44.472 -0.578 19946
700 1 2 . 1 1 49 49 GLY H H 49 7.836 7.836 7.400 0.436 19946
701 1 2 . 1 1 50 50 LEU N N 50 121.541 121.541 124.312 -2.771 19946
702 1 2 . 1 1 50 50 LEU HA H 50 4.239 4.239 4.338 -0.099 19946
703 1 2 . 1 1 50 50 LEU CA C 50 51.985 51.985 54.392 -2.408 19946
704 1 2 . 1 1 50 50 LEU CB C 50 42.648 42.648 41.101 1.547 19946
705 1 2 . 1 1 50 50 LEU H H 50 8.564 8.564 8.259 0.305 19946
706 1 2 . 1 1 51 51 PRO HA H 51 4.243 4.243 4.634 -0.391 19946
707 1 2 . 1 1 51 51 PRO CB C 51 31.639 31.639 32.603 -0.964 19946
708 1 2 . 1 1 52 52 ALA N N 52 127.008 127.008 126.086 0.922 19946
709 1 2 . 1 1 52 52 ALA HA H 52 3.790 3.790 4.129 -0.339 19946
710 1 2 . 1 1 52 52 ALA CA C 52 54.835 54.835 54.784 0.051 19946
711 1 2 . 1 1 52 52 ALA CB C 52 17.715 17.715 18.538 -0.824 19946
712 1 2 . 1 1 52 52 ALA H H 52 8.564 8.564 8.524 0.040 19946
713 1 2 . 1 1 53 53 LYS N N 53 114.535 114.535 116.824 -2.289 19946
714 1 2 . 1 1 53 53 LYS HA H 53 4.106 4.106 4.150 -0.044 19946
715 1 2 . 1 1 53 53 LYS CA C 53 56.852 56.852 58.266 -1.414 19946
716 1 2 . 1 1 53 53 LYS CB C 53 31.386 31.386 31.838 -0.452 19946
717 1 2 . 1 1 53 53 LYS H H 53 8.364 8.364 8.706 -0.342 19946
718 1 2 . 1 1 54 54 LEU N N 54 118.515 118.515 117.995 0.520 19946
719 1 2 . 1 1 54 54 LEU HA H 54 4.247 4.247 4.517 -0.270 19946
720 1 2 . 1 1 54 54 LEU CA C 54 53.338 53.338 53.593 -0.255 19946
721 1 2 . 1 1 54 54 LEU CB C 54 40.890 40.890 42.440 -1.550 19946
722 1 2 . 1 1 54 54 LEU H H 54 7.745 7.745 7.240 0.505 19946
723 1 2 . 1 1 55 55 ARG N N 55 117.612 117.612 121.319 -3.707 19946
724 1 2 . 1 1 55 55 ARG HA H 55 3.927 3.927 4.620 -0.693 19946
725 1 2 . 1 1 55 55 ARG CA C 55 56.832 56.832 55.566 1.266 19946
726 1 2 . 1 1 55 55 ARG CB C 55 28.610 28.610 32.171 -3.561 19946
727 1 2 . 1 1 55 55 ARG H H 55 6.938 6.938 8.037 -1.099 19946
728 1 2 . 1 1 56 56 HIS N N 56 123.269 123.269 123.074 0.195 19946
729 1 2 . 1 1 56 56 HIS HA H 56 4.614 4.614 4.759 -0.145 19946
730 1 2 . 1 1 56 56 HIS CA C 56 54.835 54.835 55.594 -0.759 19946
731 1 2 . 1 1 56 56 HIS CB C 56 32.648 32.648 32.205 0.443 19946
732 1 2 . 1 1 56 56 HIS H H 56 7.237 7.237 8.582 -1.345 19946
733 1 2 . 1 1 57 57 GLU N N 57 120.895 120.895 118.133 2.762 19946
734 1 2 . 1 1 57 57 GLU HA H 57 3.976 3.976 4.416 -0.440 19946
735 1 2 . 1 1 57 57 GLU CA C 57 58.871 58.871 57.694 1.177 19946
736 1 2 . 1 1 57 57 GLU CB C 57 29.158 29.158 30.776 -1.618 19946
737 1 2 . 1 1 57 57 GLU H H 57 7.625 7.625 8.749 -1.124 19946
738 1 2 . 1 1 58 58 GLN N N 58 118.485 118.485 115.369 3.116 19946
739 1 2 . 1 1 58 58 GLN HA H 58 5.425 5.425 4.940 0.485 19946
740 1 2 . 1 1 58 58 GLN CA C 58 54.910 54.910 54.644 0.266 19946
741 1 2 . 1 1 58 58 GLN CB C 58 32.285 32.285 30.640 1.645 19946
742 1 2 . 1 1 58 58 GLN H H 58 8.335 8.335 8.159 0.176 19946
743 1 2 . 1 1 59 59 ILE N N 59 123.505 123.505 119.417 4.088 19946
744 1 2 . 1 1 59 59 ILE HA H 59 4.492 4.492 4.817 -0.325 19946
745 1 2 . 1 1 59 59 ILE CA C 59 58.869 58.869 59.715 -0.846 19946
746 1 2 . 1 1 59 59 ILE CB C 59 42.332 42.332 41.401 0.931 19946
747 1 2 . 1 1 59 59 ILE H H 59 8.704 8.704 8.700 0.004 19946
748 1 2 . 1 1 60 60 ILE N N 60 126.464 126.464 120.176 6.288 19946
749 1 2 . 1 1 60 60 ILE HA H 60 4.954 4.954 3.688 1.266 19946
750 1 2 . 1 1 60 60 ILE CA C 60 57.357 57.357 58.012 -0.655 19946
751 1 2 . 1 1 60 60 ILE CB C 60 39.131 39.131 41.399 -2.268 19946
752 1 2 . 1 1 60 60 ILE H H 60 9.006 9.006 7.840 1.166 19946
753 1 2 . 1 1 61 61 PHE N N 61 124.441 124.441 122.789 1.652 19946
754 1 2 . 1 1 61 61 PHE HA H 61 5.795 5.795 5.319 0.476 19946
755 1 2 . 1 1 61 61 PHE CA C 61 56.131 56.131 55.958 0.173 19946
756 1 2 . 1 1 61 61 PHE CB C 61 42.879 42.879 43.654 -0.775 19946
757 1 2 . 1 1 61 61 PHE H H 61 8.938 8.938 8.870 0.068 19946
758 1 2 . 1 1 62 62 HIS N N 62 117.494 117.494 119.475 -1.981 19946
759 1 2 . 1 1 62 62 HIS HA H 62 5.928 5.928 4.977 0.951 19946
760 1 2 . 1 1 62 62 HIS CA C 62 53.322 53.322 55.582 -2.260 19946
761 1 2 . 1 1 62 62 HIS CB C 62 35.673 35.673 33.353 2.320 19946
762 1 2 . 1 1 62 62 HIS H H 62 9.230 9.230 8.130 1.100 19946
763 1 2 . 1 1 63 63 CYS N N 63 120.220 120.220 124.217 -3.997 19946
764 1 2 . 1 1 63 63 CYS HA H 63 5.033 5.033 4.022 1.011 19946
765 1 2 . 1 1 63 63 CYS CA C 63 56.131 56.131 62.935 -6.804 19946
766 1 2 . 1 1 63 63 CYS CB C 63 28.109 28.109 28.674 -0.565 19946
767 1 2 . 1 1 63 63 CYS H H 63 8.131 8.131 9.229 -1.098 19946
768 1 2 . 1 1 65 65 ALA N N 65 119.272 119.272 122.841 -3.569 19946
769 1 2 . 1 1 65 65 ALA HA H 65 5.063 5.063 4.686 0.377 19946
770 1 2 . 1 1 65 65 ALA CA C 65 49.793 49.793 51.865 -2.072 19946
771 1 2 . 1 1 65 65 ALA CB C 65 19.775 19.775 19.506 0.269 19946
772 1 2 . 1 1 65 65 ALA H H 65 8.967 8.967 8.291 0.676 19946
773 1 2 . 1 1 66 66 GLY N N 66 113.296 113.296 107.947 5.349 19946
774 1 2 . 1 1 66 66 GLY CA C 66 44.934 44.934 45.121 -0.187 19946
775 1 2 . 1 1 66 66 GLY H H 66 8.778 8.778 8.235 0.543 19946
776 1 2 . 1 1 67 67 LYS N N 67 121.300 121.300 118.652 2.648 19946
777 1 2 . 1 1 67 67 LYS HA H 67 4.211 4.211 3.807 0.404 19946
778 1 2 . 1 1 67 67 LYS H H 67 8.111 8.111 8.413 -0.302 19946
779 1 2 . 1 1 68 68 ARG N N 68 126.092 126.092 115.175 10.917 19946
780 1 2 . 1 1 68 68 ARG H H 68 9.067 9.067 8.740 0.327 19946
781 1 2 . 1 1 69 69 THR N N 69 117.153 117.153 109.651 7.502 19946
782 1 2 . 1 1 69 69 THR HA H 69 3.576 3.576 4.524 -0.948 19946
783 1 2 . 1 1 69 69 THR CA C 69 65.397 65.397 64.076 1.321 19946
784 1 2 . 1 1 69 69 THR CB C 69 66.938 66.938 69.101 -2.163 19946
785 1 2 . 1 1 69 69 THR H H 69 10.233 10.233 7.823 2.410 19946
786 1 2 . 1 1 70 70 SER N N 70 113.686 113.686 115.989 -2.303 19946
787 1 2 . 1 1 70 70 SER HA H 70 4.091 4.091 4.154 -0.063 19946
788 1 2 . 1 1 70 70 SER CA C 70 61.391 61.391 61.245 0.145 19946
789 1 2 . 1 1 70 70 SER CB C 70 65.425 65.425 62.851 2.574 19946
790 1 2 . 1 1 70 70 SER H H 70 7.322 7.322 8.372 -1.050 19946
791 1 2 . 1 1 71 71 ASN N N 71 118.257 118.257 118.542 -0.285 19946
792 1 2 . 1 1 71 71 ASN HA H 71 4.177 4.177 4.495 -0.318 19946
793 1 2 . 1 1 71 71 ASN CA C 71 54.736 54.736 55.546 -0.810 19946
794 1 2 . 1 1 71 71 ASN CB C 71 38.391 38.391 38.639 -0.248 19946
795 1 2 . 1 1 71 71 ASN H H 71 7.863 7.863 8.525 -0.662 19946
796 1 2 . 1 1 72 72 ASN N N 72 115.529 115.529 114.479 1.050 19946
797 1 2 . 1 1 72 72 ASN HA H 72 5.127 5.127 4.905 0.222 19946
798 1 2 . 1 1 72 72 ASN CA C 72 52.173 52.173 52.393 -0.220 19946
799 1 2 . 1 1 72 72 ASN CB C 72 39.165 39.165 38.124 1.041 19946
800 1 2 . 1 1 72 72 ASN H H 72 7.238 7.238 8.297 -1.059 19946
801 1 2 . 1 1 73 73 ALA N N 73 125.388 125.388 122.606 2.782 19946
802 1 2 . 1 1 73 73 ALA HA H 73 3.639 3.639 4.125 -0.486 19946
803 1 2 . 1 1 73 73 ALA CA C 73 56.133 56.133 54.337 1.796 19946
804 1 2 . 1 1 73 73 ALA CB C 73 18.528 18.528 19.017 -0.489 19946
805 1 2 . 1 1 73 73 ALA H H 73 7.081 7.081 7.460 -0.379 19946
806 1 2 . 1 1 74 74 ASP N N 74 115.501 115.501 118.634 -3.133 19946
807 1 2 . 1 1 74 74 ASP HA H 74 4.135 4.135 4.371 -0.236 19946
808 1 2 . 1 1 74 74 ASP CA C 74 55.891 55.891 57.306 -1.415 19946
809 1 2 . 1 1 74 74 ASP CB C 74 38.699 38.699 40.683 -1.984 19946
810 1 2 . 1 1 74 74 ASP H H 74 8.346 8.346 8.375 -0.029 19946
811 1 2 . 1 1 75 75 LYS N N 75 122.469 122.469 119.698 2.771 19946
812 1 2 . 1 1 75 75 LYS HA H 75 4.024 4.024 4.040 -0.016 19946
813 1 2 . 1 1 75 75 LYS CA C 75 57.861 57.861 58.993 -1.132 19946
814 1 2 . 1 1 75 75 LYS CB C 75 31.660 31.660 32.125 -0.465 19946
815 1 2 . 1 1 75 75 LYS H H 75 7.583 7.583 8.242 -0.659 19946
816 1 2 . 1 1 76 76 LEU N N 76 119.196 119.196 118.882 0.314 19946
817 1 2 . 1 1 76 76 LEU HA H 76 3.570 3.570 4.014 -0.444 19946
818 1 2 . 1 1 76 76 LEU CA C 76 56.852 56.852 57.285 -0.432 19946
819 1 2 . 1 1 76 76 LEU CB C 76 39.245 39.245 41.653 -2.408 19946
820 1 2 . 1 1 76 76 LEU H H 76 8.069 8.069 7.525 0.544 19946
821 1 2 . 1 1 77 77 ALA N N 77 120.302 120.302 120.724 -0.422 19946
822 1 2 . 1 1 77 77 ALA HA H 77 3.985 3.985 3.826 0.159 19946
823 1 2 . 1 1 77 77 ALA CA C 77 53.794 53.794 53.718 0.076 19946
824 1 2 . 1 1 77 77 ALA CB C 77 17.353 17.353 18.160 -0.807 19946
825 1 2 . 1 1 77 77 ALA H H 77 8.063 8.063 7.592 0.471 19946
826 1 2 . 1 1 78 78 ALA N N 78 119.602 119.602 117.910 1.692 19946
827 1 2 . 1 1 78 78 ALA HA H 78 4.138 4.138 4.315 -0.177 19946
828 1 2 . 1 1 78 78 ALA CA C 78 54.049 54.049 52.678 1.371 19946
829 1 2 . 1 1 78 78 ALA CB C 78 17.520 17.520 19.487 -1.967 19946
830 1 2 . 1 1 78 78 ALA H H 78 7.274 7.274 7.726 -0.452 19946
831 1 2 . 1 1 79 79 ILE N N 79 118.809 118.809 119.365 -0.556 19946
832 1 2 . 1 1 79 79 ILE HA H 79 3.798 3.798 3.861 -0.063 19946
833 1 2 . 1 1 79 79 ILE CA C 79 63.354 63.354 63.062 0.291 19946
834 1 2 . 1 1 79 79 ILE CB C 79 38.422 38.422 38.614 -0.192 19946
835 1 2 . 1 1 79 79 ILE H H 79 8.170 8.170 7.665 0.505 19946
836 1 2 . 1 1 80 80 ALA N N 80 118.736 118.736 119.155 -0.419 19946
837 1 2 . 1 1 80 80 ALA HA H 80 4.412 4.412 4.652 -0.240 19946
838 1 2 . 1 1 80 80 ALA CA C 80 50.801 50.801 50.580 0.221 19946
839 1 2 . 1 1 80 80 ALA CB C 80 19.537 19.537 18.616 0.921 19946
840 1 2 . 1 1 80 80 ALA H H 80 7.857 7.857 7.330 0.527 19946
841 1 2 . 1 1 81 81 ALA N N 81 124.485 124.485 122.850 1.635 19946
842 1 2 . 1 1 81 81 ALA HA H 81 4.353 4.353 5.084 -0.731 19946
843 1 2 . 1 1 81 81 ALA CA C 81 51.305 51.305 49.623 1.682 19946
844 1 2 . 1 1 81 81 ALA CB C 81 16.511 16.511 18.724 -2.213 19946
845 1 2 . 1 1 81 81 ALA H H 81 7.191 7.191 7.461 -0.270 19946
846 1 2 . 1 1 82 82 PRO CA C 82 62.903 62.903 62.949 -0.046 19946
847 1 2 . 1 1 83 83 ALA N N 83 128.367 128.367 122.453 5.914 19946
848 1 2 . 1 1 83 83 ALA HA H 83 4.058 4.058 4.083 -0.025 19946
849 1 2 . 1 1 83 83 ALA CA C 83 52.314 52.314 52.955 -0.641 19946
850 1 2 . 1 1 83 83 ALA CB C 83 19.001 19.001 19.475 -0.474 19946
851 1 2 . 1 1 83 83 ALA H H 83 8.472 8.472 7.662 0.810 19946
852 1 2 . 1 1 84 84 GLU N N 84 122.108 122.108 122.197 -0.089 19946
853 1 2 . 1 1 84 84 GLU HA H 84 4.164 4.164 4.415 -0.251 19946
854 1 2 . 1 1 84 84 GLU CA C 84 55.937 55.937 56.882 -0.945 19946
855 1 2 . 1 1 84 84 GLU CB C 84 30.213 30.213 30.216 -0.003 19946
856 1 2 . 1 1 84 84 GLU H H 84 8.106 8.106 8.105 0.001 19946
857 1 2 . 1 1 85 85 ILE N N 85 122.808 122.808 122.075 0.733 19946
858 1 2 . 1 1 85 85 ILE HA H 85 5.211 5.211 5.074 0.137 19946
859 1 2 . 1 1 85 85 ILE CA C 85 58.365 58.365 58.075 0.290 19946
860 1 2 . 1 1 85 85 ILE CB C 85 39.707 39.707 39.921 -0.214 19946
861 1 2 . 1 1 85 85 ILE H H 85 7.850 7.850 8.309 -0.459 19946
862 1 2 . 1 1 86 86 PHE N N 86 122.937 122.937 116.999 5.938 19946
863 1 2 . 1 1 86 86 PHE HA H 86 5.388 5.388 4.932 0.456 19946
864 1 2 . 1 1 86 86 PHE CA C 86 54.509 54.509 56.995 -2.486 19946
865 1 2 . 1 1 86 86 PHE CB C 86 42.878 42.878 41.447 1.431 19946
866 1 2 . 1 1 86 86 PHE H H 86 9.004 9.004 7.637 1.367 19946
867 1 2 . 1 1 87 87 LEU N N 87 120.712 120.712 115.107 5.605 19946
868 1 2 . 1 1 87 87 LEU HA H 87 5.295 5.295 5.240 0.055 19946
869 1 2 . 1 1 87 87 LEU CA C 87 51.810 51.810 52.440 -0.630 19946
870 1 2 . 1 1 87 87 LEU CB C 87 42.059 42.059 44.699 -2.640 19946
871 1 2 . 1 1 87 87 LEU H H 87 8.785 8.785 8.358 0.427 19946
872 1 2 . 1 1 88 88 LEU N N 88 124.779 124.779 120.842 3.937 19946
873 1 2 . 1 1 88 88 LEU HA H 88 4.434 4.434 4.911 -0.477 19946
874 1 2 . 1 1 88 88 LEU CA C 88 54.331 54.331 53.752 0.579 19946
875 1 2 . 1 1 88 88 LEU CB C 88 42.648 42.648 42.566 0.082 19946
876 1 2 . 1 1 88 88 LEU H H 88 8.243 8.243 7.938 0.305 19946
877 1 2 . 1 1 89 89 GLU N N 89 112.478 112.478 126.401 -13.923 19946
878 1 2 . 1 1 89 89 GLU HA H 89 3.881 3.881 3.802 0.079 19946
879 1 2 . 1 1 89 89 GLU H H 89 9.343 9.343 8.162 1.181 19946
880 1 2 . 1 1 90 90 ASP N N 90 120.709 120.709 118.406 2.303 19946
881 1 2 . 1 1 90 90 ASP HA H 90 4.168 4.168 4.415 -0.247 19946
882 1 2 . 1 1 90 90 ASP H H 90 9.062 9.062 8.584 0.478 19946
883 1 2 . 1 1 91 91 GLY N N 91 105.049 105.049 107.632 -2.583 19946
884 1 2 . 1 1 91 91 GLY CA C 91 46.263 46.263 46.270 -0.007 19946
885 1 2 . 1 1 91 91 GLY H H 91 7.848 7.848 8.465 -0.617 19946
886 1 2 . 1 1 92 92 ILE N N 92 122.127 122.127 124.958 -2.831 19946
887 1 2 . 1 1 92 92 ILE HA H 92 3.811 3.811 3.720 0.091 19946
888 1 2 . 1 1 92 92 ILE CA C 92 62.656 62.656 64.832 -2.176 19946
889 1 2 . 1 1 92 92 ILE CB C 92 37.243 37.243 37.254 -0.011 19946
890 1 2 . 1 1 92 92 ILE H H 92 8.077 8.077 8.236 -0.159 19946
891 1 2 . 1 1 93 93 ASP N N 93 127.038 127.038 119.843 7.195 19946
892 1 2 . 1 1 93 93 ASP HA H 93 4.452 4.452 4.451 0.001 19946
893 1 2 . 1 1 93 93 ASP CA C 93 57.357 57.357 58.243 -0.886 19946
894 1 2 . 1 1 93 93 ASP CB C 93 38.194 38.194 40.348 -2.154 19946
895 1 2 . 1 1 93 93 ASP H H 93 9.094 9.094 7.918 1.176 19946
896 1 2 . 1 1 94 94 GLY N N 94 111.411 111.411 108.188 3.223 19946
897 1 2 . 1 1 94 94 GLY CA C 94 44.750 44.750 46.002 -1.252 19946
898 1 2 . 1 1 94 94 GLY H H 94 8.047 8.047 7.387 0.660 19946
899 1 2 . 1 1 95 95 TRP N N 95 127.574 127.574 124.418 3.156 19946
900 1 2 . 1 1 95 95 TRP HA H 95 3.738 3.738 4.181 -0.443 19946
901 1 2 . 1 1 95 95 TRP CA C 95 60.852 60.852 59.679 1.173 19946
902 1 2 . 1 1 95 95 TRP CB C 95 28.613 28.613 29.543 -0.930 19946
903 1 2 . 1 1 95 95 TRP H H 95 7.918 7.918 8.946 -1.028 19946
904 1 2 . 1 1 96 96 LYS N N 96 117.374 117.374 118.694 -1.320 19946
905 1 2 . 1 1 96 96 LYS HA H 96 4.079 4.079 4.035 0.044 19946
906 1 2 . 1 1 96 96 LYS CA C 96 59.091 59.091 58.720 0.371 19946
907 1 2 . 1 1 96 96 LYS H H 96 8.625 8.625 8.557 0.068 19946
908 1 2 . 1 1 97 97 LYS N N 97 123.490 123.490 119.795 3.695 19946
909 1 2 . 1 1 97 97 LYS HA H 97 4.021 4.021 4.089 -0.068 19946
910 1 2 . 1 1 97 97 LYS CB C 97 31.542 31.542 32.520 -0.978 19946
911 1 2 . 1 1 97 97 LYS H H 97 8.233 8.233 7.705 0.528 19946
912 1 2 . 1 1 98 98 ALA N N 98 120.321 120.321 119.649 0.672 19946
913 1 2 . 1 1 98 98 ALA HA H 98 4.248 4.248 4.468 -0.220 19946
914 1 2 . 1 1 98 98 ALA CA C 98 51.305 51.305 51.205 0.100 19946
915 1 2 . 1 1 98 98 ALA CB C 98 17.744 17.744 19.073 -1.329 19946
916 1 2 . 1 1 98 98 ALA H H 98 7.480 7.480 7.161 0.319 19946
917 1 2 . 1 1 99 99 GLY N N 99 106.984 106.984 108.417 -1.433 19946
918 1 2 . 1 1 99 99 GLY CA C 99 44.246 44.246 45.899 -1.653 19946
919 1 2 . 1 1 99 99 GLY H H 99 7.867 7.867 8.521 -0.654 19946
920 1 2 . 1 1 100 100 LEU N N 100 122.993 122.993 120.775 2.218 19946
921 1 2 . 1 1 100 100 LEU HA H 100 4.277 4.277 4.345 -0.068 19946
922 1 2 . 1 1 100 100 LEU CA C 100 52.314 52.314 50.971 1.343 19946
923 1 2 . 1 1 100 100 LEU CB C 100 36.786 36.786 42.394 -5.608 19946
924 1 2 . 1 1 100 100 LEU H H 100 6.958 6.958 7.225 -0.267 19946
925 1 2 . 1 1 101 101 PRO HA H 101 4.492 4.492 4.621 -0.129 19946
926 1 2 . 1 1 101 101 PRO CB C 101 32.097 32.097 32.283 -0.186 19946
927 1 2 . 1 1 102 102 VAL N N 102 111.514 111.514 116.026 -4.512 19946
928 1 2 . 1 1 102 102 VAL HA H 102 4.367 4.367 4.403 -0.036 19946
929 1 2 . 1 1 102 102 VAL CA C 102 58.869 58.869 60.056 -1.188 19946
930 1 2 . 1 1 102 102 VAL CB C 102 35.351 35.351 32.788 2.563 19946
931 1 2 . 1 1 102 102 VAL H H 102 7.988 7.988 8.225 -0.237 19946
932 1 2 . 1 1 103 103 ALA N N 103 126.676 126.676 122.482 4.194 19946
933 1 2 . 1 1 103 103 ALA HA H 103 4.524 4.524 4.541 -0.017 19946
934 1 2 . 1 1 103 103 ALA CA C 103 49.793 49.793 51.588 -1.795 19946
935 1 2 . 1 1 103 103 ALA CB C 103 18.600 18.600 18.030 0.570 19946
936 1 2 . 1 1 103 103 ALA H H 103 8.919 8.919 8.437 0.482 19946
937 1 2 . 1 1 104 104 VAL N N 104 121.148 121.148 121.987 -0.839 19946
938 1 2 . 1 1 104 104 VAL HA H 104 4.475 4.475 4.303 0.172 19946
939 1 2 . 1 1 104 104 VAL CA C 104 59.374 59.374 61.192 -1.818 19946
940 1 2 . 1 1 104 104 VAL CB C 104 33.884 33.884 33.029 0.855 19946
941 1 2 . 1 1 104 104 VAL H H 104 8.241 8.241 7.732 0.509 19946
942 1 2 . 1 1 105 105 ASN N N 105 123.816 123.816 119.985 3.831 19946
943 1 2 . 1 1 105 105 ASN HA H 105 4.674 4.674 4.896 -0.222 19946
944 1 2 . 1 1 105 105 ASN CA C 105 53.200 53.200 53.352 -0.152 19946
945 1 2 . 1 1 105 105 ASN CB C 105 37.959 37.959 38.569 -0.610 19946
946 1 2 . 1 1 105 105 ASN H H 105 8.150 8.150 8.644 -0.494 19946
947 1 2 . 1 1 106 106 LYS N N 106 123.804 123.804 121.714 2.090 19946
948 1 2 . 1 1 106 106 LYS H H 106 8.340 8.340 8.096 0.244 19946
949 1 3 . 1 1 2 2 LEU N N 2 120.763 120.763 124.137 -3.374 19946
950 1 3 . 1 1 2 2 LEU HA H 2 4.384 4.384 4.430 -0.046 19946
951 1 3 . 1 1 2 2 LEU CA C 2 53.827 53.827 55.292 -1.465 19946
952 1 3 . 1 1 2 2 LEU CB C 2 42.229 42.229 42.379 -0.150 19946
953 1 3 . 1 1 2 2 LEU H H 2 7.888 7.888 8.494 -0.606 19946
954 1 3 . 1 1 3 3 THR N N 3 118.330 118.330 121.361 -3.031 19946
955 1 3 . 1 1 3 3 THR HA H 3 4.469 4.469 4.603 -0.134 19946
956 1 3 . 1 1 3 3 THR CA C 3 61.391 61.391 60.635 0.756 19946
957 1 3 . 1 1 3 3 THR CB C 3 69.496 69.496 70.062 -0.566 19946
958 1 3 . 1 1 3 3 THR H H 3 7.905 7.905 8.524 -0.619 19946
959 1 3 . 1 1 4 4 THR N N 4 122.024 122.024 116.182 5.842 19946
960 1 3 . 1 1 4 4 THR HA H 4 5.171 5.171 5.085 0.086 19946
961 1 3 . 1 1 4 4 THR CA C 4 61.595 61.595 60.219 1.376 19946
962 1 3 . 1 1 4 4 THR CB C 4 69.027 69.027 69.889 -0.862 19946
963 1 3 . 1 1 4 4 THR H H 4 8.504 8.504 8.226 0.278 19946
964 1 3 . 1 1 5 5 ILE N N 5 122.667 122.667 124.061 -1.394 19946
965 1 3 . 1 1 5 5 ILE HA H 5 4.973 4.973 4.627 0.346 19946
966 1 3 . 1 1 5 5 ILE CA C 5 57.971 57.971 59.288 -1.317 19946
967 1 3 . 1 1 5 5 ILE CB C 5 41.458 41.458 40.676 0.782 19946
968 1 3 . 1 1 5 5 ILE H H 5 8.903 8.903 8.150 0.753 19946
969 1 3 . 1 1 6 6 SER N N 6 123.156 123.156 112.598 10.558 19946
970 1 3 . 1 1 6 6 SER HA H 6 4.785 4.785 4.540 0.245 19946
971 1 3 . 1 1 6 6 SER H H 6 9.138 9.138 8.717 0.421 19946
972 1 3 . 1 1 7 7 PRO HA H 7 4.004 4.004 4.746 -0.742 19946
973 1 3 . 1 1 7 7 PRO CA C 7 65.510 65.510 62.601 2.909 19946
974 1 3 . 1 1 7 7 PRO CB C 7 30.924 30.924 32.249 -1.325 19946
975 1 3 . 1 1 8 8 HIS N N 8 114.319 114.319 117.505 -3.186 19946
976 1 3 . 1 1 8 8 HIS HA H 8 3.989 3.989 4.184 -0.195 19946
977 1 3 . 1 1 8 8 HIS CA C 8 60.050 60.050 60.470 -0.420 19946
978 1 3 . 1 1 8 8 HIS CB C 8 28.613 28.613 29.599 -0.986 19946
979 1 3 . 1 1 8 8 HIS H H 8 8.127 8.127 8.704 -0.577 19946
980 1 3 . 1 1 9 9 ASP N N 9 121.300 121.300 117.802 3.498 19946
981 1 3 . 1 1 9 9 ASP HA H 9 4.301 4.301 4.438 -0.137 19946
982 1 3 . 1 1 9 9 ASP CA C 9 56.455 56.455 56.813 -0.358 19946
983 1 3 . 1 1 9 9 ASP CB C 9 38.699 38.699 40.718 -2.019 19946
984 1 3 . 1 1 9 9 ASP H H 9 7.639 7.639 8.411 -0.772 19946
985 1 3 . 1 1 10 10 ALA N N 10 123.991 123.991 120.351 3.640 19946
986 1 3 . 1 1 10 10 ALA HA H 10 3.719 3.719 4.200 -0.481 19946
987 1 3 . 1 1 10 10 ALA CA C 10 54.331 54.331 54.880 -0.549 19946
988 1 3 . 1 1 10 10 ALA CB C 10 17.549 17.549 18.692 -1.143 19946
989 1 3 . 1 1 10 10 ALA H H 10 8.820 8.820 8.435 0.385 19946
990 1 3 . 1 1 11 11 GLN N N 11 118.128 118.128 116.482 1.646 19946
991 1 3 . 1 1 11 11 GLN HA H 11 3.933 3.933 4.192 -0.259 19946
992 1 3 . 1 1 11 11 GLN CA C 11 59.389 59.389 57.603 1.786 19946
993 1 3 . 1 1 11 11 GLN CB C 11 27.948 27.948 28.404 -0.456 19946
994 1 3 . 1 1 11 11 GLN H H 11 8.353 8.353 7.657 0.696 19946
995 1 3 . 1 1 12 12 GLU N N 12 119.307 119.307 120.898 -1.591 19946
996 1 3 . 1 1 12 12 GLU HA H 12 4.023 4.023 4.265 -0.242 19946
997 1 3 . 1 1 12 12 GLU CA C 12 58.476 58.476 58.761 -0.285 19946
998 1 3 . 1 1 12 12 GLU CB C 12 28.532 28.532 30.028 -1.496 19946
999 1 3 . 1 1 12 12 GLU H H 12 7.197 7.197 7.672 -0.475 19946
1000 1 3 . 1 1 13 13 LEU N N 13 120.635 120.635 118.447 2.188 19946
1001 1 3 . 1 1 13 13 LEU HA H 13 3.821 3.821 4.139 -0.318 19946
1002 1 3 . 1 1 13 13 LEU CA C 13 57.065 57.065 58.239 -1.174 19946
1003 1 3 . 1 1 13 13 LEU CB C 13 40.890 40.890 41.336 -0.446 19946
1004 1 3 . 1 1 13 13 LEU H H 13 7.554 7.554 7.544 0.010 19946
1005 1 3 . 1 1 14 14 ILE N N 14 123.021 123.021 119.701 3.320 19946
1006 1 3 . 1 1 14 14 ILE HA H 14 3.827 3.827 3.872 -0.045 19946
1007 1 3 . 1 1 14 14 ILE CA C 14 64.053 64.053 64.787 -0.734 19946
1008 1 3 . 1 1 14 14 ILE CB C 14 38.115 38.115 37.511 0.604 19946
1009 1 3 . 1 1 14 14 ILE H H 14 8.710 8.710 7.668 1.042 19946
1010 1 3 . 1 1 15 15 ALA N N 15 124.504 124.504 120.478 4.026 19946
1011 1 3 . 1 1 15 15 ALA HA H 15 4.115 4.115 4.153 -0.038 19946
1012 1 3 . 1 1 15 15 ALA CA C 15 54.257 54.257 53.997 0.260 19946
1013 1 3 . 1 1 15 15 ALA CB C 15 17.040 17.040 18.496 -1.456 19946
1014 1 3 . 1 1 15 15 ALA H H 15 7.758 7.758 7.704 0.054 19946
1015 1 3 . 1 1 16 16 ARG N N 16 115.990 115.990 116.850 -0.860 19946
1016 1 3 . 1 1 16 16 ARG HA H 16 4.348 4.348 4.382 -0.034 19946
1017 1 3 . 1 1 16 16 ARG CA C 16 55.416 55.416 56.702 -1.286 19946
1018 1 3 . 1 1 16 16 ARG CB C 16 29.762 29.762 31.197 -1.435 19946
1019 1 3 . 1 1 16 16 ARG H H 16 7.252 7.252 7.999 -0.747 19946
1020 1 3 . 1 1 17 17 GLY N N 17 107.981 107.981 105.517 2.464 19946
1021 1 3 . 1 1 17 17 GLY CA C 17 44.854 44.854 44.351 0.503 19946
1022 1 3 . 1 1 17 17 GLY H H 17 7.748 7.748 7.547 0.201 19946
1023 1 3 . 1 1 18 18 ALA N N 18 123.914 123.914 123.644 0.270 19946
1024 1 3 . 1 1 18 18 ALA HA H 18 4.221 4.221 4.302 -0.081 19946
1025 1 3 . 1 1 18 18 ALA CA C 18 52.270 52.270 52.508 -0.238 19946
1026 1 3 . 1 1 18 18 ALA CB C 18 18.638 18.638 19.874 -1.236 19946
1027 1 3 . 1 1 18 18 ALA H H 18 7.940 7.940 8.183 -0.243 19946
1028 1 3 . 1 1 19 19 LYS N N 19 119.436 119.436 120.383 -0.947 19946
1029 1 3 . 1 1 19 19 LYS HA H 19 4.301 4.301 4.567 -0.266 19946
1030 1 3 . 1 1 19 19 LYS CA C 19 53.105 53.105 55.030 -1.925 19946
1031 1 3 . 1 1 19 19 LYS CB C 19 32.856 32.856 36.396 -3.540 19946
1032 1 3 . 1 1 19 19 LYS H H 19 7.565 7.565 7.704 -0.139 19946
1033 1 3 . 1 1 20 20 LEU N N 20 127.401 127.401 122.458 4.943 19946
1034 1 3 . 1 1 20 20 LEU HA H 20 5.042 5.042 4.532 0.510 19946
1035 1 3 . 1 1 20 20 LEU CA C 20 52.314 52.314 54.053 -1.739 19946
1036 1 3 . 1 1 20 20 LEU CB C 20 43.234 43.234 45.854 -2.620 19946
1037 1 3 . 1 1 20 20 LEU H H 20 8.727 8.727 8.232 0.495 19946
1038 1 3 . 1 1 21 21 ILE N N 21 128.186 128.186 121.960 6.226 19946
1039 1 3 . 1 1 21 21 ILE HA H 21 4.547 4.547 4.309 0.238 19946
1040 1 3 . 1 1 21 21 ILE CA C 21 59.589 59.589 59.464 0.125 19946
1041 1 3 . 1 1 21 21 ILE CB C 21 38.545 38.545 42.377 -3.832 19946
1042 1 3 . 1 1 21 21 ILE H H 21 9.366 9.366 7.957 1.409 19946
1043 1 3 . 1 1 22 22 ASP N N 22 129.968 129.968 125.506 4.462 19946
1044 1 3 . 1 1 22 22 ASP HA H 22 3.803 3.803 5.409 -1.606 19946
1045 1 3 . 1 1 22 22 ASP CA C 22 51.435 51.435 52.608 -1.173 19946
1046 1 3 . 1 1 22 22 ASP CB C 22 42.062 42.062 42.921 -0.859 19946
1047 1 3 . 1 1 22 22 ASP H H 22 8.583 8.583 8.112 0.471 19946
1048 1 3 . 1 1 23 23 ILE N N 23 116.266 116.266 121.188 -4.922 19946
1049 1 3 . 1 1 23 23 ILE HA H 23 5.229 5.229 4.769 0.460 19946
1050 1 3 . 1 1 23 23 ILE CA C 23 59.374 59.374 59.301 0.073 19946
1051 1 3 . 1 1 23 23 ILE CB C 23 37.327 37.327 37.137 0.190 19946
1052 1 3 . 1 1 23 23 ILE H H 23 7.836 7.836 7.966 -0.130 19946
1053 1 3 . 1 1 24 24 ARG N N 24 125.001 125.001 121.738 3.263 19946
1054 1 3 . 1 1 24 24 ARG HA H 24 4.116 4.116 4.535 -0.419 19946
1055 1 3 . 1 1 24 24 ARG CA C 24 55.943 55.943 53.589 2.354 19946
1056 1 3 . 1 1 24 24 ARG CB C 24 30.135 30.135 30.906 -0.771 19946
1057 1 3 . 1 1 24 24 ARG H H 24 8.195 8.195 7.926 0.269 19946
1058 1 3 . 1 1 25 25 ASP N N 25 112.839 112.839 119.258 -6.419 19946
1059 1 3 . 1 1 25 25 ASP HA H 25 4.545 4.545 4.470 0.075 19946
1060 1 3 . 1 1 25 25 ASP CA C 25 53.870 53.870 54.795 -0.925 19946
1061 1 3 . 1 1 25 25 ASP CB C 25 41.327 41.327 41.044 0.283 19946
1062 1 3 . 1 1 25 25 ASP H H 25 7.660 7.660 8.384 -0.724 19946
1063 1 3 . 1 1 26 26 ALA N N 26 122.145 122.145 123.475 -1.330 19946
1064 1 3 . 1 1 26 26 ALA HA H 26 3.897 3.897 4.391 -0.494 19946
1065 1 3 . 1 1 26 26 ALA CA C 26 54.958 54.958 53.255 1.703 19946
1066 1 3 . 1 1 26 26 ALA CB C 26 17.520 17.520 20.385 -2.865 19946
1067 1 3 . 1 1 26 26 ALA H H 26 8.766 8.766 8.370 0.396 19946
1068 1 3 . 1 1 27 27 ASP N N 27 115.380 115.380 117.512 -2.132 19946
1069 1 3 . 1 1 27 27 ASP HA H 27 4.299 4.299 4.494 -0.195 19946
1070 1 3 . 1 1 27 27 ASP CA C 27 56.451 56.451 56.074 0.377 19946
1071 1 3 . 1 1 27 27 ASP CB C 27 39.156 39.156 40.219 -1.063 19946
1072 1 3 . 1 1 27 27 ASP H H 27 8.686 8.686 8.404 0.282 19946
1073 1 3 . 1 1 28 28 GLU N N 28 120.081 120.081 118.440 1.641 19946
1074 1 3 . 1 1 28 28 GLU HA H 28 4.086 4.086 4.236 -0.150 19946
1075 1 3 . 1 1 28 28 GLU CA C 28 58.389 58.389 57.878 0.511 19946
1076 1 3 . 1 1 28 28 GLU CB C 28 28.728 28.728 30.116 -1.388 19946
1077 1 3 . 1 1 28 28 GLU H H 28 7.397 7.397 8.530 -1.133 19946
1078 1 3 . 1 1 29 29 TYR N N 29 121.205 121.205 117.881 3.324 19946
1079 1 3 . 1 1 29 29 TYR HA H 29 4.083 4.083 4.635 -0.552 19946
1080 1 3 . 1 1 29 29 TYR CA C 29 60.378 60.378 56.808 3.570 19946
1081 1 3 . 1 1 29 29 TYR CB C 29 38.699 38.699 38.609 0.090 19946
1082 1 3 . 1 1 29 29 TYR H H 29 7.506 7.506 7.838 -0.332 19946
1083 1 3 . 1 1 30 30 LEU N N 30 118.828 118.828 120.196 -1.368 19946
1084 1 3 . 1 1 30 30 LEU HA H 30 3.850 3.850 3.954 -0.104 19946
1085 1 3 . 1 1 30 30 LEU CA C 30 56.348 56.348 57.162 -0.814 19946
1086 1 3 . 1 1 30 30 LEU CB C 30 41.220 41.220 42.037 -0.817 19946
1087 1 3 . 1 1 30 30 LEU H H 30 8.211 8.211 7.649 0.562 19946
1088 1 3 . 1 1 31 31 ARG N N 31 118.220 118.220 118.193 0.027 19946
1089 1 3 . 1 1 31 31 ARG HA H 31 4.101 4.101 4.144 -0.043 19946
1090 1 3 . 1 1 31 31 ARG CA C 31 58.365 58.365 57.807 0.558 19946
1091 1 3 . 1 1 31 31 ARG CB C 31 30.074 30.074 30.367 -0.293 19946
1092 1 3 . 1 1 31 31 ARG H H 31 7.120 7.120 8.190 -1.070 19946
1093 1 3 . 1 1 32 32 GLU N N 32 117.980 117.980 117.434 0.546 19946
1094 1 3 . 1 1 32 32 GLU HA H 32 4.884 4.884 3.963 0.921 19946
1095 1 3 . 1 1 32 32 GLU CA C 32 55.339 55.339 57.394 -2.055 19946
1096 1 3 . 1 1 32 32 GLU CB C 32 31.698 31.698 29.746 1.952 19946
1097 1 3 . 1 1 32 32 GLU H H 32 7.506 7.506 8.158 -0.652 19946
1098 1 3 . 1 1 33 33 HIS N N 33 118.257 118.257 117.332 0.925 19946
1099 1 3 . 1 1 33 33 HIS HA H 33 4.643 4.643 4.675 -0.032 19946
1100 1 3 . 1 1 33 33 HIS CA C 33 53.766 53.766 54.277 -0.511 19946
1101 1 3 . 1 1 33 33 HIS CB C 33 29.940 29.940 32.641 -2.700 19946
1102 1 3 . 1 1 33 33 HIS H H 33 8.269 8.269 8.114 0.155 19946
1103 1 3 . 1 1 34 34 ILE N N 34 127.809 127.809 117.484 10.325 19946
1104 1 3 . 1 1 34 34 ILE HA H 34 3.920 3.920 4.440 -0.520 19946
1105 1 3 . 1 1 34 34 ILE CA C 34 59.648 59.648 58.372 1.276 19946
1106 1 3 . 1 1 34 34 ILE CB C 34 37.959 37.959 41.486 -3.527 19946
1107 1 3 . 1 1 34 34 ILE H H 34 9.989 9.989 8.241 1.748 19946
1108 1 3 . 1 1 35 35 PRO HA H 35 4.198 4.198 4.284 -0.086 19946
1109 1 3 . 1 1 36 36 GLU N N 36 114.414 114.414 118.461 -4.047 19946
1110 1 3 . 1 1 36 36 GLU HA H 36 4.082 4.082 4.328 -0.246 19946
1111 1 3 . 1 1 36 36 GLU CA C 36 57.861 57.861 56.111 1.750 19946
1112 1 3 . 1 1 36 36 GLU CB C 36 28.109 28.109 29.806 -1.698 19946
1113 1 3 . 1 1 36 36 GLU H H 36 8.557 8.557 8.027 0.530 19946
1114 1 3 . 1 1 37 37 ALA N N 37 122.882 122.882 124.599 -1.717 19946
1115 1 3 . 1 1 37 37 ALA HA H 37 4.439 4.439 4.647 -0.208 19946
1116 1 3 . 1 1 37 37 ALA CA C 37 52.005 52.005 51.568 0.437 19946
1117 1 3 . 1 1 37 37 ALA CB C 37 20.438 20.438 20.772 -0.334 19946
1118 1 3 . 1 1 37 37 ALA H H 37 8.096 8.096 7.926 0.170 19946
1119 1 3 . 1 1 38 38 ASP N N 38 124.471 124.471 118.225 6.246 19946
1120 1 3 . 1 1 38 38 ASP HA H 38 4.844 4.844 5.085 -0.241 19946
1121 1 3 . 1 1 38 38 ASP CA C 38 52.614 52.614 53.785 -1.171 19946
1122 1 3 . 1 1 38 38 ASP CB C 38 44.407 44.407 43.812 0.595 19946
1123 1 3 . 1 1 38 38 ASP H H 38 9.004 9.004 8.408 0.596 19946
1124 1 3 . 1 1 39 39 LEU N N 39 123.936 123.936 125.468 -1.532 19946
1125 1 3 . 1 1 39 39 LEU HA H 39 4.328 4.328 4.649 -0.321 19946
1126 1 3 . 1 1 39 39 LEU CA C 39 54.037 54.037 56.024 -1.987 19946
1127 1 3 . 1 1 39 39 LEU CB C 39 41.220 41.220 42.858 -1.638 19946
1128 1 3 . 1 1 39 39 LEU H H 39 8.125 8.125 8.748 -0.623 19946
1129 1 3 . 1 1 40 40 ALA N N 40 131.297 131.297 125.751 5.546 19946
1130 1 3 . 1 1 40 40 ALA HA H 40 4.408 4.408 4.579 -0.171 19946
1131 1 3 . 1 1 40 40 ALA CA C 40 48.784 48.784 50.722 -1.938 19946
1132 1 3 . 1 1 40 40 ALA CB C 40 17.979 17.979 19.768 -1.789 19946
1133 1 3 . 1 1 40 40 ALA H H 40 8.654 8.654 8.903 -0.249 19946
1134 1 3 . 1 1 41 41 PRO HA H 41 4.101 4.101 4.622 -0.521 19946
1135 1 3 . 1 1 41 41 PRO CA C 41 61.391 61.391 62.172 -0.781 19946
1136 1 3 . 1 1 41 41 PRO CB C 41 32.097 32.097 33.185 -1.089 19946
1137 1 3 . 1 1 42 42 LEU N N 42 125.312 125.312 120.120 5.192 19946
1138 1 3 . 1 1 42 42 LEU HA H 42 3.871 3.871 3.875 -0.004 19946
1139 1 3 . 1 1 42 42 LEU CA C 42 57.861 57.861 58.485 -0.624 19946
1140 1 3 . 1 1 42 42 LEU CB C 42 40.941 40.941 41.390 -0.449 19946
1141 1 3 . 1 1 42 42 LEU H H 42 8.285 8.285 8.517 -0.232 19946
1142 1 3 . 1 1 43 43 SER N N 43 110.669 110.669 114.134 -3.465 19946
1143 1 3 . 1 1 43 43 SER HA H 43 4.106 4.106 4.136 -0.030 19946
1144 1 3 . 1 1 43 43 SER CA C 43 60.497 60.497 61.050 -0.553 19946
1145 1 3 . 1 1 43 43 SER CB C 43 61.391 61.391 62.609 -1.218 19946
1146 1 3 . 1 1 43 43 SER H H 43 8.453 8.453 8.135 0.318 19946
1147 1 3 . 1 1 44 44 VAL N N 44 123.933 123.933 122.280 1.653 19946
1148 1 3 . 1 1 44 44 VAL HA H 44 3.821 3.821 3.811 0.010 19946
1149 1 3 . 1 1 44 44 VAL CA C 44 64.752 64.752 66.003 -1.251 19946
1150 1 3 . 1 1 44 44 VAL CB C 44 31.135 31.135 31.568 -0.433 19946
1151 1 3 . 1 1 44 44 VAL H H 44 7.156 7.156 7.891 -0.735 19946
1152 1 3 . 1 1 45 45 LEU N N 45 121.150 121.150 119.113 2.037 19946
1153 1 3 . 1 1 45 45 LEU HA H 45 3.767 3.767 4.139 -0.372 19946
1154 1 3 . 1 1 45 45 LEU CA C 45 56.599 56.599 57.423 -0.824 19946
1155 1 3 . 1 1 45 45 LEU CB C 45 40.890 40.890 41.233 -0.343 19946
1156 1 3 . 1 1 45 45 LEU H H 45 7.997 7.997 9.016 -1.019 19946
1157 1 3 . 1 1 46 46 GLU N N 46 116.256 116.256 119.026 -2.770 19946
1158 1 3 . 1 1 46 46 GLU HA H 46 3.678 3.678 4.275 -0.597 19946
1159 1 3 . 1 1 46 46 GLU CA C 46 58.365 58.365 58.465 -0.100 19946
1160 1 3 . 1 1 46 46 GLU CB C 46 29.622 29.622 29.810 -0.188 19946
1161 1 3 . 1 1 46 46 GLU H H 46 8.501 8.501 8.117 0.384 19946
1162 1 3 . 1 1 47 47 GLN N N 47 117.261 117.261 117.366 -0.105 19946
1163 1 3 . 1 1 47 47 GLN HA H 47 4.216 4.216 4.279 -0.063 19946
1164 1 3 . 1 1 47 47 GLN CA C 47 56.852 56.852 57.755 -0.902 19946
1165 1 3 . 1 1 47 47 GLN CB C 47 29.119 29.119 29.859 -0.740 19946
1166 1 3 . 1 1 47 47 GLN H H 47 7.407 7.407 8.118 -0.711 19946
1167 1 3 . 1 1 48 48 SER N N 48 111.890 111.890 112.338 -0.448 19946
1168 1 3 . 1 1 48 48 SER HA H 48 4.641 4.641 4.582 0.059 19946
1169 1 3 . 1 1 48 48 SER CA C 48 57.956 57.956 58.555 -0.599 19946
1170 1 3 . 1 1 48 48 SER CB C 48 63.912 63.912 65.057 -1.145 19946
1171 1 3 . 1 1 48 48 SER H H 48 8.566 8.566 8.401 0.165 19946
1172 1 3 . 1 1 49 49 GLY N N 49 111.545 111.545 110.213 1.332 19946
1173 1 3 . 1 1 49 49 GLY CA C 49 43.894 43.894 44.554 -0.660 19946
1174 1 3 . 1 1 49 49 GLY H H 49 7.836 7.836 7.886 -0.050 19946
1175 1 3 . 1 1 50 50 LEU N N 50 121.541 121.541 124.589 -3.048 19946
1176 1 3 . 1 1 50 50 LEU HA H 50 4.239 4.239 4.263 -0.024 19946
1177 1 3 . 1 1 50 50 LEU CA C 50 51.985 51.985 54.688 -2.703 19946
1178 1 3 . 1 1 50 50 LEU CB C 50 42.648 42.648 41.348 1.300 19946
1179 1 3 . 1 1 50 50 LEU H H 50 8.564 8.564 8.405 0.159 19946
1180 1 3 . 1 1 51 51 PRO HA H 51 4.243 4.243 4.518 -0.275 19946
1181 1 3 . 1 1 51 51 PRO CB C 51 31.639 31.639 32.502 -0.863 19946
1182 1 3 . 1 1 52 52 ALA N N 52 127.008 127.008 127.939 -0.931 19946
1183 1 3 . 1 1 52 52 ALA HA H 52 3.790 3.790 3.998 -0.208 19946
1184 1 3 . 1 1 52 52 ALA CA C 52 54.835 54.835 54.643 0.192 19946
1185 1 3 . 1 1 52 52 ALA CB C 52 17.715 17.715 18.646 -0.931 19946
1186 1 3 . 1 1 52 52 ALA H H 52 8.564 8.564 8.662 -0.098 19946
1187 1 3 . 1 1 53 53 LYS N N 53 114.535 114.535 115.380 -0.845 19946
1188 1 3 . 1 1 53 53 LYS HA H 53 4.106 4.106 4.067 0.039 19946
1189 1 3 . 1 1 53 53 LYS CA C 53 56.852 56.852 58.096 -1.244 19946
1190 1 3 . 1 1 53 53 LYS CB C 53 31.386 31.386 31.747 -0.361 19946
1191 1 3 . 1 1 53 53 LYS H H 53 8.364 8.364 8.329 0.035 19946
1192 1 3 . 1 1 54 54 LEU N N 54 118.515 118.515 117.409 1.106 19946
1193 1 3 . 1 1 54 54 LEU HA H 54 4.247 4.247 4.533 -0.286 19946
1194 1 3 . 1 1 54 54 LEU CA C 54 53.338 53.338 53.412 -0.074 19946
1195 1 3 . 1 1 54 54 LEU CB C 54 40.890 40.890 42.176 -1.286 19946
1196 1 3 . 1 1 54 54 LEU H H 54 7.745 7.745 7.416 0.329 19946
1197 1 3 . 1 1 55 55 ARG N N 55 117.612 117.612 121.397 -3.785 19946
1198 1 3 . 1 1 55 55 ARG HA H 55 3.927 3.927 4.468 -0.541 19946
1199 1 3 . 1 1 55 55 ARG CA C 55 56.832 56.832 55.640 1.192 19946
1200 1 3 . 1 1 55 55 ARG CB C 55 28.610 28.610 31.580 -2.970 19946
1201 1 3 . 1 1 55 55 ARG H H 55 6.938 6.938 7.662 -0.724 19946
1202 1 3 . 1 1 56 56 HIS N N 56 123.269 123.269 123.199 0.070 19946
1203 1 3 . 1 1 56 56 HIS HA H 56 4.614 4.614 4.830 -0.216 19946
1204 1 3 . 1 1 56 56 HIS CA C 56 54.835 54.835 55.401 -0.566 19946
1205 1 3 . 1 1 56 56 HIS CB C 56 32.648 32.648 31.866 0.781 19946
1206 1 3 . 1 1 56 56 HIS H H 56 7.237 7.237 8.531 -1.294 19946
1207 1 3 . 1 1 57 57 GLU N N 57 120.895 120.895 117.792 3.103 19946
1208 1 3 . 1 1 57 57 GLU HA H 57 3.976 3.976 4.465 -0.489 19946
1209 1 3 . 1 1 57 57 GLU CA C 57 58.871 58.871 56.576 2.295 19946
1210 1 3 . 1 1 57 57 GLU CB C 57 29.158 29.158 31.156 -1.998 19946
1211 1 3 . 1 1 57 57 GLU H H 57 7.625 7.625 8.870 -1.245 19946
1212 1 3 . 1 1 58 58 GLN N N 58 118.485 118.485 115.671 2.814 19946
1213 1 3 . 1 1 58 58 GLN HA H 58 5.425 5.425 5.125 0.300 19946
1214 1 3 . 1 1 58 58 GLN CA C 58 54.910 54.910 54.621 0.289 19946
1215 1 3 . 1 1 58 58 GLN CB C 58 32.285 32.285 30.291 1.994 19946
1216 1 3 . 1 1 58 58 GLN H H 58 8.335 8.335 7.735 0.600 19946
1217 1 3 . 1 1 59 59 ILE N N 59 123.505 123.505 118.725 4.780 19946
1218 1 3 . 1 1 59 59 ILE HA H 59 4.492 4.492 5.226 -0.734 19946
1219 1 3 . 1 1 59 59 ILE CA C 59 58.869 58.869 58.503 0.366 19946
1220 1 3 . 1 1 59 59 ILE CB C 59 42.332 42.332 41.522 0.810 19946
1221 1 3 . 1 1 59 59 ILE H H 59 8.704 8.704 8.204 0.500 19946
1222 1 3 . 1 1 60 60 ILE N N 60 126.464 126.464 115.701 10.763 19946
1223 1 3 . 1 1 60 60 ILE HA H 60 4.954 4.954 4.600 0.354 19946
1224 1 3 . 1 1 60 60 ILE CA C 60 57.357 57.357 59.982 -2.625 19946
1225 1 3 . 1 1 60 60 ILE CB C 60 39.131 39.131 42.396 -3.265 19946
1226 1 3 . 1 1 60 60 ILE H H 60 9.006 9.006 7.471 1.535 19946
1227 1 3 . 1 1 61 61 PHE N N 61 124.441 124.441 120.274 4.167 19946
1228 1 3 . 1 1 61 61 PHE HA H 61 5.795 5.795 5.029 0.766 19946
1229 1 3 . 1 1 61 61 PHE CA C 61 56.131 56.131 56.986 -0.855 19946
1230 1 3 . 1 1 61 61 PHE CB C 61 42.879 42.879 43.278 -0.399 19946
1231 1 3 . 1 1 61 61 PHE H H 61 8.938 8.938 8.227 0.711 19946
1232 1 3 . 1 1 62 62 HIS N N 62 117.494 117.494 118.930 -1.436 19946
1233 1 3 . 1 1 62 62 HIS HA H 62 5.928 5.928 5.084 0.844 19946
1234 1 3 . 1 1 62 62 HIS CA C 62 53.322 53.322 54.435 -1.113 19946
1235 1 3 . 1 1 62 62 HIS CB C 62 35.673 35.673 33.145 2.528 19946
1236 1 3 . 1 1 62 62 HIS H H 62 9.230 9.230 8.683 0.547 19946
1237 1 3 . 1 1 63 63 CYS N N 63 120.220 120.220 118.589 1.631 19946
1238 1 3 . 1 1 63 63 CYS HA H 63 5.033 5.033 4.716 0.317 19946
1239 1 3 . 1 1 63 63 CYS CA C 63 56.131 56.131 57.333 -1.202 19946
1240 1 3 . 1 1 63 63 CYS CB C 63 28.109 28.109 31.485 -3.376 19946
1241 1 3 . 1 1 63 63 CYS H H 63 8.131 8.131 8.827 -0.696 19946
1242 1 3 . 1 1 65 65 ALA N N 65 119.272 119.272 119.300 -0.028 19946
1243 1 3 . 1 1 65 65 ALA HA H 65 5.063 5.063 4.433 0.630 19946
1244 1 3 . 1 1 65 65 ALA CA C 65 49.793 49.793 51.616 -1.823 19946
1245 1 3 . 1 1 65 65 ALA CB C 65 19.775 19.775 18.455 1.320 19946
1246 1 3 . 1 1 65 65 ALA H H 65 8.967 8.967 7.454 1.513 19946
1247 1 3 . 1 1 66 66 GLY N N 66 113.296 113.296 109.288 4.008 19946
1248 1 3 . 1 1 66 66 GLY CA C 66 44.934 44.934 45.523 -0.589 19946
1249 1 3 . 1 1 66 66 GLY H H 66 8.778 8.778 7.796 0.982 19946
1250 1 3 . 1 1 67 67 LYS N N 67 121.300 121.300 119.542 1.758 19946
1251 1 3 . 1 1 67 67 LYS HA H 67 4.211 4.211 3.802 0.409 19946
1252 1 3 . 1 1 67 67 LYS H H 67 8.111 8.111 8.431 -0.320 19946
1253 1 3 . 1 1 68 68 ARG N N 68 126.092 126.092 119.817 6.275 19946
1254 1 3 . 1 1 68 68 ARG H H 68 9.067 9.067 8.540 0.527 19946
1255 1 3 . 1 1 69 69 THR N N 69 117.153 117.153 114.154 2.999 19946
1256 1 3 . 1 1 69 69 THR HA H 69 3.576 3.576 4.394 -0.818 19946
1257 1 3 . 1 1 69 69 THR CA C 69 65.397 65.397 63.310 2.087 19946
1258 1 3 . 1 1 69 69 THR CB C 69 66.938 66.938 69.386 -2.448 19946
1259 1 3 . 1 1 69 69 THR H H 69 10.233 10.233 7.927 2.306 19946
1260 1 3 . 1 1 70 70 SER N N 70 113.686 113.686 116.749 -3.063 19946
1261 1 3 . 1 1 70 70 SER HA H 70 4.091 4.091 4.336 -0.245 19946
1262 1 3 . 1 1 70 70 SER CA C 70 61.391 61.391 60.344 1.047 19946
1263 1 3 . 1 1 70 70 SER CB C 70 65.425 65.425 62.688 2.737 19946
1264 1 3 . 1 1 70 70 SER H H 70 7.322 7.322 8.312 -0.990 19946
1265 1 3 . 1 1 71 71 ASN N N 71 118.257 118.257 118.614 -0.357 19946
1266 1 3 . 1 1 71 71 ASN HA H 71 4.177 4.177 4.490 -0.313 19946
1267 1 3 . 1 1 71 71 ASN CA C 71 54.736 54.736 55.509 -0.773 19946
1268 1 3 . 1 1 71 71 ASN CB C 71 38.391 38.391 38.616 -0.225 19946
1269 1 3 . 1 1 71 71 ASN H H 71 7.863 7.863 8.632 -0.769 19946
1270 1 3 . 1 1 72 72 ASN N N 72 115.529 115.529 115.496 0.033 19946
1271 1 3 . 1 1 72 72 ASN HA H 72 5.127 5.127 4.909 0.218 19946
1272 1 3 . 1 1 72 72 ASN CA C 72 52.173 52.173 52.883 -0.710 19946
1273 1 3 . 1 1 72 72 ASN CB C 72 39.165 39.165 38.992 0.173 19946
1274 1 3 . 1 1 72 72 ASN H H 72 7.238 7.238 7.935 -0.697 19946
1275 1 3 . 1 1 73 73 ALA N N 73 125.388 125.388 122.950 2.438 19946
1276 1 3 . 1 1 73 73 ALA HA H 73 3.639 3.639 4.103 -0.464 19946
1277 1 3 . 1 1 73 73 ALA CA C 73 56.133 56.133 54.189 1.944 19946
1278 1 3 . 1 1 73 73 ALA CB C 73 18.528 18.528 19.330 -0.802 19946
1279 1 3 . 1 1 73 73 ALA H H 73 7.081 7.081 7.510 -0.429 19946
1280 1 3 . 1 1 74 74 ASP N N 74 115.501 115.501 119.770 -4.269 19946
1281 1 3 . 1 1 74 74 ASP HA H 74 4.135 4.135 4.442 -0.307 19946
1282 1 3 . 1 1 74 74 ASP CA C 74 55.891 55.891 57.490 -1.599 19946
1283 1 3 . 1 1 74 74 ASP CB C 74 38.699 38.699 40.857 -2.158 19946
1284 1 3 . 1 1 74 74 ASP H H 74 8.346 8.346 8.428 -0.082 19946
1285 1 3 . 1 1 75 75 LYS N N 75 122.469 122.469 119.311 3.158 19946
1286 1 3 . 1 1 75 75 LYS HA H 75 4.024 4.024 4.049 -0.025 19946
1287 1 3 . 1 1 75 75 LYS CA C 75 57.861 57.861 58.624 -0.763 19946
1288 1 3 . 1 1 75 75 LYS CB C 75 31.660 31.660 31.981 -0.321 19946
1289 1 3 . 1 1 75 75 LYS H H 75 7.583 7.583 8.234 -0.651 19946
1290 1 3 . 1 1 76 76 LEU N N 76 119.196 119.196 117.906 1.290 19946
1291 1 3 . 1 1 76 76 LEU HA H 76 3.570 3.570 3.925 -0.355 19946
1292 1 3 . 1 1 76 76 LEU CA C 76 56.852 56.852 57.353 -0.501 19946
1293 1 3 . 1 1 76 76 LEU CB C 76 39.245 39.245 41.405 -2.160 19946
1294 1 3 . 1 1 76 76 LEU H H 76 8.069 8.069 7.348 0.721 19946
1295 1 3 . 1 1 77 77 ALA N N 77 120.302 120.302 120.326 -0.024 19946
1296 1 3 . 1 1 77 77 ALA HA H 77 3.985 3.985 4.121 -0.136 19946
1297 1 3 . 1 1 77 77 ALA CA C 77 53.794 53.794 54.205 -0.411 19946
1298 1 3 . 1 1 77 77 ALA CB C 77 17.353 17.353 18.556 -1.203 19946
1299 1 3 . 1 1 77 77 ALA H H 77 8.063 8.063 7.566 0.497 19946
1300 1 3 . 1 1 78 78 ALA N N 78 119.602 119.602 117.758 1.844 19946
1301 1 3 . 1 1 78 78 ALA HA H 78 4.138 4.138 4.330 -0.192 19946
1302 1 3 . 1 1 78 78 ALA CA C 78 54.049 54.049 52.881 1.168 19946
1303 1 3 . 1 1 78 78 ALA CB C 78 17.520 17.520 19.303 -1.783 19946
1304 1 3 . 1 1 78 78 ALA H H 78 7.274 7.274 7.652 -0.378 19946
1305 1 3 . 1 1 79 79 ILE N N 79 118.809 118.809 119.489 -0.680 19946
1306 1 3 . 1 1 79 79 ILE HA H 79 3.798 3.798 3.943 -0.145 19946
1307 1 3 . 1 1 79 79 ILE CA C 79 63.354 63.354 63.257 0.097 19946
1308 1 3 . 1 1 79 79 ILE CB C 79 38.422 38.422 39.078 -0.656 19946
1309 1 3 . 1 1 79 79 ILE H H 79 8.170 8.170 7.740 0.430 19946
1310 1 3 . 1 1 80 80 ALA N N 80 118.736 118.736 120.107 -1.371 19946
1311 1 3 . 1 1 80 80 ALA HA H 80 4.412 4.412 4.629 -0.217 19946
1312 1 3 . 1 1 80 80 ALA CA C 80 50.801 50.801 50.181 0.620 19946
1313 1 3 . 1 1 80 80 ALA CB C 80 19.537 19.537 18.369 1.168 19946
1314 1 3 . 1 1 80 80 ALA H H 80 7.857 7.857 7.576 0.281 19946
1315 1 3 . 1 1 81 81 ALA N N 81 124.485 124.485 122.411 2.074 19946
1316 1 3 . 1 1 81 81 ALA HA H 81 4.353 4.353 5.073 -0.720 19946
1317 1 3 . 1 1 81 81 ALA CA C 81 51.305 51.305 49.285 2.020 19946
1318 1 3 . 1 1 81 81 ALA CB C 81 16.511 16.511 18.770 -2.259 19946
1319 1 3 . 1 1 81 81 ALA H H 81 7.191 7.191 7.499 -0.308 19946
1320 1 3 . 1 1 82 82 PRO CA C 82 62.903 62.903 62.965 -0.062 19946
1321 1 3 . 1 1 83 83 ALA N N 83 128.367 128.367 122.626 5.741 19946
1322 1 3 . 1 1 83 83 ALA HA H 83 4.058 4.058 4.027 0.031 19946
1323 1 3 . 1 1 83 83 ALA CA C 83 52.314 52.314 52.784 -0.470 19946
1324 1 3 . 1 1 83 83 ALA CB C 83 19.001 19.001 19.287 -0.286 19946
1325 1 3 . 1 1 83 83 ALA H H 83 8.472 8.472 7.667 0.805 19946
1326 1 3 . 1 1 84 84 GLU N N 84 122.108 122.108 122.818 -0.710 19946
1327 1 3 . 1 1 84 84 GLU HA H 84 4.164 4.164 4.301 -0.137 19946
1328 1 3 . 1 1 84 84 GLU CA C 84 55.937 55.937 56.762 -0.825 19946
1329 1 3 . 1 1 84 84 GLU CB C 84 30.213 30.213 30.322 -0.109 19946
1330 1 3 . 1 1 84 84 GLU H H 84 8.106 8.106 7.952 0.154 19946
1331 1 3 . 1 1 85 85 ILE N N 85 122.808 122.808 121.928 0.880 19946
1332 1 3 . 1 1 85 85 ILE HA H 85 5.211 5.211 4.525 0.686 19946
1333 1 3 . 1 1 85 85 ILE CA C 85 58.365 58.365 58.279 0.086 19946
1334 1 3 . 1 1 85 85 ILE CB C 85 39.707 39.707 39.937 -0.230 19946
1335 1 3 . 1 1 85 85 ILE H H 85 7.850 7.850 8.191 -0.341 19946
1336 1 3 . 1 1 86 86 PHE N N 86 122.937 122.937 120.381 2.556 19946
1337 1 3 . 1 1 86 86 PHE HA H 86 5.388 5.388 4.827 0.561 19946
1338 1 3 . 1 1 86 86 PHE CA C 86 54.509 54.509 55.730 -1.221 19946
1339 1 3 . 1 1 86 86 PHE CB C 86 42.878 42.878 42.135 0.743 19946
1340 1 3 . 1 1 86 86 PHE H H 86 9.004 9.004 7.912 1.092 19946
1341 1 3 . 1 1 87 87 LEU N N 87 120.712 120.712 118.125 2.587 19946
1342 1 3 . 1 1 87 87 LEU HA H 87 5.295 5.295 4.849 0.446 19946
1343 1 3 . 1 1 87 87 LEU CA C 87 51.810 51.810 54.016 -2.206 19946
1344 1 3 . 1 1 87 87 LEU CB C 87 42.059 42.059 44.398 -2.340 19946
1345 1 3 . 1 1 87 87 LEU H H 87 8.785 8.785 9.019 -0.234 19946
1346 1 3 . 1 1 88 88 LEU N N 88 124.779 124.779 122.592 2.187 19946
1347 1 3 . 1 1 88 88 LEU HA H 88 4.434 4.434 4.960 -0.526 19946
1348 1 3 . 1 1 88 88 LEU CA C 88 54.331 54.331 53.849 0.482 19946
1349 1 3 . 1 1 88 88 LEU CB C 88 42.648 42.648 43.329 -0.681 19946
1350 1 3 . 1 1 88 88 LEU H H 88 8.243 8.243 8.180 0.063 19946
1351 1 3 . 1 1 89 89 GLU N N 89 112.478 112.478 124.178 -11.700 19946
1352 1 3 . 1 1 89 89 GLU HA H 89 3.881 3.881 4.158 -0.277 19946
1353 1 3 . 1 1 89 89 GLU H H 89 9.343 9.343 8.437 0.906 19946
1354 1 3 . 1 1 90 90 ASP N N 90 120.709 120.709 120.059 0.650 19946
1355 1 3 . 1 1 90 90 ASP HA H 90 4.168 4.168 4.500 -0.332 19946
1356 1 3 . 1 1 90 90 ASP H H 90 9.062 9.062 8.044 1.018 19946
1357 1 3 . 1 1 91 91 GLY N N 91 105.049 105.049 109.847 -4.798 19946
1358 1 3 . 1 1 91 91 GLY CA C 91 46.263 46.263 46.572 -0.309 19946
1359 1 3 . 1 1 91 91 GLY H H 91 7.848 7.848 8.372 -0.524 19946
1360 1 3 . 1 1 92 92 ILE N N 92 122.127 122.127 120.435 1.692 19946
1361 1 3 . 1 1 92 92 ILE HA H 92 3.811 3.811 3.972 -0.161 19946
1362 1 3 . 1 1 92 92 ILE CA C 92 62.656 62.656 64.104 -1.448 19946
1363 1 3 . 1 1 92 92 ILE CB C 92 37.243 37.243 38.183 -0.940 19946
1364 1 3 . 1 1 92 92 ILE H H 92 8.077 8.077 8.786 -0.709 19946
1365 1 3 . 1 1 93 93 ASP N N 93 127.038 127.038 118.367 8.671 19946
1366 1 3 . 1 1 93 93 ASP HA H 93 4.452 4.452 4.545 -0.093 19946
1367 1 3 . 1 1 93 93 ASP CA C 93 57.357 57.357 57.822 -0.465 19946
1368 1 3 . 1 1 93 93 ASP CB C 93 38.194 38.194 40.512 -2.318 19946
1369 1 3 . 1 1 93 93 ASP H H 93 9.094 9.094 8.612 0.482 19946
1370 1 3 . 1 1 94 94 GLY N N 94 111.411 111.411 107.584 3.827 19946
1371 1 3 . 1 1 94 94 GLY CA C 94 44.750 44.750 46.022 -1.272 19946
1372 1 3 . 1 1 94 94 GLY H H 94 8.047 8.047 7.921 0.126 19946
1373 1 3 . 1 1 95 95 TRP N N 95 127.574 127.574 122.622 4.952 19946
1374 1 3 . 1 1 95 95 TRP HA H 95 3.738 3.738 4.472 -0.734 19946
1375 1 3 . 1 1 95 95 TRP CA C 95 60.852 60.852 58.345 2.507 19946
1376 1 3 . 1 1 95 95 TRP CB C 95 28.613 28.613 30.387 -1.774 19946
1377 1 3 . 1 1 95 95 TRP H H 95 7.918 7.918 8.415 -0.497 19946
1378 1 3 . 1 1 96 96 LYS N N 96 117.374 117.374 119.250 -1.876 19946
1379 1 3 . 1 1 96 96 LYS HA H 96 4.079 4.079 4.163 -0.084 19946
1380 1 3 . 1 1 96 96 LYS CA C 96 59.091 59.091 57.793 1.298 19946
1381 1 3 . 1 1 96 96 LYS H H 96 8.625 8.625 7.909 0.716 19946
1382 1 3 . 1 1 97 97 LYS N N 97 123.490 123.490 118.509 4.981 19946
1383 1 3 . 1 1 97 97 LYS HA H 97 4.021 4.021 4.160 -0.139 19946
1384 1 3 . 1 1 97 97 LYS CB C 97 31.542 31.542 32.058 -0.516 19946
1385 1 3 . 1 1 97 97 LYS H H 97 8.233 8.233 8.411 -0.178 19946
1386 1 3 . 1 1 98 98 ALA N N 98 120.321 120.321 120.140 0.181 19946
1387 1 3 . 1 1 98 98 ALA HA H 98 4.248 4.248 4.554 -0.306 19946
1388 1 3 . 1 1 98 98 ALA CA C 98 51.305 51.305 51.226 0.079 19946
1389 1 3 . 1 1 98 98 ALA CB C 98 17.744 17.744 18.811 -1.067 19946
1390 1 3 . 1 1 98 98 ALA H H 98 7.480 7.480 7.229 0.251 19946
1391 1 3 . 1 1 99 99 GLY N N 99 106.984 106.984 108.526 -1.542 19946
1392 1 3 . 1 1 99 99 GLY CA C 99 44.246 44.246 45.718 -1.472 19946
1393 1 3 . 1 1 99 99 GLY H H 99 7.867 7.867 7.569 0.298 19946
1394 1 3 . 1 1 100 100 LEU N N 100 122.993 122.993 119.845 3.148 19946
1395 1 3 . 1 1 100 100 LEU HA H 100 4.277 4.277 4.329 -0.052 19946
1396 1 3 . 1 1 100 100 LEU CA C 100 52.314 52.314 50.893 1.421 19946
1397 1 3 . 1 1 100 100 LEU CB C 100 36.786 36.786 42.434 -5.648 19946
1398 1 3 . 1 1 100 100 LEU H H 100 6.958 6.958 7.153 -0.195 19946
1399 1 3 . 1 1 101 101 PRO HA H 101 4.492 4.492 4.558 -0.066 19946
1400 1 3 . 1 1 101 101 PRO CB C 101 32.097 32.097 32.034 0.063 19946
1401 1 3 . 1 1 102 102 VAL N N 102 111.514 111.514 116.904 -5.390 19946
1402 1 3 . 1 1 102 102 VAL HA H 102 4.367 4.367 4.444 -0.076 19946
1403 1 3 . 1 1 102 102 VAL CA C 102 58.869 58.869 59.881 -1.012 19946
1404 1 3 . 1 1 102 102 VAL CB C 102 35.351 35.351 32.206 3.145 19946
1405 1 3 . 1 1 102 102 VAL H H 102 7.988 7.988 8.463 -0.475 19946
1406 1 3 . 1 1 103 103 ALA N N 103 126.676 126.676 123.655 3.021 19946
1407 1 3 . 1 1 103 103 ALA HA H 103 4.524 4.524 4.292 0.232 19946
1408 1 3 . 1 1 103 103 ALA CA C 103 49.793 49.793 51.903 -2.110 19946
1409 1 3 . 1 1 103 103 ALA CB C 103 18.600 18.600 17.708 0.892 19946
1410 1 3 . 1 1 103 103 ALA H H 103 8.919 8.919 8.311 0.608 19946
1411 1 3 . 1 1 104 104 VAL N N 104 121.148 121.148 124.505 -3.357 19946
1412 1 3 . 1 1 104 104 VAL HA H 104 4.475 4.475 4.076 0.399 19946
1413 1 3 . 1 1 104 104 VAL CA C 104 59.374 59.374 60.675 -1.301 19946
1414 1 3 . 1 1 104 104 VAL CB C 104 33.884 33.884 32.993 0.891 19946
1415 1 3 . 1 1 104 104 VAL H H 104 8.241 8.241 7.821 0.420 19946
1416 1 3 . 1 1 105 105 ASN N N 105 123.816 123.816 118.773 5.043 19946
1417 1 3 . 1 1 105 105 ASN HA H 105 4.674 4.674 4.483 0.191 19946
1418 1 3 . 1 1 105 105 ASN CA C 105 53.200 53.200 55.775 -2.575 19946
1419 1 3 . 1 1 105 105 ASN CB C 105 37.959 37.959 38.522 -0.563 19946
1420 1 3 . 1 1 105 105 ASN H H 105 8.150 8.150 8.515 -0.365 19946
1421 1 3 . 1 1 106 106 LYS N N 106 123.804 123.804 115.878 7.926 19946
1422 1 3 . 1 1 106 106 LYS H H 106 8.340 8.340 7.817 0.523 19946
1423 1 4 . 1 1 2 2 LEU N N 2 120.763 120.763 119.503 1.260 19946
1424 1 4 . 1 1 2 2 LEU HA H 2 4.384 4.384 4.476 -0.092 19946
1425 1 4 . 1 1 2 2 LEU CA C 2 53.827 53.827 54.390 -0.563 19946
1426 1 4 . 1 1 2 2 LEU CB C 2 42.229 42.229 39.635 2.594 19946
1427 1 4 . 1 1 2 2 LEU H H 2 7.888 7.888 8.254 -0.366 19946
1428 1 4 . 1 1 3 3 THR N N 3 118.330 118.330 118.171 0.159 19946
1429 1 4 . 1 1 3 3 THR HA H 3 4.469 4.469 4.576 -0.107 19946
1430 1 4 . 1 1 3 3 THR CA C 3 61.391 61.391 60.687 0.704 19946
1431 1 4 . 1 1 3 3 THR CB C 3 69.496 69.496 70.307 -0.811 19946
1432 1 4 . 1 1 3 3 THR H H 3 7.905 7.905 7.479 0.426 19946
1433 1 4 . 1 1 4 4 THR N N 4 122.024 122.024 116.968 5.056 19946
1434 1 4 . 1 1 4 4 THR HA H 4 5.171 5.171 4.526 0.645 19946
1435 1 4 . 1 1 4 4 THR CA C 4 61.595 61.595 62.076 -0.481 19946
1436 1 4 . 1 1 4 4 THR CB C 4 69.027 69.027 70.531 -1.504 19946
1437 1 4 . 1 1 4 4 THR H H 4 8.504 8.504 8.457 0.047 19946
1438 1 4 . 1 1 5 5 ILE N N 5 122.667 122.667 121.708 0.959 19946
1439 1 4 . 1 1 5 5 ILE HA H 5 4.973 4.973 4.639 0.334 19946
1440 1 4 . 1 1 5 5 ILE CA C 5 57.971 57.971 58.760 -0.789 19946
1441 1 4 . 1 1 5 5 ILE CB C 5 41.458 41.458 41.007 0.451 19946
1442 1 4 . 1 1 5 5 ILE H H 5 8.903 8.903 8.112 0.791 19946
1443 1 4 . 1 1 6 6 SER N N 6 123.156 123.156 115.981 7.175 19946
1444 1 4 . 1 1 6 6 SER HA H 6 4.785 4.785 5.108 -0.323 19946
1445 1 4 . 1 1 6 6 SER H H 6 9.138 9.138 8.306 0.832 19946
1446 1 4 . 1 1 7 7 PRO HA H 7 4.004 4.004 4.432 -0.428 19946
1447 1 4 . 1 1 7 7 PRO CA C 7 65.510 65.510 64.897 0.613 19946
1448 1 4 . 1 1 7 7 PRO CB C 7 30.924 30.924 31.874 -0.950 19946
1449 1 4 . 1 1 8 8 HIS N N 8 114.319 114.319 115.424 -1.105 19946
1450 1 4 . 1 1 8 8 HIS HA H 8 3.989 3.989 4.428 -0.439 19946
1451 1 4 . 1 1 8 8 HIS CA C 8 60.050 60.050 59.525 0.525 19946
1452 1 4 . 1 1 8 8 HIS CB C 8 28.613 28.613 29.590 -0.977 19946
1453 1 4 . 1 1 8 8 HIS H H 8 8.127 8.127 8.420 -0.293 19946
1454 1 4 . 1 1 9 9 ASP N N 9 121.300 121.300 117.458 3.842 19946
1455 1 4 . 1 1 9 9 ASP HA H 9 4.301 4.301 4.743 -0.442 19946
1456 1 4 . 1 1 9 9 ASP CA C 9 56.455 56.455 55.171 1.284 19946
1457 1 4 . 1 1 9 9 ASP CB C 9 38.699 38.699 41.625 -2.926 19946
1458 1 4 . 1 1 9 9 ASP H H 9 7.639 7.639 7.739 -0.100 19946
1459 1 4 . 1 1 10 10 ALA N N 10 123.991 123.991 122.807 1.184 19946
1460 1 4 . 1 1 10 10 ALA HA H 10 3.719 3.719 4.140 -0.421 19946
1461 1 4 . 1 1 10 10 ALA CA C 10 54.331 54.331 54.786 -0.455 19946
1462 1 4 . 1 1 10 10 ALA CB C 10 17.549 17.549 18.480 -0.931 19946
1463 1 4 . 1 1 10 10 ALA H H 10 8.820 8.820 7.659 1.161 19946
1464 1 4 . 1 1 11 11 GLN N N 11 118.128 118.128 115.893 2.235 19946
1465 1 4 . 1 1 11 11 GLN HA H 11 3.933 3.933 4.164 -0.231 19946
1466 1 4 . 1 1 11 11 GLN CA C 11 59.389 59.389 57.547 1.842 19946
1467 1 4 . 1 1 11 11 GLN CB C 11 27.948 27.948 28.442 -0.494 19946
1468 1 4 . 1 1 11 11 GLN H H 11 8.353 8.353 8.105 0.248 19946
1469 1 4 . 1 1 12 12 GLU N N 12 119.307 119.307 120.368 -1.061 19946
1470 1 4 . 1 1 12 12 GLU HA H 12 4.023 4.023 4.263 -0.240 19946
1471 1 4 . 1 1 12 12 GLU CA C 12 58.476 58.476 58.545 -0.070 19946
1472 1 4 . 1 1 12 12 GLU CB C 12 28.532 28.532 30.286 -1.754 19946
1473 1 4 . 1 1 12 12 GLU H H 12 7.197 7.197 7.738 -0.541 19946
1474 1 4 . 1 1 13 13 LEU N N 13 120.635 120.635 118.491 2.144 19946
1475 1 4 . 1 1 13 13 LEU HA H 13 3.821 3.821 4.070 -0.249 19946
1476 1 4 . 1 1 13 13 LEU CA C 13 57.065 57.065 58.144 -1.079 19946
1477 1 4 . 1 1 13 13 LEU CB C 13 40.890 40.890 41.449 -0.559 19946
1478 1 4 . 1 1 13 13 LEU H H 13 7.554 7.554 7.440 0.114 19946
1479 1 4 . 1 1 14 14 ILE N N 14 123.021 123.021 119.685 3.336 19946
1480 1 4 . 1 1 14 14 ILE HA H 14 3.827 3.827 3.855 -0.028 19946
1481 1 4 . 1 1 14 14 ILE CA C 14 64.053 64.053 64.828 -0.775 19946
1482 1 4 . 1 1 14 14 ILE CB C 14 38.115 38.115 37.729 0.386 19946
1483 1 4 . 1 1 14 14 ILE H H 14 8.710 8.710 7.904 0.806 19946
1484 1 4 . 1 1 15 15 ALA N N 15 124.504 124.504 119.591 4.913 19946
1485 1 4 . 1 1 15 15 ALA HA H 15 4.115 4.115 4.150 -0.035 19946
1486 1 4 . 1 1 15 15 ALA CA C 15 54.257 54.257 53.860 0.397 19946
1487 1 4 . 1 1 15 15 ALA CB C 15 17.040 17.040 18.319 -1.279 19946
1488 1 4 . 1 1 15 15 ALA H H 15 7.758 7.758 7.957 -0.199 19946
1489 1 4 . 1 1 16 16 ARG N N 16 115.990 115.990 116.827 -0.837 19946
1490 1 4 . 1 1 16 16 ARG HA H 16 4.348 4.348 4.343 0.005 19946
1491 1 4 . 1 1 16 16 ARG CA C 16 55.416 55.416 56.864 -1.448 19946
1492 1 4 . 1 1 16 16 ARG CB C 16 29.762 29.762 31.124 -1.362 19946
1493 1 4 . 1 1 16 16 ARG H H 16 7.252 7.252 7.898 -0.646 19946
1494 1 4 . 1 1 17 17 GLY N N 17 107.981 107.981 105.279 2.702 19946
1495 1 4 . 1 1 17 17 GLY CA C 17 44.854 44.854 44.906 -0.052 19946
1496 1 4 . 1 1 17 17 GLY H H 17 7.748 7.748 7.475 0.273 19946
1497 1 4 . 1 1 18 18 ALA N N 18 123.914 123.914 125.454 -1.540 19946
1498 1 4 . 1 1 18 18 ALA HA H 18 4.221 4.221 4.264 -0.043 19946
1499 1 4 . 1 1 18 18 ALA CA C 18 52.270 52.270 53.022 -0.752 19946
1500 1 4 . 1 1 18 18 ALA CB C 18 18.638 18.638 19.254 -0.616 19946
1501 1 4 . 1 1 18 18 ALA H H 18 7.940 7.940 7.870 0.070 19946
1502 1 4 . 1 1 19 19 LYS N N 19 119.436 119.436 123.374 -3.938 19946
1503 1 4 . 1 1 19 19 LYS HA H 19 4.301 4.301 4.175 0.126 19946
1504 1 4 . 1 1 19 19 LYS CA C 19 53.105 53.105 56.140 -3.035 19946
1505 1 4 . 1 1 19 19 LYS CB C 19 32.856 32.856 34.538 -1.682 19946
1506 1 4 . 1 1 19 19 LYS H H 19 7.565 7.565 8.393 -0.828 19946
1507 1 4 . 1 1 20 20 LEU N N 20 127.401 127.401 120.604 6.797 19946
1508 1 4 . 1 1 20 20 LEU HA H 20 5.042 5.042 5.388 -0.346 19946
1509 1 4 . 1 1 20 20 LEU CA C 20 52.314 52.314 53.234 -0.920 19946
1510 1 4 . 1 1 20 20 LEU CB C 20 43.234 43.234 45.307 -2.073 19946
1511 1 4 . 1 1 20 20 LEU H H 20 8.727 8.727 8.260 0.467 19946
1512 1 4 . 1 1 21 21 ILE N N 21 128.186 128.186 122.427 5.759 19946
1513 1 4 . 1 1 21 21 ILE HA H 21 4.547 4.547 4.345 0.202 19946
1514 1 4 . 1 1 21 21 ILE CA C 21 59.589 59.589 60.356 -0.767 19946
1515 1 4 . 1 1 21 21 ILE CB C 21 38.545 38.545 43.323 -4.778 19946
1516 1 4 . 1 1 21 21 ILE H H 21 9.366 9.366 8.113 1.253 19946
1517 1 4 . 1 1 22 22 ASP N N 22 129.968 129.968 123.471 6.497 19946
1518 1 4 . 1 1 22 22 ASP HA H 22 3.803 3.803 5.016 -1.213 19946
1519 1 4 . 1 1 22 22 ASP CA C 22 51.435 51.435 53.372 -1.937 19946
1520 1 4 . 1 1 22 22 ASP CB C 22 42.062 42.062 43.660 -1.599 19946
1521 1 4 . 1 1 22 22 ASP H H 22 8.583 8.583 8.020 0.563 19946
1522 1 4 . 1 1 23 23 ILE N N 23 116.266 116.266 119.613 -3.347 19946
1523 1 4 . 1 1 23 23 ILE HA H 23 5.229 5.229 4.594 0.635 19946
1524 1 4 . 1 1 23 23 ILE CA C 23 59.374 59.374 59.552 -0.178 19946
1525 1 4 . 1 1 23 23 ILE CB C 23 37.327 37.327 36.446 0.881 19946
1526 1 4 . 1 1 23 23 ILE H H 23 7.836 7.836 7.761 0.075 19946
1527 1 4 . 1 1 24 24 ARG N N 24 125.001 125.001 120.023 4.978 19946
1528 1 4 . 1 1 24 24 ARG HA H 24 4.116 4.116 4.547 -0.431 19946
1529 1 4 . 1 1 24 24 ARG CA C 24 55.943 55.943 53.844 2.099 19946
1530 1 4 . 1 1 24 24 ARG CB C 24 30.135 30.135 32.323 -2.188 19946
1531 1 4 . 1 1 24 24 ARG H H 24 8.195 8.195 7.191 1.004 19946
1532 1 4 . 1 1 25 25 ASP N N 25 112.839 112.839 120.317 -7.478 19946
1533 1 4 . 1 1 25 25 ASP HA H 25 4.545 4.545 4.588 -0.043 19946
1534 1 4 . 1 1 25 25 ASP CA C 25 53.870 53.870 54.479 -0.609 19946
1535 1 4 . 1 1 25 25 ASP CB C 25 41.327 41.327 41.295 0.032 19946
1536 1 4 . 1 1 25 25 ASP H H 25 7.660 7.660 8.197 -0.537 19946
1537 1 4 . 1 1 26 26 ALA N N 26 122.145 122.145 120.361 1.784 19946
1538 1 4 . 1 1 26 26 ALA HA H 26 3.897 3.897 4.455 -0.558 19946
1539 1 4 . 1 1 26 26 ALA CA C 26 54.958 54.958 54.017 0.941 19946
1540 1 4 . 1 1 26 26 ALA CB C 26 17.520 17.520 20.067 -2.547 19946
1541 1 4 . 1 1 26 26 ALA H H 26 8.766 8.766 8.264 0.502 19946
1542 1 4 . 1 1 27 27 ASP N N 27 115.380 115.380 119.231 -3.851 19946
1543 1 4 . 1 1 27 27 ASP HA H 27 4.299 4.299 4.282 0.017 19946
1544 1 4 . 1 1 27 27 ASP CA C 27 56.451 56.451 57.324 -0.873 19946
1545 1 4 . 1 1 27 27 ASP CB C 27 39.156 39.156 39.936 -0.780 19946
1546 1 4 . 1 1 27 27 ASP H H 27 8.686 8.686 8.704 -0.018 19946
1547 1 4 . 1 1 28 28 GLU N N 28 120.081 120.081 116.616 3.465 19946
1548 1 4 . 1 1 28 28 GLU HA H 28 4.086 4.086 4.031 0.055 19946
1549 1 4 . 1 1 28 28 GLU CA C 28 58.389 58.389 58.724 -0.334 19946
1550 1 4 . 1 1 28 28 GLU CB C 28 28.728 28.728 28.922 -0.194 19946
1551 1 4 . 1 1 28 28 GLU H H 28 7.397 7.397 8.897 -1.500 19946
1552 1 4 . 1 1 29 29 TYR N N 29 121.205 121.205 121.656 -0.451 19946
1553 1 4 . 1 1 29 29 TYR HA H 29 4.083 4.083 4.676 -0.593 19946
1554 1 4 . 1 1 29 29 TYR CA C 29 60.378 60.378 59.121 1.257 19946
1555 1 4 . 1 1 29 29 TYR CB C 29 38.699 38.699 38.733 -0.034 19946
1556 1 4 . 1 1 29 29 TYR H H 29 7.506 7.506 7.911 -0.405 19946
1557 1 4 . 1 1 30 30 LEU N N 30 118.828 118.828 120.137 -1.309 19946
1558 1 4 . 1 1 30 30 LEU HA H 30 3.850 3.850 3.658 0.192 19946
1559 1 4 . 1 1 30 30 LEU CA C 30 56.348 56.348 57.429 -1.081 19946
1560 1 4 . 1 1 30 30 LEU CB C 30 41.220 41.220 41.587 -0.367 19946
1561 1 4 . 1 1 30 30 LEU H H 30 8.211 8.211 8.304 -0.093 19946
1562 1 4 . 1 1 31 31 ARG N N 31 118.220 118.220 117.701 0.519 19946
1563 1 4 . 1 1 31 31 ARG HA H 31 4.101 4.101 4.207 -0.106 19946
1564 1 4 . 1 1 31 31 ARG CA C 31 58.365 58.365 57.771 0.594 19946
1565 1 4 . 1 1 31 31 ARG CB C 31 30.074 30.074 31.333 -1.259 19946
1566 1 4 . 1 1 31 31 ARG H H 31 7.120 7.120 7.753 -0.633 19946
1567 1 4 . 1 1 32 32 GLU N N 32 117.980 117.980 117.146 0.834 19946
1568 1 4 . 1 1 32 32 GLU HA H 32 4.884 4.884 4.375 0.509 19946
1569 1 4 . 1 1 32 32 GLU CA C 32 55.339 55.339 56.656 -1.317 19946
1570 1 4 . 1 1 32 32 GLU CB C 32 31.698 31.698 30.902 0.796 19946
1571 1 4 . 1 1 32 32 GLU H H 32 7.506 7.506 7.792 -0.286 19946
1572 1 4 . 1 1 33 33 HIS N N 33 118.257 118.257 117.729 0.528 19946
1573 1 4 . 1 1 33 33 HIS HA H 33 4.643 4.643 5.024 -0.381 19946
1574 1 4 . 1 1 33 33 HIS CA C 33 53.766 53.766 54.260 -0.494 19946
1575 1 4 . 1 1 33 33 HIS CB C 33 29.940 29.940 32.959 -3.019 19946
1576 1 4 . 1 1 33 33 HIS H H 33 8.269 8.269 8.500 -0.231 19946
1577 1 4 . 1 1 34 34 ILE N N 34 127.809 127.809 118.021 9.788 19946
1578 1 4 . 1 1 34 34 ILE HA H 34 3.920 3.920 4.432 -0.512 19946
1579 1 4 . 1 1 34 34 ILE CA C 34 59.648 59.648 58.214 1.434 19946
1580 1 4 . 1 1 34 34 ILE CB C 34 37.959 37.959 42.286 -4.327 19946
1581 1 4 . 1 1 34 34 ILE H H 34 9.989 9.989 8.094 1.895 19946
1582 1 4 . 1 1 35 35 PRO HA H 35 4.198 4.198 4.292 -0.094 19946
1583 1 4 . 1 1 36 36 GLU N N 36 114.414 114.414 122.825 -8.411 19946
1584 1 4 . 1 1 36 36 GLU HA H 36 4.082 4.082 3.728 0.354 19946
1585 1 4 . 1 1 36 36 GLU CA C 36 57.861 57.861 57.249 0.612 19946
1586 1 4 . 1 1 36 36 GLU CB C 36 28.109 28.109 29.116 -1.007 19946
1587 1 4 . 1 1 36 36 GLU H H 36 8.557 8.557 8.103 0.454 19946
1588 1 4 . 1 1 37 37 ALA N N 37 122.882 122.882 125.402 -2.520 19946
1589 1 4 . 1 1 37 37 ALA HA H 37 4.439 4.439 4.600 -0.161 19946
1590 1 4 . 1 1 37 37 ALA CA C 37 52.005 52.005 51.608 0.397 19946
1591 1 4 . 1 1 37 37 ALA CB C 37 20.438 20.438 20.884 -0.447 19946
1592 1 4 . 1 1 37 37 ALA H H 37 8.096 8.096 8.024 0.072 19946
1593 1 4 . 1 1 38 38 ASP N N 38 124.471 124.471 117.879 6.592 19946
1594 1 4 . 1 1 38 38 ASP HA H 38 4.844 4.844 4.789 0.055 19946
1595 1 4 . 1 1 38 38 ASP CA C 38 52.614 52.614 54.005 -1.391 19946
1596 1 4 . 1 1 38 38 ASP CB C 38 44.407 44.407 43.570 0.837 19946
1597 1 4 . 1 1 38 38 ASP H H 38 9.004 9.004 8.348 0.656 19946
1598 1 4 . 1 1 39 39 LEU N N 39 123.936 123.936 121.537 2.399 19946
1599 1 4 . 1 1 39 39 LEU HA H 39 4.328 4.328 4.004 0.324 19946
1600 1 4 . 1 1 39 39 LEU CA C 39 54.037 54.037 55.857 -1.820 19946
1601 1 4 . 1 1 39 39 LEU CB C 39 41.220 41.220 41.919 -0.699 19946
1602 1 4 . 1 1 39 39 LEU H H 39 8.125 8.125 8.174 -0.049 19946
1603 1 4 . 1 1 40 40 ALA N N 40 131.297 131.297 126.103 5.194 19946
1604 1 4 . 1 1 40 40 ALA HA H 40 4.408 4.408 4.439 -0.031 19946
1605 1 4 . 1 1 40 40 ALA CA C 40 48.784 48.784 50.894 -2.110 19946
1606 1 4 . 1 1 40 40 ALA CB C 40 17.979 17.979 19.094 -1.115 19946
1607 1 4 . 1 1 40 40 ALA H H 40 8.654 8.654 8.596 0.058 19946
1608 1 4 . 1 1 41 41 PRO HA H 41 4.101 4.101 4.595 -0.494 19946
1609 1 4 . 1 1 41 41 PRO CA C 41 61.391 61.391 62.117 -0.726 19946
1610 1 4 . 1 1 41 41 PRO CB C 41 32.097 32.097 32.536 -0.439 19946
1611 1 4 . 1 1 42 42 LEU N N 42 125.312 125.312 119.691 5.621 19946
1612 1 4 . 1 1 42 42 LEU HA H 42 3.871 3.871 3.811 0.060 19946
1613 1 4 . 1 1 42 42 LEU CA C 42 57.861 57.861 58.446 -0.585 19946
1614 1 4 . 1 1 42 42 LEU CB C 42 40.941 40.941 41.085 -0.144 19946
1615 1 4 . 1 1 42 42 LEU H H 42 8.285 8.285 8.457 -0.172 19946
1616 1 4 . 1 1 43 43 SER N N 43 110.669 110.669 114.927 -4.258 19946
1617 1 4 . 1 1 43 43 SER HA H 43 4.106 4.106 4.022 0.084 19946
1618 1 4 . 1 1 43 43 SER CA C 43 60.497 60.497 62.432 -1.935 19946
1619 1 4 . 1 1 43 43 SER CB C 43 61.391 61.391 62.711 -1.320 19946
1620 1 4 . 1 1 43 43 SER H H 43 8.453 8.453 8.209 0.244 19946
1621 1 4 . 1 1 44 44 VAL N N 44 123.933 123.933 122.519 1.414 19946
1622 1 4 . 1 1 44 44 VAL HA H 44 3.821 3.821 3.716 0.105 19946
1623 1 4 . 1 1 44 44 VAL CA C 44 64.752 64.752 66.642 -1.890 19946
1624 1 4 . 1 1 44 44 VAL CB C 44 31.135 31.135 31.816 -0.681 19946
1625 1 4 . 1 1 44 44 VAL H H 44 7.156 7.156 7.819 -0.663 19946
1626 1 4 . 1 1 45 45 LEU N N 45 121.150 121.150 119.865 1.285 19946
1627 1 4 . 1 1 45 45 LEU HA H 45 3.767 3.767 3.943 -0.176 19946
1628 1 4 . 1 1 45 45 LEU CA C 45 56.599 56.599 57.884 -1.285 19946
1629 1 4 . 1 1 45 45 LEU CB C 45 40.890 40.890 41.393 -0.503 19946
1630 1 4 . 1 1 45 45 LEU H H 45 7.997 7.997 8.954 -0.957 19946
1631 1 4 . 1 1 46 46 GLU N N 46 116.256 116.256 118.283 -2.027 19946
1632 1 4 . 1 1 46 46 GLU HA H 46 3.678 3.678 4.260 -0.582 19946
1633 1 4 . 1 1 46 46 GLU CA C 46 58.365 58.365 58.083 0.282 19946
1634 1 4 . 1 1 46 46 GLU CB C 46 29.622 29.622 30.177 -0.555 19946
1635 1 4 . 1 1 46 46 GLU H H 46 8.501 8.501 8.138 0.363 19946
1636 1 4 . 1 1 47 47 GLN N N 47 117.261 117.261 118.190 -0.929 19946
1637 1 4 . 1 1 47 47 GLN HA H 47 4.216 4.216 4.179 0.037 19946
1638 1 4 . 1 1 47 47 GLN CA C 47 56.852 56.852 58.060 -1.208 19946
1639 1 4 . 1 1 47 47 GLN CB C 47 29.119 29.119 29.430 -0.311 19946
1640 1 4 . 1 1 47 47 GLN H H 47 7.407 7.407 8.468 -1.061 19946
1641 1 4 . 1 1 48 48 SER N N 48 111.890 111.890 112.910 -1.020 19946
1642 1 4 . 1 1 48 48 SER HA H 48 4.641 4.641 4.453 0.188 19946
1643 1 4 . 1 1 48 48 SER CA C 48 57.956 57.956 58.669 -0.713 19946
1644 1 4 . 1 1 48 48 SER CB C 48 63.912 63.912 64.809 -0.897 19946
1645 1 4 . 1 1 48 48 SER H H 48 8.566 8.566 8.347 0.219 19946
1646 1 4 . 1 1 49 49 GLY N N 49 111.545 111.545 109.282 2.263 19946
1647 1 4 . 1 1 49 49 GLY CA C 49 43.894 43.894 44.370 -0.476 19946
1648 1 4 . 1 1 49 49 GLY H H 49 7.836 7.836 7.857 -0.021 19946
1649 1 4 . 1 1 50 50 LEU N N 50 121.541 121.541 124.458 -2.917 19946
1650 1 4 . 1 1 50 50 LEU HA H 50 4.239 4.239 4.399 -0.160 19946
1651 1 4 . 1 1 50 50 LEU CA C 50 51.985 51.985 53.990 -2.005 19946
1652 1 4 . 1 1 50 50 LEU CB C 50 42.648 42.648 40.857 1.791 19946
1653 1 4 . 1 1 50 50 LEU H H 50 8.564 8.564 8.586 -0.022 19946
1654 1 4 . 1 1 51 51 PRO HA H 51 4.243 4.243 4.520 -0.277 19946
1655 1 4 . 1 1 51 51 PRO CB C 51 31.639 31.639 32.419 -0.780 19946
1656 1 4 . 1 1 52 52 ALA N N 52 127.008 127.008 121.918 5.090 19946
1657 1 4 . 1 1 52 52 ALA HA H 52 3.790 3.790 4.475 -0.685 19946
1658 1 4 . 1 1 52 52 ALA CA C 52 54.835 54.835 52.947 1.888 19946
1659 1 4 . 1 1 52 52 ALA CB C 52 17.715 17.715 18.893 -1.178 19946
1660 1 4 . 1 1 52 52 ALA H H 52 8.564 8.564 8.660 -0.096 19946
1661 1 4 . 1 1 53 53 LYS N N 53 114.535 114.535 117.237 -2.702 19946
1662 1 4 . 1 1 53 53 LYS HA H 53 4.106 4.106 4.268 -0.162 19946
1663 1 4 . 1 1 53 53 LYS CA C 53 56.852 56.852 57.994 -1.142 19946
1664 1 4 . 1 1 53 53 LYS CB C 53 31.386 31.386 32.440 -1.054 19946
1665 1 4 . 1 1 53 53 LYS H H 53 8.364 8.364 8.058 0.306 19946
1666 1 4 . 1 1 54 54 LEU N N 54 118.515 118.515 117.962 0.553 19946
1667 1 4 . 1 1 54 54 LEU HA H 54 4.247 4.247 4.531 -0.284 19946
1668 1 4 . 1 1 54 54 LEU CA C 54 53.338 53.338 53.627 -0.289 19946
1669 1 4 . 1 1 54 54 LEU CB C 54 40.890 40.890 41.702 -0.812 19946
1670 1 4 . 1 1 54 54 LEU H H 54 7.745 7.745 7.533 0.212 19946
1671 1 4 . 1 1 55 55 ARG N N 55 117.612 117.612 120.558 -2.946 19946
1672 1 4 . 1 1 55 55 ARG HA H 55 3.927 3.927 4.449 -0.522 19946
1673 1 4 . 1 1 55 55 ARG CA C 55 56.832 56.832 56.102 0.730 19946
1674 1 4 . 1 1 55 55 ARG CB C 55 28.610 28.610 31.884 -3.274 19946
1675 1 4 . 1 1 55 55 ARG H H 55 6.938 6.938 7.817 -0.879 19946
1676 1 4 . 1 1 56 56 HIS N N 56 123.269 123.269 121.868 1.401 19946
1677 1 4 . 1 1 56 56 HIS HA H 56 4.614 4.614 4.552 0.062 19946
1678 1 4 . 1 1 56 56 HIS CA C 56 54.835 54.835 55.793 -0.958 19946
1679 1 4 . 1 1 56 56 HIS CB C 56 32.648 32.648 31.047 1.601 19946
1680 1 4 . 1 1 56 56 HIS H H 56 7.237 7.237 8.282 -1.045 19946
1681 1 4 . 1 1 57 57 GLU N N 57 120.895 120.895 118.342 2.553 19946
1682 1 4 . 1 1 57 57 GLU HA H 57 3.976 3.976 4.337 -0.361 19946
1683 1 4 . 1 1 57 57 GLU CA C 57 58.871 58.871 57.335 1.536 19946
1684 1 4 . 1 1 57 57 GLU CB C 57 29.158 29.158 30.982 -1.824 19946
1685 1 4 . 1 1 57 57 GLU H H 57 7.625 7.625 8.284 -0.659 19946
1686 1 4 . 1 1 58 58 GLN N N 58 118.485 118.485 116.893 1.592 19946
1687 1 4 . 1 1 58 58 GLN HA H 58 5.425 5.425 5.092 0.333 19946
1688 1 4 . 1 1 58 58 GLN CA C 58 54.910 54.910 54.954 -0.044 19946
1689 1 4 . 1 1 58 58 GLN CB C 58 32.285 32.285 30.457 1.827 19946
1690 1 4 . 1 1 58 58 GLN H H 58 8.335 8.335 8.047 0.288 19946
1691 1 4 . 1 1 59 59 ILE N N 59 123.505 123.505 119.764 3.741 19946
1692 1 4 . 1 1 59 59 ILE HA H 59 4.492 4.492 5.006 -0.514 19946
1693 1 4 . 1 1 59 59 ILE CA C 59 58.869 58.869 60.349 -1.480 19946
1694 1 4 . 1 1 59 59 ILE CB C 59 42.332 42.332 39.989 2.343 19946
1695 1 4 . 1 1 59 59 ILE H H 59 8.704 8.704 8.293 0.411 19946
1696 1 4 . 1 1 60 60 ILE N N 60 126.464 126.464 124.390 2.074 19946
1697 1 4 . 1 1 60 60 ILE HA H 60 4.954 4.954 4.434 0.520 19946
1698 1 4 . 1 1 60 60 ILE CA C 60 57.357 57.357 59.350 -1.993 19946
1699 1 4 . 1 1 60 60 ILE CB C 60 39.131 39.131 40.294 -1.163 19946
1700 1 4 . 1 1 60 60 ILE H H 60 9.006 9.006 8.518 0.488 19946
1701 1 4 . 1 1 61 61 PHE N N 61 124.441 124.441 126.247 -1.806 19946
1702 1 4 . 1 1 61 61 PHE HA H 61 5.795 5.795 5.078 0.717 19946
1703 1 4 . 1 1 61 61 PHE CA C 61 56.131 56.131 55.694 0.437 19946
1704 1 4 . 1 1 61 61 PHE CB C 61 42.879 42.879 40.931 1.948 19946
1705 1 4 . 1 1 61 61 PHE H H 61 8.938 8.938 7.379 1.559 19946
1706 1 4 . 1 1 62 62 HIS N N 62 117.494 117.494 116.253 1.241 19946
1707 1 4 . 1 1 62 62 HIS HA H 62 5.928 5.928 5.061 0.867 19946
1708 1 4 . 1 1 62 62 HIS CA C 62 53.322 53.322 55.053 -1.731 19946
1709 1 4 . 1 1 62 62 HIS CB C 62 35.673 35.673 34.496 1.177 19946
1710 1 4 . 1 1 62 62 HIS H H 62 9.230 9.230 8.356 0.874 19946
1711 1 4 . 1 1 63 63 CYS N N 63 120.220 120.220 119.922 0.298 19946
1712 1 4 . 1 1 63 63 CYS HA H 63 5.033 5.033 4.363 0.670 19946
1713 1 4 . 1 1 63 63 CYS CA C 63 56.131 56.131 62.562 -6.431 19946
1714 1 4 . 1 1 63 63 CYS CB C 63 28.109 28.109 29.092 -0.983 19946
1715 1 4 . 1 1 63 63 CYS H H 63 8.131 8.131 9.111 -0.980 19946
1716 1 4 . 1 1 65 65 ALA N N 65 119.272 119.272 121.932 -2.660 19946
1717 1 4 . 1 1 65 65 ALA HA H 65 5.063 5.063 4.319 0.744 19946
1718 1 4 . 1 1 65 65 ALA CA C 65 49.793 49.793 52.708 -2.915 19946
1719 1 4 . 1 1 65 65 ALA CB C 65 19.775 19.775 18.186 1.589 19946
1720 1 4 . 1 1 65 65 ALA H H 65 8.967 8.967 8.070 0.897 19946
1721 1 4 . 1 1 66 66 GLY N N 66 113.296 113.296 109.512 3.784 19946
1722 1 4 . 1 1 66 66 GLY CA C 66 44.934 44.934 45.463 -0.529 19946
1723 1 4 . 1 1 66 66 GLY H H 66 8.778 8.778 7.746 1.032 19946
1724 1 4 . 1 1 67 67 LYS N N 67 121.300 121.300 121.953 -0.653 19946
1725 1 4 . 1 1 67 67 LYS HA H 67 4.211 4.211 4.305 -0.094 19946
1726 1 4 . 1 1 67 67 LYS H H 67 8.111 8.111 8.383 -0.272 19946
1727 1 4 . 1 1 68 68 ARG N N 68 126.092 126.092 123.574 2.518 19946
1728 1 4 . 1 1 68 68 ARG H H 68 9.067 9.067 8.214 0.853 19946
1729 1 4 . 1 1 69 69 THR N N 69 117.153 117.153 114.626 2.527 19946
1730 1 4 . 1 1 69 69 THR HA H 69 3.576 3.576 4.546 -0.970 19946
1731 1 4 . 1 1 69 69 THR CA C 69 65.397 65.397 61.882 3.515 19946
1732 1 4 . 1 1 69 69 THR CB C 69 66.938 66.938 69.332 -2.394 19946
1733 1 4 . 1 1 69 69 THR H H 69 10.233 10.233 8.295 1.938 19946
1734 1 4 . 1 1 70 70 SER N N 70 113.686 113.686 117.081 -3.395 19946
1735 1 4 . 1 1 70 70 SER HA H 70 4.091 4.091 4.320 -0.229 19946
1736 1 4 . 1 1 70 70 SER CA C 70 61.391 61.391 60.922 0.469 19946
1737 1 4 . 1 1 70 70 SER CB C 70 65.425 65.425 63.322 2.103 19946
1738 1 4 . 1 1 70 70 SER H H 70 7.322 7.322 8.122 -0.800 19946
1739 1 4 . 1 1 71 71 ASN N N 71 118.257 118.257 116.845 1.412 19946
1740 1 4 . 1 1 71 71 ASN HA H 71 4.177 4.177 4.517 -0.340 19946
1741 1 4 . 1 1 71 71 ASN CA C 71 54.736 54.736 54.153 0.583 19946
1742 1 4 . 1 1 71 71 ASN CB C 71 38.391 38.391 37.563 0.828 19946
1743 1 4 . 1 1 71 71 ASN H H 71 7.863 7.863 8.423 -0.560 19946
1744 1 4 . 1 1 72 72 ASN N N 72 115.529 115.529 110.258 5.271 19946
1745 1 4 . 1 1 72 72 ASN HA H 72 5.127 5.127 4.372 0.755 19946
1746 1 4 . 1 1 72 72 ASN CA C 72 52.173 52.173 53.761 -1.588 19946
1747 1 4 . 1 1 72 72 ASN CB C 72 39.165 39.165 37.248 1.917 19946
1748 1 4 . 1 1 72 72 ASN H H 72 7.238 7.238 8.551 -1.313 19946
1749 1 4 . 1 1 73 73 ALA N N 73 125.388 125.388 122.247 3.141 19946
1750 1 4 . 1 1 73 73 ALA HA H 73 3.639 3.639 3.882 -0.243 19946
1751 1 4 . 1 1 73 73 ALA CA C 73 56.133 56.133 55.585 0.548 19946
1752 1 4 . 1 1 73 73 ALA CB C 73 18.528 18.528 18.854 -0.326 19946
1753 1 4 . 1 1 73 73 ALA H H 73 7.081 7.081 8.118 -1.037 19946
1754 1 4 . 1 1 74 74 ASP N N 74 115.501 115.501 118.279 -2.778 19946
1755 1 4 . 1 1 74 74 ASP HA H 74 4.135 4.135 4.298 -0.163 19946
1756 1 4 . 1 1 74 74 ASP CA C 74 55.891 55.891 57.568 -1.677 19946
1757 1 4 . 1 1 74 74 ASP CB C 74 38.699 38.699 40.543 -1.844 19946
1758 1 4 . 1 1 74 74 ASP H H 74 8.346 8.346 8.487 -0.141 19946
1759 1 4 . 1 1 75 75 LYS N N 75 122.469 122.469 119.786 2.683 19946
1760 1 4 . 1 1 75 75 LYS HA H 75 4.024 4.024 4.141 -0.117 19946
1761 1 4 . 1 1 75 75 LYS CA C 75 57.861 57.861 58.723 -0.862 19946
1762 1 4 . 1 1 75 75 LYS CB C 75 31.660 31.660 32.414 -0.754 19946
1763 1 4 . 1 1 75 75 LYS H H 75 7.583 7.583 7.820 -0.237 19946
1764 1 4 . 1 1 76 76 LEU N N 76 119.196 119.196 120.489 -1.293 19946
1765 1 4 . 1 1 76 76 LEU HA H 76 3.570 3.570 3.881 -0.311 19946
1766 1 4 . 1 1 76 76 LEU CA C 76 56.852 56.852 57.945 -1.093 19946
1767 1 4 . 1 1 76 76 LEU CB C 76 39.245 39.245 41.521 -2.276 19946
1768 1 4 . 1 1 76 76 LEU H H 76 8.069 8.069 7.847 0.222 19946
1769 1 4 . 1 1 77 77 ALA N N 77 120.302 120.302 121.958 -1.656 19946
1770 1 4 . 1 1 77 77 ALA HA H 77 3.985 3.985 3.940 0.045 19946
1771 1 4 . 1 1 77 77 ALA CA C 77 53.794 53.794 55.051 -1.257 19946
1772 1 4 . 1 1 77 77 ALA CB C 77 17.353 17.353 18.353 -1.000 19946
1773 1 4 . 1 1 77 77 ALA H H 77 8.063 8.063 8.714 -0.651 19946
1774 1 4 . 1 1 78 78 ALA N N 78 119.602 119.602 119.510 0.092 19946
1775 1 4 . 1 1 78 78 ALA HA H 78 4.138 4.138 4.110 0.028 19946
1776 1 4 . 1 1 78 78 ALA CA C 78 54.049 54.049 54.155 -0.106 19946
1777 1 4 . 1 1 78 78 ALA CB C 78 17.520 17.520 19.119 -1.599 19946
1778 1 4 . 1 1 78 78 ALA H H 78 7.274 7.274 7.320 -0.046 19946
1779 1 4 . 1 1 79 79 ILE N N 79 118.809 118.809 119.531 -0.722 19946
1780 1 4 . 1 1 79 79 ILE HA H 79 3.798 3.798 3.746 0.052 19946
1781 1 4 . 1 1 79 79 ILE CA C 79 63.354 63.354 64.180 -0.826 19946
1782 1 4 . 1 1 79 79 ILE CB C 79 38.422 38.422 38.669 -0.247 19946
1783 1 4 . 1 1 79 79 ILE H H 79 8.170 8.170 8.377 -0.207 19946
1784 1 4 . 1 1 80 80 ALA N N 80 118.736 118.736 118.328 0.408 19946
1785 1 4 . 1 1 80 80 ALA HA H 80 4.412 4.412 4.519 -0.107 19946
1786 1 4 . 1 1 80 80 ALA CA C 80 50.801 50.801 50.397 0.404 19946
1787 1 4 . 1 1 80 80 ALA CB C 80 19.537 19.537 18.512 1.025 19946
1788 1 4 . 1 1 80 80 ALA H H 80 7.857 7.857 8.080 -0.223 19946
1789 1 4 . 1 1 81 81 ALA N N 81 124.485 124.485 123.348 1.137 19946
1790 1 4 . 1 1 81 81 ALA HA H 81 4.353 4.353 5.140 -0.787 19946
1791 1 4 . 1 1 81 81 ALA CA C 81 51.305 51.305 49.466 1.839 19946
1792 1 4 . 1 1 81 81 ALA CB C 81 16.511 16.511 18.684 -2.173 19946
1793 1 4 . 1 1 81 81 ALA H H 81 7.191 7.191 7.213 -0.022 19946
1794 1 4 . 1 1 82 82 PRO CA C 82 62.903 62.903 62.952 -0.049 19946
1795 1 4 . 1 1 83 83 ALA N N 83 128.367 128.367 122.441 5.926 19946
1796 1 4 . 1 1 83 83 ALA HA H 83 4.058 4.058 4.124 -0.066 19946
1797 1 4 . 1 1 83 83 ALA CA C 83 52.314 52.314 52.747 -0.433 19946
1798 1 4 . 1 1 83 83 ALA CB C 83 19.001 19.001 19.631 -0.630 19946
1799 1 4 . 1 1 83 83 ALA H H 83 8.472 8.472 7.621 0.851 19946
1800 1 4 . 1 1 84 84 GLU N N 84 122.108 122.108 119.562 2.546 19946
1801 1 4 . 1 1 84 84 GLU HA H 84 4.164 4.164 4.662 -0.498 19946
1802 1 4 . 1 1 84 84 GLU CA C 84 55.937 55.937 56.014 -0.077 19946
1803 1 4 . 1 1 84 84 GLU CB C 84 30.213 30.213 32.131 -1.918 19946
1804 1 4 . 1 1 84 84 GLU H H 84 8.106 8.106 8.127 -0.021 19946
1805 1 4 . 1 1 85 85 ILE N N 85 122.808 122.808 119.157 3.651 19946
1806 1 4 . 1 1 85 85 ILE HA H 85 5.211 5.211 5.162 0.049 19946
1807 1 4 . 1 1 85 85 ILE CA C 85 58.365 58.365 59.182 -0.817 19946
1808 1 4 . 1 1 85 85 ILE CB C 85 39.707 39.707 41.584 -1.877 19946
1809 1 4 . 1 1 85 85 ILE H H 85 7.850 7.850 8.476 -0.626 19946
1810 1 4 . 1 1 86 86 PHE N N 86 122.937 122.937 117.771 5.166 19946
1811 1 4 . 1 1 86 86 PHE HA H 86 5.388 5.388 4.640 0.748 19946
1812 1 4 . 1 1 86 86 PHE CA C 86 54.509 54.509 57.289 -2.780 19946
1813 1 4 . 1 1 86 86 PHE CB C 86 42.878 42.878 43.508 -0.630 19946
1814 1 4 . 1 1 86 86 PHE H H 86 9.004 9.004 7.762 1.242 19946
1815 1 4 . 1 1 87 87 LEU N N 87 120.712 120.712 118.796 1.916 19946
1816 1 4 . 1 1 87 87 LEU HA H 87 5.295 5.295 4.746 0.549 19946
1817 1 4 . 1 1 87 87 LEU CA C 87 51.810 51.810 53.240 -1.430 19946
1818 1 4 . 1 1 87 87 LEU CB C 87 42.059 42.059 45.017 -2.958 19946
1819 1 4 . 1 1 87 87 LEU H H 87 8.785 8.785 8.099 0.686 19946
1820 1 4 . 1 1 88 88 LEU N N 88 124.779 124.779 120.869 3.910 19946
1821 1 4 . 1 1 88 88 LEU HA H 88 4.434 4.434 4.278 0.156 19946
1822 1 4 . 1 1 88 88 LEU CA C 88 54.331 54.331 52.804 1.527 19946
1823 1 4 . 1 1 88 88 LEU CB C 88 42.648 42.648 40.030 2.618 19946
1824 1 4 . 1 1 88 88 LEU H H 88 8.243 8.243 8.047 0.196 19946
1825 1 4 . 1 1 89 89 GLU N N 89 112.478 112.478 118.948 -6.470 19946
1826 1 4 . 1 1 89 89 GLU HA H 89 3.881 3.881 3.997 -0.116 19946
1827 1 4 . 1 1 89 89 GLU H H 89 9.343 9.343 8.509 0.834 19946
1828 1 4 . 1 1 90 90 ASP N N 90 120.709 120.709 120.242 0.467 19946
1829 1 4 . 1 1 90 90 ASP HA H 90 4.168 4.168 4.869 -0.701 19946
1830 1 4 . 1 1 90 90 ASP H H 90 9.062 9.062 8.376 0.686 19946
1831 1 4 . 1 1 91 91 GLY N N 91 105.049 105.049 112.836 -7.787 19946
1832 1 4 . 1 1 91 91 GLY CA C 91 46.263 46.263 44.636 1.627 19946
1833 1 4 . 1 1 91 91 GLY H H 91 7.848 7.848 7.655 0.193 19946
1834 1 4 . 1 1 92 92 ILE N N 92 122.127 122.127 121.040 1.087 19946
1835 1 4 . 1 1 92 92 ILE HA H 92 3.811 3.811 4.117 -0.306 19946
1836 1 4 . 1 1 92 92 ILE CA C 92 62.656 62.656 63.104 -0.448 19946
1837 1 4 . 1 1 92 92 ILE CB C 92 37.243 37.243 37.766 -0.523 19946
1838 1 4 . 1 1 92 92 ILE H H 92 8.077 8.077 7.591 0.486 19946
1839 1 4 . 1 1 93 93 ASP N N 93 127.038 127.038 121.581 5.457 19946
1840 1 4 . 1 1 93 93 ASP HA H 93 4.452 4.452 4.287 0.165 19946
1841 1 4 . 1 1 93 93 ASP CA C 93 57.357 57.357 57.874 -0.517 19946
1842 1 4 . 1 1 93 93 ASP CB C 93 38.194 38.194 39.853 -1.659 19946
1843 1 4 . 1 1 93 93 ASP H H 93 9.094 9.094 8.475 0.619 19946
1844 1 4 . 1 1 94 94 GLY N N 94 111.411 111.411 107.761 3.650 19946
1845 1 4 . 1 1 94 94 GLY CA C 94 44.750 44.750 46.597 -1.847 19946
1846 1 4 . 1 1 94 94 GLY H H 94 8.047 8.047 8.045 0.002 19946
1847 1 4 . 1 1 95 95 TRP N N 95 127.574 127.574 123.955 3.619 19946
1848 1 4 . 1 1 95 95 TRP HA H 95 3.738 3.738 4.345 -0.607 19946
1849 1 4 . 1 1 95 95 TRP CA C 95 60.852 60.852 58.881 1.971 19946
1850 1 4 . 1 1 95 95 TRP CB C 95 28.613 28.613 30.172 -1.559 19946
1851 1 4 . 1 1 95 95 TRP H H 95 7.918 7.918 8.526 -0.608 19946
1852 1 4 . 1 1 96 96 LYS N N 96 117.374 117.374 118.640 -1.266 19946
1853 1 4 . 1 1 96 96 LYS HA H 96 4.079 4.079 3.743 0.336 19946
1854 1 4 . 1 1 96 96 LYS CA C 96 59.091 59.091 58.556 0.534 19946
1855 1 4 . 1 1 96 96 LYS H H 96 8.625 8.625 8.274 0.351 19946
1856 1 4 . 1 1 97 97 LYS N N 97 123.490 123.490 119.985 3.505 19946
1857 1 4 . 1 1 97 97 LYS HA H 97 4.021 4.021 4.099 -0.078 19946
1858 1 4 . 1 1 97 97 LYS CB C 97 31.542 31.542 32.200 -0.658 19946
1859 1 4 . 1 1 97 97 LYS H H 97 8.233 8.233 8.413 -0.180 19946
1860 1 4 . 1 1 98 98 ALA N N 98 120.321 120.321 119.687 0.634 19946
1861 1 4 . 1 1 98 98 ALA HA H 98 4.248 4.248 4.450 -0.202 19946
1862 1 4 . 1 1 98 98 ALA CA C 98 51.305 51.305 50.991 0.314 19946
1863 1 4 . 1 1 98 98 ALA CB C 98 17.744 17.744 19.342 -1.598 19946
1864 1 4 . 1 1 98 98 ALA H H 98 7.480 7.480 7.552 -0.072 19946
1865 1 4 . 1 1 99 99 GLY N N 99 106.984 106.984 108.230 -1.246 19946
1866 1 4 . 1 1 99 99 GLY CA C 99 44.246 44.246 45.705 -1.459 19946
1867 1 4 . 1 1 99 99 GLY H H 99 7.867 7.867 8.066 -0.199 19946
1868 1 4 . 1 1 100 100 LEU N N 100 122.993 122.993 119.884 3.109 19946
1869 1 4 . 1 1 100 100 LEU HA H 100 4.277 4.277 4.352 -0.075 19946
1870 1 4 . 1 1 100 100 LEU CA C 100 52.314 52.314 50.840 1.474 19946
1871 1 4 . 1 1 100 100 LEU CB C 100 36.786 36.786 42.840 -6.054 19946
1872 1 4 . 1 1 100 100 LEU H H 100 6.958 6.958 7.137 -0.179 19946
1873 1 4 . 1 1 101 101 PRO HA H 101 4.492 4.492 4.506 -0.014 19946
1874 1 4 . 1 1 101 101 PRO CB C 101 32.097 32.097 31.723 0.374 19946
1875 1 4 . 1 1 102 102 VAL N N 102 111.514 111.514 116.306 -4.792 19946
1876 1 4 . 1 1 102 102 VAL HA H 102 4.367 4.367 4.442 -0.075 19946
1877 1 4 . 1 1 102 102 VAL CA C 102 58.869 58.869 59.831 -0.962 19946
1878 1 4 . 1 1 102 102 VAL CB C 102 35.351 35.351 32.180 3.171 19946
1879 1 4 . 1 1 102 102 VAL H H 102 7.988 7.988 8.255 -0.267 19946
1880 1 4 . 1 1 103 103 ALA N N 103 126.676 126.676 123.819 2.857 19946
1881 1 4 . 1 1 103 103 ALA HA H 103 4.524 4.524 4.500 0.024 19946
1882 1 4 . 1 1 103 103 ALA CA C 103 49.793 49.793 52.034 -2.241 19946
1883 1 4 . 1 1 103 103 ALA CB C 103 18.600 18.600 18.224 0.376 19946
1884 1 4 . 1 1 103 103 ALA H H 103 8.919 8.919 8.439 0.480 19946
1885 1 4 . 1 1 104 104 VAL N N 104 121.148 121.148 124.120 -2.972 19946
1886 1 4 . 1 1 104 104 VAL HA H 104 4.475 4.475 4.269 0.206 19946
1887 1 4 . 1 1 104 104 VAL CA C 104 59.374 59.374 59.825 -0.451 19946
1888 1 4 . 1 1 104 104 VAL CB C 104 33.884 33.884 33.317 0.567 19946
1889 1 4 . 1 1 104 104 VAL H H 104 8.241 8.241 7.866 0.375 19946
1890 1 4 . 1 1 105 105 ASN N N 105 123.816 123.816 121.197 2.619 19946
1891 1 4 . 1 1 105 105 ASN HA H 105 4.674 4.674 4.636 0.038 19946
1892 1 4 . 1 1 105 105 ASN CA C 105 53.200 53.200 53.454 -0.254 19946
1893 1 4 . 1 1 105 105 ASN CB C 105 37.959 37.959 38.002 -0.043 19946
1894 1 4 . 1 1 105 105 ASN H H 105 8.150 8.150 8.455 -0.305 19946
1895 1 4 . 1 1 106 106 LYS N N 106 123.804 123.804 123.482 0.322 19946
1896 1 4 . 1 1 106 106 LYS H H 106 8.340 8.340 8.389 -0.049 19946
1897 1 5 . 1 1 2 2 LEU N N 2 120.763 120.763 124.031 -3.268 19946
1898 1 5 . 1 1 2 2 LEU HA H 2 4.384 4.384 5.092 -0.708 19946
1899 1 5 . 1 1 2 2 LEU CA C 2 53.827 53.827 54.639 -0.812 19946
1900 1 5 . 1 1 2 2 LEU CB C 2 42.229 42.229 41.677 0.552 19946
1901 1 5 . 1 1 2 2 LEU H H 2 7.888 7.888 8.332 -0.444 19946
1902 1 5 . 1 1 3 3 THR N N 3 118.330 118.330 122.895 -4.565 19946
1903 1 5 . 1 1 3 3 THR HA H 3 4.469 4.469 4.818 -0.349 19946
1904 1 5 . 1 1 3 3 THR CA C 3 61.391 61.391 60.883 0.508 19946
1905 1 5 . 1 1 3 3 THR CB C 3 69.496 69.496 71.389 -1.893 19946
1906 1 5 . 1 1 3 3 THR H H 3 7.905 7.905 8.553 -0.648 19946
1907 1 5 . 1 1 4 4 THR N N 4 122.024 122.024 116.379 5.645 19946
1908 1 5 . 1 1 4 4 THR HA H 4 5.171 5.171 5.006 0.165 19946
1909 1 5 . 1 1 4 4 THR CA C 4 61.595 61.595 60.896 0.699 19946
1910 1 5 . 1 1 4 4 THR CB C 4 69.027 69.027 69.910 -0.883 19946
1911 1 5 . 1 1 4 4 THR H H 4 8.504 8.504 8.433 0.071 19946
1912 1 5 . 1 1 5 5 ILE N N 5 122.667 122.667 121.698 0.969 19946
1913 1 5 . 1 1 5 5 ILE HA H 5 4.973 4.973 4.760 0.213 19946
1914 1 5 . 1 1 5 5 ILE CA C 5 57.971 57.971 59.086 -1.115 19946
1915 1 5 . 1 1 5 5 ILE CB C 5 41.458 41.458 40.965 0.493 19946
1916 1 5 . 1 1 5 5 ILE H H 5 8.903 8.903 8.191 0.712 19946
1917 1 5 . 1 1 6 6 SER N N 6 123.156 123.156 115.727 7.429 19946
1918 1 5 . 1 1 6 6 SER HA H 6 4.785 4.785 4.835 -0.050 19946
1919 1 5 . 1 1 6 6 SER H H 6 9.138 9.138 8.410 0.728 19946
1920 1 5 . 1 1 7 7 PRO HA H 7 4.004 4.004 4.518 -0.514 19946
1921 1 5 . 1 1 7 7 PRO CA C 7 65.510 65.510 65.368 0.142 19946
1922 1 5 . 1 1 7 7 PRO CB C 7 30.924 30.924 32.164 -1.240 19946
1923 1 5 . 1 1 8 8 HIS N N 8 114.319 114.319 117.457 -3.138 19946
1924 1 5 . 1 1 8 8 HIS HA H 8 3.989 3.989 4.320 -0.331 19946
1925 1 5 . 1 1 8 8 HIS CA C 8 60.050 60.050 59.001 1.049 19946
1926 1 5 . 1 1 8 8 HIS CB C 8 28.613 28.613 29.485 -0.872 19946
1927 1 5 . 1 1 8 8 HIS H H 8 8.127 8.127 8.645 -0.518 19946
1928 1 5 . 1 1 9 9 ASP N N 9 121.300 121.300 118.245 3.055 19946
1929 1 5 . 1 1 9 9 ASP HA H 9 4.301 4.301 4.518 -0.217 19946
1930 1 5 . 1 1 9 9 ASP CA C 9 56.455 56.455 56.990 -0.535 19946
1931 1 5 . 1 1 9 9 ASP CB C 9 38.699 38.699 40.299 -1.600 19946
1932 1 5 . 1 1 9 9 ASP H H 9 7.639 7.639 8.458 -0.819 19946
1933 1 5 . 1 1 10 10 ALA N N 10 123.991 123.991 123.362 0.629 19946
1934 1 5 . 1 1 10 10 ALA HA H 10 3.719 3.719 4.071 -0.352 19946
1935 1 5 . 1 1 10 10 ALA CA C 10 54.331 54.331 54.792 -0.461 19946
1936 1 5 . 1 1 10 10 ALA CB C 10 17.549 17.549 18.323 -0.774 19946
1937 1 5 . 1 1 10 10 ALA H H 10 8.820 8.820 8.126 0.694 19946
1938 1 5 . 1 1 11 11 GLN N N 11 118.128 118.128 117.038 1.090 19946
1939 1 5 . 1 1 11 11 GLN HA H 11 3.933 3.933 4.130 -0.197 19946
1940 1 5 . 1 1 11 11 GLN CA C 11 59.389 59.389 58.017 1.372 19946
1941 1 5 . 1 1 11 11 GLN CB C 11 27.948 27.948 28.581 -0.633 19946
1942 1 5 . 1 1 11 11 GLN H H 11 8.353 8.353 8.532 -0.179 19946
1943 1 5 . 1 1 12 12 GLU N N 12 119.307 119.307 119.058 0.249 19946
1944 1 5 . 1 1 12 12 GLU HA H 12 4.023 4.023 4.294 -0.271 19946
1945 1 5 . 1 1 12 12 GLU CA C 12 58.476 58.476 57.932 0.544 19946
1946 1 5 . 1 1 12 12 GLU CB C 12 28.532 28.532 29.844 -1.312 19946
1947 1 5 . 1 1 12 12 GLU H H 12 7.197 7.197 8.315 -1.118 19946
1948 1 5 . 1 1 13 13 LEU N N 13 120.635 120.635 118.859 1.776 19946
1949 1 5 . 1 1 13 13 LEU HA H 13 3.821 3.821 4.206 -0.385 19946
1950 1 5 . 1 1 13 13 LEU CA C 13 57.065 57.065 57.477 -0.412 19946
1951 1 5 . 1 1 13 13 LEU CB C 13 40.890 40.890 42.257 -1.367 19946
1952 1 5 . 1 1 13 13 LEU H H 13 7.554 7.554 7.241 0.313 19946
1953 1 5 . 1 1 14 14 ILE N N 14 123.021 123.021 118.907 4.114 19946
1954 1 5 . 1 1 14 14 ILE HA H 14 3.827 3.827 3.910 -0.083 19946
1955 1 5 . 1 1 14 14 ILE CA C 14 64.053 64.053 64.990 -0.937 19946
1956 1 5 . 1 1 14 14 ILE CB C 14 38.115 38.115 37.781 0.334 19946
1957 1 5 . 1 1 14 14 ILE H H 14 8.710 8.710 7.979 0.731 19946
1958 1 5 . 1 1 15 15 ALA N N 15 124.504 124.504 119.552 4.952 19946
1959 1 5 . 1 1 15 15 ALA HA H 15 4.115 4.115 4.184 -0.069 19946
1960 1 5 . 1 1 15 15 ALA CA C 15 54.257 54.257 53.670 0.587 19946
1961 1 5 . 1 1 15 15 ALA CB C 15 17.040 17.040 18.404 -1.364 19946
1962 1 5 . 1 1 15 15 ALA H H 15 7.758 7.758 7.794 -0.036 19946
1963 1 5 . 1 1 16 16 ARG N N 16 115.990 115.990 116.882 -0.892 19946
1964 1 5 . 1 1 16 16 ARG HA H 16 4.348 4.348 4.407 -0.059 19946
1965 1 5 . 1 1 16 16 ARG CA C 16 55.416 55.416 56.710 -1.294 19946
1966 1 5 . 1 1 16 16 ARG CB C 16 29.762 29.762 31.332 -1.571 19946
1967 1 5 . 1 1 16 16 ARG H H 16 7.252 7.252 8.100 -0.848 19946
1968 1 5 . 1 1 17 17 GLY N N 17 107.981 107.981 105.683 2.298 19946
1969 1 5 . 1 1 17 17 GLY CA C 17 44.854 44.854 44.873 -0.019 19946
1970 1 5 . 1 1 17 17 GLY H H 17 7.748 7.748 7.498 0.250 19946
1971 1 5 . 1 1 18 18 ALA N N 18 123.914 123.914 125.558 -1.644 19946
1972 1 5 . 1 1 18 18 ALA HA H 18 4.221 4.221 4.290 -0.069 19946
1973 1 5 . 1 1 18 18 ALA CA C 18 52.270 52.270 53.019 -0.749 19946
1974 1 5 . 1 1 18 18 ALA CB C 18 18.638 18.638 19.547 -0.909 19946
1975 1 5 . 1 1 18 18 ALA H H 18 7.940 7.940 7.837 0.103 19946
1976 1 5 . 1 1 19 19 LYS N N 19 119.436 119.436 122.177 -2.741 19946
1977 1 5 . 1 1 19 19 LYS HA H 19 4.301 4.301 4.352 -0.051 19946
1978 1 5 . 1 1 19 19 LYS CA C 19 53.105 53.105 55.357 -2.252 19946
1979 1 5 . 1 1 19 19 LYS CB C 19 32.856 32.856 34.501 -1.645 19946
1980 1 5 . 1 1 19 19 LYS H H 19 7.565 7.565 8.516 -0.951 19946
1981 1 5 . 1 1 20 20 LEU N N 20 127.401 127.401 121.964 5.437 19946
1982 1 5 . 1 1 20 20 LEU HA H 20 5.042 5.042 4.476 0.566 19946
1983 1 5 . 1 1 20 20 LEU CA C 20 52.314 52.314 54.123 -1.809 19946
1984 1 5 . 1 1 20 20 LEU CB C 20 43.234 43.234 44.460 -1.226 19946
1985 1 5 . 1 1 20 20 LEU H H 20 8.727 8.727 8.217 0.510 19946
1986 1 5 . 1 1 21 21 ILE N N 21 128.186 128.186 126.499 1.687 19946
1987 1 5 . 1 1 21 21 ILE HA H 21 4.547 4.547 4.269 0.278 19946
1988 1 5 . 1 1 21 21 ILE CA C 21 59.589 59.589 59.985 -0.396 19946
1989 1 5 . 1 1 21 21 ILE CB C 21 38.545 38.545 41.492 -2.947 19946
1990 1 5 . 1 1 21 21 ILE H H 21 9.366 9.366 7.832 1.534 19946
1991 1 5 . 1 1 22 22 ASP N N 22 129.968 129.968 123.734 6.234 19946
1992 1 5 . 1 1 22 22 ASP HA H 22 3.803 3.803 5.029 -1.226 19946
1993 1 5 . 1 1 22 22 ASP CA C 22 51.435 51.435 53.112 -1.677 19946
1994 1 5 . 1 1 22 22 ASP CB C 22 42.062 42.062 43.488 -1.426 19946
1995 1 5 . 1 1 22 22 ASP H H 22 8.583 8.583 8.223 0.360 19946
1996 1 5 . 1 1 23 23 ILE N N 23 116.266 116.266 121.613 -5.347 19946
1997 1 5 . 1 1 23 23 ILE HA H 23 5.229 5.229 4.391 0.838 19946
1998 1 5 . 1 1 23 23 ILE CA C 23 59.374 59.374 60.240 -0.866 19946
1999 1 5 . 1 1 23 23 ILE CB C 23 37.327 37.327 36.302 1.025 19946
2000 1 5 . 1 1 23 23 ILE H H 23 7.836 7.836 7.637 0.199 19946
2001 1 5 . 1 1 24 24 ARG N N 24 125.001 125.001 120.414 4.587 19946
2002 1 5 . 1 1 24 24 ARG HA H 24 4.116 4.116 4.382 -0.266 19946
2003 1 5 . 1 1 24 24 ARG CA C 24 55.943 55.943 54.499 1.444 19946
2004 1 5 . 1 1 24 24 ARG CB C 24 30.135 30.135 30.891 -0.756 19946
2005 1 5 . 1 1 24 24 ARG H H 24 8.195 8.195 7.207 0.988 19946
2006 1 5 . 1 1 25 25 ASP N N 25 112.839 112.839 119.069 -6.230 19946
2007 1 5 . 1 1 25 25 ASP HA H 25 4.545 4.545 4.578 -0.033 19946
2008 1 5 . 1 1 25 25 ASP CA C 25 53.870 53.870 54.894 -1.024 19946
2009 1 5 . 1 1 25 25 ASP CB C 25 41.327 41.327 41.850 -0.523 19946
2010 1 5 . 1 1 25 25 ASP H H 25 7.660 7.660 8.522 -0.862 19946
2011 1 5 . 1 1 26 26 ALA N N 26 122.145 122.145 121.143 1.002 19946
2012 1 5 . 1 1 26 26 ALA HA H 26 3.897 3.897 4.262 -0.365 19946
2013 1 5 . 1 1 26 26 ALA CA C 26 54.958 54.958 53.421 1.537 19946
2014 1 5 . 1 1 26 26 ALA CB C 26 17.520 17.520 20.137 -2.617 19946
2015 1 5 . 1 1 26 26 ALA H H 26 8.766 8.766 8.171 0.595 19946
2016 1 5 . 1 1 27 27 ASP N N 27 115.380 115.380 119.193 -3.813 19946
2017 1 5 . 1 1 27 27 ASP HA H 27 4.299 4.299 4.386 -0.087 19946
2018 1 5 . 1 1 27 27 ASP CA C 27 56.451 56.451 56.471 -0.020 19946
2019 1 5 . 1 1 27 27 ASP CB C 27 39.156 39.156 40.527 -1.371 19946
2020 1 5 . 1 1 27 27 ASP H H 27 8.686 8.686 8.662 0.024 19946
2021 1 5 . 1 1 28 28 GLU N N 28 120.081 120.081 119.363 0.718 19946
2022 1 5 . 1 1 28 28 GLU HA H 28 4.086 4.086 4.077 0.009 19946
2023 1 5 . 1 1 28 28 GLU CA C 28 58.389 58.389 58.892 -0.503 19946
2024 1 5 . 1 1 28 28 GLU CB C 28 28.728 28.728 29.706 -0.977 19946
2025 1 5 . 1 1 28 28 GLU H H 28 7.397 7.397 8.816 -1.419 19946
2026 1 5 . 1 1 29 29 TYR N N 29 121.205 121.205 118.135 3.070 19946
2027 1 5 . 1 1 29 29 TYR HA H 29 4.083 4.083 4.669 -0.586 19946
2028 1 5 . 1 1 29 29 TYR CA C 29 60.378 60.378 57.685 2.693 19946
2029 1 5 . 1 1 29 29 TYR CB C 29 38.699 38.699 39.682 -0.983 19946
2030 1 5 . 1 1 29 29 TYR H H 29 7.506 7.506 7.609 -0.103 19946
2031 1 5 . 1 1 30 30 LEU N N 30 118.828 118.828 123.023 -4.195 19946
2032 1 5 . 1 1 30 30 LEU HA H 30 3.850 3.850 4.050 -0.200 19946
2033 1 5 . 1 1 30 30 LEU CA C 30 56.348 56.348 57.499 -1.151 19946
2034 1 5 . 1 1 30 30 LEU CB C 30 41.220 41.220 41.647 -0.426 19946
2035 1 5 . 1 1 30 30 LEU H H 30 8.211 8.211 7.682 0.529 19946
2036 1 5 . 1 1 31 31 ARG N N 31 118.220 118.220 117.782 0.438 19946
2037 1 5 . 1 1 31 31 ARG HA H 31 4.101 4.101 4.031 0.070 19946
2038 1 5 . 1 1 31 31 ARG CA C 31 58.365 58.365 58.684 -0.319 19946
2039 1 5 . 1 1 31 31 ARG CB C 31 30.074 30.074 30.197 -0.123 19946
2040 1 5 . 1 1 31 31 ARG H H 31 7.120 7.120 8.352 -1.232 19946
2041 1 5 . 1 1 32 32 GLU N N 32 117.980 117.980 116.531 1.449 19946
2042 1 5 . 1 1 32 32 GLU HA H 32 4.884 4.884 4.641 0.243 19946
2043 1 5 . 1 1 32 32 GLU CA C 32 55.339 55.339 55.625 -0.286 19946
2044 1 5 . 1 1 32 32 GLU CB C 32 31.698 31.698 30.831 0.867 19946
2045 1 5 . 1 1 32 32 GLU H H 32 7.506 7.506 8.320 -0.814 19946
2046 1 5 . 1 1 33 33 HIS N N 33 118.257 118.257 120.991 -2.734 19946
2047 1 5 . 1 1 33 33 HIS HA H 33 4.643 4.643 4.588 0.055 19946
2048 1 5 . 1 1 33 33 HIS CA C 33 53.766 53.766 55.589 -1.823 19946
2049 1 5 . 1 1 33 33 HIS CB C 33 29.940 29.940 31.452 -1.512 19946
2050 1 5 . 1 1 33 33 HIS H H 33 8.269 8.269 8.642 -0.373 19946
2051 1 5 . 1 1 34 34 ILE N N 34 127.809 127.809 117.387 10.422 19946
2052 1 5 . 1 1 34 34 ILE HA H 34 3.920 3.920 3.814 0.106 19946
2053 1 5 . 1 1 34 34 ILE CA C 34 59.648 59.648 61.711 -2.063 19946
2054 1 5 . 1 1 34 34 ILE CB C 34 37.959 37.959 38.954 -0.995 19946
2055 1 5 . 1 1 34 34 ILE H H 34 9.989 9.989 7.835 2.154 19946
2056 1 5 . 1 1 35 35 PRO HA H 35 4.198 4.198 4.289 -0.091 19946
2057 1 5 . 1 1 36 36 GLU N N 36 114.414 114.414 122.225 -7.811 19946
2058 1 5 . 1 1 36 36 GLU HA H 36 4.082 4.082 3.910 0.172 19946
2059 1 5 . 1 1 36 36 GLU CA C 36 57.861 57.861 56.983 0.878 19946
2060 1 5 . 1 1 36 36 GLU CB C 36 28.109 28.109 29.088 -0.979 19946
2061 1 5 . 1 1 36 36 GLU H H 36 8.557 8.557 8.301 0.256 19946
2062 1 5 . 1 1 37 37 ALA N N 37 122.882 122.882 126.593 -3.711 19946
2063 1 5 . 1 1 37 37 ALA HA H 37 4.439 4.439 4.816 -0.377 19946
2064 1 5 . 1 1 37 37 ALA CA C 37 52.005 52.005 50.964 1.041 19946
2065 1 5 . 1 1 37 37 ALA CB C 37 20.438 20.438 22.076 -1.638 19946
2066 1 5 . 1 1 37 37 ALA H H 37 8.096 8.096 8.271 -0.175 19946
2067 1 5 . 1 1 38 38 ASP N N 38 124.471 124.471 118.578 5.893 19946
2068 1 5 . 1 1 38 38 ASP HA H 38 4.844 4.844 4.653 0.191 19946
2069 1 5 . 1 1 38 38 ASP CA C 38 52.614 52.614 53.964 -1.350 19946
2070 1 5 . 1 1 38 38 ASP CB C 38 44.407 44.407 43.502 0.905 19946
2071 1 5 . 1 1 38 38 ASP H H 38 9.004 9.004 8.397 0.607 19946
2072 1 5 . 1 1 39 39 LEU N N 39 123.936 123.936 124.858 -0.922 19946
2073 1 5 . 1 1 39 39 LEU HA H 39 4.328 4.328 3.924 0.404 19946
2074 1 5 . 1 1 39 39 LEU CA C 39 54.037 54.037 56.177 -2.140 19946
2075 1 5 . 1 1 39 39 LEU CB C 39 41.220 41.220 41.580 -0.359 19946
2076 1 5 . 1 1 39 39 LEU H H 39 8.125 8.125 8.516 -0.391 19946
2077 1 5 . 1 1 40 40 ALA N N 40 131.297 131.297 127.585 3.712 19946
2078 1 5 . 1 1 40 40 ALA HA H 40 4.408 4.408 4.519 -0.111 19946
2079 1 5 . 1 1 40 40 ALA CA C 40 48.784 48.784 50.694 -1.910 19946
2080 1 5 . 1 1 40 40 ALA CB C 40 17.979 17.979 19.771 -1.792 19946
2081 1 5 . 1 1 40 40 ALA H H 40 8.654 8.654 7.943 0.711 19946
2082 1 5 . 1 1 41 41 PRO HA H 41 4.101 4.101 4.717 -0.616 19946
2083 1 5 . 1 1 41 41 PRO CA C 41 61.391 61.391 62.472 -1.081 19946
2084 1 5 . 1 1 41 41 PRO CB C 41 32.097 32.097 32.371 -0.274 19946
2085 1 5 . 1 1 42 42 LEU N N 42 125.312 125.312 121.274 4.038 19946
2086 1 5 . 1 1 42 42 LEU HA H 42 3.871 3.871 3.852 0.019 19946
2087 1 5 . 1 1 42 42 LEU CA C 42 57.861 57.861 58.801 -0.940 19946
2088 1 5 . 1 1 42 42 LEU CB C 42 40.941 40.941 40.752 0.189 19946
2089 1 5 . 1 1 42 42 LEU H H 42 8.285 8.285 8.463 -0.178 19946
2090 1 5 . 1 1 43 43 SER N N 43 110.669 110.669 114.260 -3.591 19946
2091 1 5 . 1 1 43 43 SER HA H 43 4.106 4.106 4.103 0.003 19946
2092 1 5 . 1 1 43 43 SER CA C 43 60.497 60.497 62.019 -1.522 19946
2093 1 5 . 1 1 43 43 SER CB C 43 61.391 61.391 62.373 -0.982 19946
2094 1 5 . 1 1 43 43 SER H H 43 8.453 8.453 8.309 0.144 19946
2095 1 5 . 1 1 44 44 VAL N N 44 123.933 123.933 121.803 2.130 19946
2096 1 5 . 1 1 44 44 VAL HA H 44 3.821 3.821 3.782 0.039 19946
2097 1 5 . 1 1 44 44 VAL CA C 44 64.752 64.752 65.952 -1.200 19946
2098 1 5 . 1 1 44 44 VAL CB C 44 31.135 31.135 31.598 -0.463 19946
2099 1 5 . 1 1 44 44 VAL H H 44 7.156 7.156 7.753 -0.597 19946
2100 1 5 . 1 1 45 45 LEU N N 45 121.150 121.150 119.751 1.399 19946
2101 1 5 . 1 1 45 45 LEU HA H 45 3.767 3.767 3.962 -0.195 19946
2102 1 5 . 1 1 45 45 LEU CA C 45 56.599 56.599 57.991 -1.392 19946
2103 1 5 . 1 1 45 45 LEU CB C 45 40.890 40.890 41.407 -0.517 19946
2104 1 5 . 1 1 45 45 LEU H H 45 7.997 7.997 8.947 -0.950 19946
2105 1 5 . 1 1 46 46 GLU N N 46 116.256 116.256 118.298 -2.042 19946
2106 1 5 . 1 1 46 46 GLU HA H 46 3.678 3.678 4.130 -0.452 19946
2107 1 5 . 1 1 46 46 GLU CA C 46 58.365 58.365 58.305 0.060 19946
2108 1 5 . 1 1 46 46 GLU CB C 46 29.622 29.622 30.115 -0.493 19946
2109 1 5 . 1 1 46 46 GLU H H 46 8.501 8.501 8.234 0.267 19946
2110 1 5 . 1 1 47 47 GLN N N 47 117.261 117.261 117.409 -0.148 19946
2111 1 5 . 1 1 47 47 GLN HA H 47 4.216 4.216 4.126 0.090 19946
2112 1 5 . 1 1 47 47 GLN CA C 47 56.852 56.852 58.218 -1.366 19946
2113 1 5 . 1 1 47 47 GLN CB C 47 29.119 29.119 29.097 0.022 19946
2114 1 5 . 1 1 47 47 GLN H H 47 7.407 7.407 8.394 -0.987 19946
2115 1 5 . 1 1 48 48 SER N N 48 111.890 111.890 112.239 -0.349 19946
2116 1 5 . 1 1 48 48 SER HA H 48 4.641 4.641 4.534 0.107 19946
2117 1 5 . 1 1 48 48 SER CA C 48 57.956 57.956 57.995 -0.039 19946
2118 1 5 . 1 1 48 48 SER CB C 48 63.912 63.912 65.003 -1.091 19946
2119 1 5 . 1 1 48 48 SER H H 48 8.566 8.566 8.378 0.188 19946
2120 1 5 . 1 1 49 49 GLY N N 49 111.545 111.545 109.725 1.820 19946
2121 1 5 . 1 1 49 49 GLY CA C 49 43.894 43.894 44.552 -0.658 19946
2122 1 5 . 1 1 49 49 GLY H H 49 7.836 7.836 7.385 0.451 19946
2123 1 5 . 1 1 50 50 LEU N N 50 121.541 121.541 122.738 -1.197 19946
2124 1 5 . 1 1 50 50 LEU HA H 50 4.239 4.239 4.238 0.001 19946
2125 1 5 . 1 1 50 50 LEU CA C 50 51.985 51.985 54.471 -2.486 19946
2126 1 5 . 1 1 50 50 LEU CB C 50 42.648 42.648 42.013 0.635 19946
2127 1 5 . 1 1 50 50 LEU H H 50 8.564 8.564 8.392 0.172 19946
2128 1 5 . 1 1 51 51 PRO HA H 51 4.243 4.243 4.528 -0.285 19946
2129 1 5 . 1 1 51 51 PRO CB C 51 31.639 31.639 32.789 -1.150 19946
2130 1 5 . 1 1 52 52 ALA N N 52 127.008 127.008 126.971 0.037 19946
2131 1 5 . 1 1 52 52 ALA HA H 52 3.790 3.790 4.092 -0.302 19946
2132 1 5 . 1 1 52 52 ALA CA C 52 54.835 54.835 54.934 -0.099 19946
2133 1 5 . 1 1 52 52 ALA CB C 52 17.715 17.715 18.600 -0.885 19946
2134 1 5 . 1 1 52 52 ALA H H 52 8.564 8.564 8.584 -0.020 19946
2135 1 5 . 1 1 53 53 LYS N N 53 114.535 114.535 115.543 -1.008 19946
2136 1 5 . 1 1 53 53 LYS HA H 53 4.106 4.106 4.060 0.046 19946
2137 1 5 . 1 1 53 53 LYS CA C 53 56.852 56.852 58.380 -1.528 19946
2138 1 5 . 1 1 53 53 LYS CB C 53 31.386 31.386 31.781 -0.395 19946
2139 1 5 . 1 1 53 53 LYS H H 53 8.364 8.364 8.474 -0.110 19946
2140 1 5 . 1 1 54 54 LEU N N 54 118.515 118.515 117.073 1.442 19946
2141 1 5 . 1 1 54 54 LEU HA H 54 4.247 4.247 4.441 -0.194 19946
2142 1 5 . 1 1 54 54 LEU CA C 54 53.338 53.338 53.800 -0.462 19946
2143 1 5 . 1 1 54 54 LEU CB C 54 40.890 40.890 41.812 -0.922 19946
2144 1 5 . 1 1 54 54 LEU H H 54 7.745 7.745 7.099 0.646 19946
2145 1 5 . 1 1 55 55 ARG N N 55 117.612 117.612 121.238 -3.626 19946
2146 1 5 . 1 1 55 55 ARG HA H 55 3.927 3.927 4.628 -0.701 19946
2147 1 5 . 1 1 55 55 ARG CA C 55 56.832 56.832 55.564 1.268 19946
2148 1 5 . 1 1 55 55 ARG CB C 55 28.610 28.610 32.040 -3.430 19946
2149 1 5 . 1 1 55 55 ARG H H 55 6.938 6.938 8.182 -1.244 19946
2150 1 5 . 1 1 56 56 HIS N N 56 123.269 123.269 123.778 -0.509 19946
2151 1 5 . 1 1 56 56 HIS HA H 56 4.614 4.614 4.690 -0.076 19946
2152 1 5 . 1 1 56 56 HIS CA C 56 54.835 54.835 55.725 -0.890 19946
2153 1 5 . 1 1 56 56 HIS CB C 56 32.648 32.648 31.727 0.921 19946
2154 1 5 . 1 1 56 56 HIS H H 56 7.237 7.237 8.539 -1.302 19946
2155 1 5 . 1 1 57 57 GLU N N 57 120.895 120.895 118.524 2.371 19946
2156 1 5 . 1 1 57 57 GLU HA H 57 3.976 3.976 4.259 -0.283 19946
2157 1 5 . 1 1 57 57 GLU CA C 57 58.871 58.871 57.969 0.902 19946
2158 1 5 . 1 1 57 57 GLU CB C 57 29.158 29.158 30.724 -1.566 19946
2159 1 5 . 1 1 57 57 GLU H H 57 7.625 7.625 8.283 -0.658 19946
2160 1 5 . 1 1 58 58 GLN N N 58 118.485 118.485 116.388 2.097 19946
2161 1 5 . 1 1 58 58 GLN HA H 58 5.425 5.425 4.927 0.498 19946
2162 1 5 . 1 1 58 58 GLN CA C 58 54.910 54.910 54.819 0.091 19946
2163 1 5 . 1 1 58 58 GLN CB C 58 32.285 32.285 31.187 1.098 19946
2164 1 5 . 1 1 58 58 GLN H H 58 8.335 8.335 8.104 0.231 19946
2165 1 5 . 1 1 59 59 ILE N N 59 123.505 123.505 118.704 4.801 19946
2166 1 5 . 1 1 59 59 ILE HA H 59 4.492 4.492 4.567 -0.075 19946
2167 1 5 . 1 1 59 59 ILE CA C 59 58.869 58.869 59.355 -0.486 19946
2168 1 5 . 1 1 59 59 ILE CB C 59 42.332 42.332 40.519 1.813 19946
2169 1 5 . 1 1 59 59 ILE H H 59 8.704 8.704 8.682 0.022 19946
2170 1 5 . 1 1 60 60 ILE N N 60 126.464 126.464 117.287 9.177 19946
2171 1 5 . 1 1 60 60 ILE HA H 60 4.954 4.954 4.993 -0.039 19946
2172 1 5 . 1 1 60 60 ILE CA C 60 57.357 57.357 59.368 -2.011 19946
2173 1 5 . 1 1 60 60 ILE CB C 60 39.131 39.131 42.146 -3.015 19946
2174 1 5 . 1 1 60 60 ILE H H 60 9.006 9.006 7.765 1.241 19946
2175 1 5 . 1 1 61 61 PHE N N 61 124.441 124.441 122.377 2.064 19946
2176 1 5 . 1 1 61 61 PHE HA H 61 5.795 5.795 4.938 0.857 19946
2177 1 5 . 1 1 61 61 PHE CA C 61 56.131 56.131 57.152 -1.021 19946
2178 1 5 . 1 1 61 61 PHE CB C 61 42.879 42.879 43.641 -0.762 19946
2179 1 5 . 1 1 61 61 PHE H H 61 8.938 8.938 8.362 0.576 19946
2180 1 5 . 1 1 62 62 HIS N N 62 117.494 117.494 120.013 -2.519 19946
2181 1 5 . 1 1 62 62 HIS HA H 62 5.928 5.928 5.014 0.914 19946
2182 1 5 . 1 1 62 62 HIS CA C 62 53.322 53.322 55.308 -1.986 19946
2183 1 5 . 1 1 62 62 HIS CB C 62 35.673 35.673 32.885 2.788 19946
2184 1 5 . 1 1 62 62 HIS H H 62 9.230 9.230 8.262 0.968 19946
2185 1 5 . 1 1 63 63 CYS N N 63 120.220 120.220 123.050 -2.830 19946
2186 1 5 . 1 1 63 63 CYS HA H 63 5.033 5.033 4.497 0.536 19946
2187 1 5 . 1 1 63 63 CYS CA C 63 56.131 56.131 57.496 -1.365 19946
2188 1 5 . 1 1 63 63 CYS CB C 63 28.109 28.109 30.534 -2.425 19946
2189 1 5 . 1 1 63 63 CYS H H 63 8.131 8.131 8.707 -0.576 19946
2190 1 5 . 1 1 65 65 ALA N N 65 119.272 119.272 119.818 -0.546 19946
2191 1 5 . 1 1 65 65 ALA HA H 65 5.063 5.063 4.615 0.448 19946
2192 1 5 . 1 1 65 65 ALA CA C 65 49.793 49.793 51.168 -1.375 19946
2193 1 5 . 1 1 65 65 ALA CB C 65 19.775 19.775 18.265 1.510 19946
2194 1 5 . 1 1 65 65 ALA H H 65 8.967 8.967 7.829 1.138 19946
2195 1 5 . 1 1 66 66 GLY N N 66 113.296 113.296 110.245 3.051 19946
2196 1 5 . 1 1 66 66 GLY CA C 66 44.934 44.934 45.465 -0.531 19946
2197 1 5 . 1 1 66 66 GLY H H 66 8.778 8.778 7.687 1.091 19946
2198 1 5 . 1 1 67 67 LYS N N 67 121.300 121.300 118.484 2.816 19946
2199 1 5 . 1 1 67 67 LYS HA H 67 4.211 4.211 3.790 0.421 19946
2200 1 5 . 1 1 67 67 LYS H H 67 8.111 8.111 8.580 -0.469 19946
2201 1 5 . 1 1 68 68 ARG N N 68 126.092 126.092 119.156 6.936 19946
2202 1 5 . 1 1 68 68 ARG H H 68 9.067 9.067 8.092 0.975 19946
2203 1 5 . 1 1 69 69 THR N N 69 117.153 117.153 111.566 5.587 19946
2204 1 5 . 1 1 69 69 THR HA H 69 3.576 3.576 4.475 -0.899 19946
2205 1 5 . 1 1 69 69 THR CA C 69 65.397 65.397 62.088 3.309 19946
2206 1 5 . 1 1 69 69 THR CB C 69 66.938 66.938 69.728 -2.790 19946
2207 1 5 . 1 1 69 69 THR H H 69 10.233 10.233 7.845 2.388 19946
2208 1 5 . 1 1 70 70 SER N N 70 113.686 113.686 117.405 -3.719 19946
2209 1 5 . 1 1 70 70 SER HA H 70 4.091 4.091 4.109 -0.018 19946
2210 1 5 . 1 1 70 70 SER CA C 70 61.391 61.391 60.941 0.450 19946
2211 1 5 . 1 1 70 70 SER CB C 70 65.425 65.425 62.832 2.593 19946
2212 1 5 . 1 1 70 70 SER H H 70 7.322 7.322 8.378 -1.056 19946
2213 1 5 . 1 1 71 71 ASN N N 71 118.257 118.257 118.939 -0.682 19946
2214 1 5 . 1 1 71 71 ASN HA H 71 4.177 4.177 4.524 -0.347 19946
2215 1 5 . 1 1 71 71 ASN CA C 71 54.736 54.736 55.240 -0.504 19946
2216 1 5 . 1 1 71 71 ASN CB C 71 38.391 38.391 38.757 -0.366 19946
2217 1 5 . 1 1 71 71 ASN H H 71 7.863 7.863 8.680 -0.817 19946
2218 1 5 . 1 1 72 72 ASN N N 72 115.529 115.529 114.697 0.832 19946
2219 1 5 . 1 1 72 72 ASN HA H 72 5.127 5.127 4.860 0.267 19946
2220 1 5 . 1 1 72 72 ASN CA C 72 52.173 52.173 53.015 -0.842 19946
2221 1 5 . 1 1 72 72 ASN CB C 72 39.165 39.165 38.535 0.630 19946
2222 1 5 . 1 1 72 72 ASN H H 72 7.238 7.238 8.379 -1.141 19946
2223 1 5 . 1 1 73 73 ALA N N 73 125.388 125.388 124.135 1.253 19946
2224 1 5 . 1 1 73 73 ALA HA H 73 3.639 3.639 3.969 -0.330 19946
2225 1 5 . 1 1 73 73 ALA CA C 73 56.133 56.133 55.015 1.118 19946
2226 1 5 . 1 1 73 73 ALA CB C 73 18.528 18.528 19.179 -0.651 19946
2227 1 5 . 1 1 73 73 ALA H H 73 7.081 7.081 7.587 -0.506 19946
2228 1 5 . 1 1 74 74 ASP N N 74 115.501 115.501 119.369 -3.868 19946
2229 1 5 . 1 1 74 74 ASP HA H 74 4.135 4.135 4.267 -0.132 19946
2230 1 5 . 1 1 74 74 ASP CA C 74 55.891 55.891 57.363 -1.472 19946
2231 1 5 . 1 1 74 74 ASP CB C 74 38.699 38.699 40.207 -1.508 19946
2232 1 5 . 1 1 74 74 ASP H H 74 8.346 8.346 8.478 -0.132 19946
2233 1 5 . 1 1 75 75 LYS N N 75 122.469 122.469 118.390 4.079 19946
2234 1 5 . 1 1 75 75 LYS HA H 75 4.024 4.024 3.974 0.050 19946
2235 1 5 . 1 1 75 75 LYS CA C 75 57.861 57.861 58.945 -1.084 19946
2236 1 5 . 1 1 75 75 LYS CB C 75 31.660 31.660 31.777 -0.117 19946
2237 1 5 . 1 1 75 75 LYS H H 75 7.583 7.583 8.230 -0.647 19946
2238 1 5 . 1 1 76 76 LEU N N 76 119.196 119.196 119.791 -0.595 19946
2239 1 5 . 1 1 76 76 LEU HA H 76 3.570 3.570 3.734 -0.164 19946
2240 1 5 . 1 1 76 76 LEU CA C 76 56.852 56.852 57.446 -0.594 19946
2241 1 5 . 1 1 76 76 LEU CB C 76 39.245 39.245 41.498 -2.253 19946
2242 1 5 . 1 1 76 76 LEU H H 76 8.069 8.069 7.413 0.656 19946
2243 1 5 . 1 1 77 77 ALA N N 77 120.302 120.302 118.887 1.415 19946
2244 1 5 . 1 1 77 77 ALA HA H 77 3.985 3.985 4.089 -0.104 19946
2245 1 5 . 1 1 77 77 ALA CA C 77 53.794 53.794 52.991 0.803 19946
2246 1 5 . 1 1 77 77 ALA CB C 77 17.353 17.353 18.612 -1.259 19946
2247 1 5 . 1 1 77 77 ALA H H 77 8.063 8.063 8.099 -0.036 19946
2248 1 5 . 1 1 78 78 ALA N N 78 119.602 119.602 117.603 1.999 19946
2249 1 5 . 1 1 78 78 ALA HA H 78 4.138 4.138 4.515 -0.377 19946
2250 1 5 . 1 1 78 78 ALA CA C 78 54.049 54.049 51.840 2.209 19946
2251 1 5 . 1 1 78 78 ALA CB C 78 17.520 17.520 19.592 -2.072 19946
2252 1 5 . 1 1 78 78 ALA H H 78 7.274 7.274 7.492 -0.218 19946
2253 1 5 . 1 1 79 79 ILE N N 79 118.809 118.809 118.749 0.060 19946
2254 1 5 . 1 1 79 79 ILE HA H 79 3.798 3.798 4.047 -0.249 19946
2255 1 5 . 1 1 79 79 ILE CA C 79 63.354 63.354 62.451 0.903 19946
2256 1 5 . 1 1 79 79 ILE CB C 79 38.422 38.422 40.180 -1.758 19946
2257 1 5 . 1 1 79 79 ILE H H 79 8.170 8.170 7.347 0.823 19946
2258 1 5 . 1 1 80 80 ALA N N 80 118.736 118.736 119.523 -0.787 19946
2259 1 5 . 1 1 80 80 ALA HA H 80 4.412 4.412 4.545 -0.133 19946
2260 1 5 . 1 1 80 80 ALA CA C 80 50.801 50.801 50.718 0.083 19946
2261 1 5 . 1 1 80 80 ALA CB C 80 19.537 19.537 18.877 0.660 19946
2262 1 5 . 1 1 80 80 ALA H H 80 7.857 7.857 7.301 0.556 19946
2263 1 5 . 1 1 81 81 ALA N N 81 124.485 124.485 123.230 1.255 19946
2264 1 5 . 1 1 81 81 ALA HA H 81 4.353 4.353 5.037 -0.684 19946
2265 1 5 . 1 1 81 81 ALA CA C 81 51.305 51.305 49.335 1.970 19946
2266 1 5 . 1 1 81 81 ALA CB C 81 16.511 16.511 19.204 -2.693 19946
2267 1 5 . 1 1 81 81 ALA H H 81 7.191 7.191 7.434 -0.243 19946
2268 1 5 . 1 1 82 82 PRO CA C 82 62.903 62.903 62.821 0.082 19946
2269 1 5 . 1 1 83 83 ALA N N 83 128.367 128.367 122.379 5.988 19946
2270 1 5 . 1 1 83 83 ALA HA H 83 4.058 4.058 4.051 0.007 19946
2271 1 5 . 1 1 83 83 ALA CA C 83 52.314 52.314 52.947 -0.633 19946
2272 1 5 . 1 1 83 83 ALA CB C 83 19.001 19.001 19.443 -0.442 19946
2273 1 5 . 1 1 83 83 ALA H H 83 8.472 8.472 7.616 0.856 19946
2274 1 5 . 1 1 84 84 GLU N N 84 122.108 122.108 118.922 3.186 19946
2275 1 5 . 1 1 84 84 GLU HA H 84 4.164 4.164 4.409 -0.245 19946
2276 1 5 . 1 1 84 84 GLU CA C 84 55.937 55.937 56.319 -0.382 19946
2277 1 5 . 1 1 84 84 GLU CB C 84 30.213 30.213 31.759 -1.546 19946
2278 1 5 . 1 1 84 84 GLU H H 84 8.106 8.106 7.996 0.110 19946
2279 1 5 . 1 1 85 85 ILE N N 85 122.808 122.808 117.951 4.857 19946
2280 1 5 . 1 1 85 85 ILE HA H 85 5.211 5.211 4.627 0.584 19946
2281 1 5 . 1 1 85 85 ILE CA C 85 58.365 58.365 59.757 -1.392 19946
2282 1 5 . 1 1 85 85 ILE CB C 85 39.707 39.707 42.228 -2.521 19946
2283 1 5 . 1 1 85 85 ILE H H 85 7.850 7.850 7.438 0.412 19946
2284 1 5 . 1 1 86 86 PHE N N 86 122.937 122.937 119.832 3.105 19946
2285 1 5 . 1 1 86 86 PHE HA H 86 5.388 5.388 5.228 0.160 19946
2286 1 5 . 1 1 86 86 PHE CA C 86 54.509 54.509 56.132 -1.623 19946
2287 1 5 . 1 1 86 86 PHE CB C 86 42.878 42.878 42.754 0.124 19946
2288 1 5 . 1 1 86 86 PHE H H 86 9.004 9.004 8.008 0.996 19946
2289 1 5 . 1 1 87 87 LEU N N 87 120.712 120.712 120.014 0.698 19946
2290 1 5 . 1 1 87 87 LEU HA H 87 5.295 5.295 4.715 0.580 19946
2291 1 5 . 1 1 87 87 LEU CA C 87 51.810 51.810 54.389 -2.579 19946
2292 1 5 . 1 1 87 87 LEU CB C 87 42.059 42.059 43.160 -1.101 19946
2293 1 5 . 1 1 87 87 LEU H H 87 8.785 8.785 9.320 -0.535 19946
2294 1 5 . 1 1 88 88 LEU N N 88 124.779 124.779 122.316 2.463 19946
2295 1 5 . 1 1 88 88 LEU HA H 88 4.434 4.434 4.664 -0.230 19946
2296 1 5 . 1 1 88 88 LEU CA C 88 54.331 54.331 53.793 0.538 19946
2297 1 5 . 1 1 88 88 LEU CB C 88 42.648 42.648 43.377 -0.729 19946
2298 1 5 . 1 1 88 88 LEU H H 88 8.243 8.243 8.472 -0.229 19946
2299 1 5 . 1 1 89 89 GLU N N 89 112.478 112.478 126.016 -13.538 19946
2300 1 5 . 1 1 89 89 GLU HA H 89 3.881 3.881 4.153 -0.272 19946
2301 1 5 . 1 1 89 89 GLU H H 89 9.343 9.343 8.118 1.225 19946
2302 1 5 . 1 1 90 90 ASP N N 90 120.709 120.709 122.259 -1.550 19946
2303 1 5 . 1 1 90 90 ASP HA H 90 4.168 4.168 4.447 -0.279 19946
2304 1 5 . 1 1 90 90 ASP H H 90 9.062 9.062 8.535 0.527 19946
2305 1 5 . 1 1 91 91 GLY N N 91 105.049 105.049 111.121 -6.072 19946
2306 1 5 . 1 1 91 91 GLY CA C 91 46.263 46.263 45.884 0.379 19946
2307 1 5 . 1 1 91 91 GLY H H 91 7.848 7.848 8.612 -0.764 19946
2308 1 5 . 1 1 92 92 ILE N N 92 122.127 122.127 120.553 1.574 19946
2309 1 5 . 1 1 92 92 ILE HA H 92 3.811 3.811 3.789 0.022 19946
2310 1 5 . 1 1 92 92 ILE CA C 92 62.656 62.656 65.421 -2.764 19946
2311 1 5 . 1 1 92 92 ILE CB C 92 37.243 37.243 37.401 -0.158 19946
2312 1 5 . 1 1 92 92 ILE H H 92 8.077 8.077 8.541 -0.464 19946
2313 1 5 . 1 1 93 93 ASP N N 93 127.038 127.038 119.066 7.972 19946
2314 1 5 . 1 1 93 93 ASP HA H 93 4.452 4.452 4.390 0.062 19946
2315 1 5 . 1 1 93 93 ASP CA C 93 57.357 57.357 57.549 -0.192 19946
2316 1 5 . 1 1 93 93 ASP CB C 93 38.194 38.194 40.643 -2.449 19946
2317 1 5 . 1 1 93 93 ASP H H 93 9.094 9.094 8.723 0.371 19946
2318 1 5 . 1 1 94 94 GLY N N 94 111.411 111.411 106.949 4.462 19946
2319 1 5 . 1 1 94 94 GLY CA C 94 44.750 44.750 45.892 -1.142 19946
2320 1 5 . 1 1 94 94 GLY H H 94 8.047 8.047 7.722 0.325 19946
2321 1 5 . 1 1 95 95 TRP N N 95 127.574 127.574 125.149 2.425 19946
2322 1 5 . 1 1 95 95 TRP HA H 95 3.738 3.738 4.447 -0.709 19946
2323 1 5 . 1 1 95 95 TRP CA C 95 60.852 60.852 58.873 1.979 19946
2324 1 5 . 1 1 95 95 TRP CB C 95 28.613 28.613 29.798 -1.185 19946
2325 1 5 . 1 1 95 95 TRP H H 95 7.918 7.918 8.436 -0.518 19946
2326 1 5 . 1 1 96 96 LYS N N 96 117.374 117.374 118.854 -1.480 19946
2327 1 5 . 1 1 96 96 LYS HA H 96 4.079 4.079 4.238 -0.159 19946
2328 1 5 . 1 1 96 96 LYS CA C 96 59.091 59.091 56.856 2.235 19946
2329 1 5 . 1 1 96 96 LYS H H 96 8.625 8.625 8.949 -0.324 19946
2330 1 5 . 1 1 97 97 LYS N N 97 123.490 123.490 119.876 3.614 19946
2331 1 5 . 1 1 97 97 LYS HA H 97 4.021 4.021 4.090 -0.069 19946
2332 1 5 . 1 1 97 97 LYS CB C 97 31.542 31.542 32.548 -1.006 19946
2333 1 5 . 1 1 97 97 LYS H H 97 8.233 8.233 7.668 0.565 19946
2334 1 5 . 1 1 98 98 ALA N N 98 120.321 120.321 119.235 1.086 19946
2335 1 5 . 1 1 98 98 ALA HA H 98 4.248 4.248 4.625 -0.377 19946
2336 1 5 . 1 1 98 98 ALA CA C 98 51.305 51.305 51.139 0.166 19946
2337 1 5 . 1 1 98 98 ALA CB C 98 17.744 17.744 19.016 -1.272 19946
2338 1 5 . 1 1 98 98 ALA H H 98 7.480 7.480 7.174 0.306 19946
2339 1 5 . 1 1 99 99 GLY N N 99 106.984 106.984 109.149 -2.165 19946
2340 1 5 . 1 1 99 99 GLY CA C 99 44.246 44.246 46.133 -1.887 19946
2341 1 5 . 1 1 99 99 GLY H H 99 7.867 7.867 7.943 -0.076 19946
2342 1 5 . 1 1 100 100 LEU N N 100 122.993 122.993 121.396 1.597 19946
2343 1 5 . 1 1 100 100 LEU HA H 100 4.277 4.277 4.407 -0.130 19946
2344 1 5 . 1 1 100 100 LEU CA C 100 52.314 52.314 51.018 1.296 19946
2345 1 5 . 1 1 100 100 LEU CB C 100 36.786 36.786 42.545 -5.759 19946
2346 1 5 . 1 1 100 100 LEU H H 100 6.958 6.958 7.145 -0.187 19946
2347 1 5 . 1 1 101 101 PRO HA H 101 4.492 4.492 4.637 -0.145 19946
2348 1 5 . 1 1 101 101 PRO CB C 101 32.097 32.097 32.071 0.026 19946
2349 1 5 . 1 1 102 102 VAL N N 102 111.514 111.514 116.965 -5.451 19946
2350 1 5 . 1 1 102 102 VAL HA H 102 4.367 4.367 4.613 -0.246 19946
2351 1 5 . 1 1 102 102 VAL CA C 102 58.869 58.869 60.518 -1.649 19946
2352 1 5 . 1 1 102 102 VAL CB C 102 35.351 35.351 33.283 2.068 19946
2353 1 5 . 1 1 102 102 VAL H H 102 7.988 7.988 8.224 -0.236 19946
2354 1 5 . 1 1 103 103 ALA N N 103 126.676 126.676 122.411 4.265 19946
2355 1 5 . 1 1 103 103 ALA HA H 103 4.524 4.524 4.560 -0.036 19946
2356 1 5 . 1 1 103 103 ALA CA C 103 49.793 49.793 51.541 -1.748 19946
2357 1 5 . 1 1 103 103 ALA CB C 103 18.600 18.600 17.151 1.449 19946
2358 1 5 . 1 1 103 103 ALA H H 103 8.919 8.919 8.476 0.443 19946
2359 1 5 . 1 1 104 104 VAL N N 104 121.148 121.148 119.756 1.392 19946
2360 1 5 . 1 1 104 104 VAL HA H 104 4.475 4.475 4.527 -0.052 19946
2361 1 5 . 1 1 104 104 VAL CA C 104 59.374 59.374 60.605 -1.231 19946
2362 1 5 . 1 1 104 104 VAL CB C 104 33.884 33.884 33.015 0.869 19946
2363 1 5 . 1 1 104 104 VAL H H 104 8.241 8.241 7.510 0.731 19946
2364 1 5 . 1 1 105 105 ASN N N 105 123.816 123.816 119.371 4.445 19946
2365 1 5 . 1 1 105 105 ASN HA H 105 4.674 4.674 4.840 -0.166 19946
2366 1 5 . 1 1 105 105 ASN CA C 105 53.200 53.200 52.629 0.571 19946
2367 1 5 . 1 1 105 105 ASN CB C 105 37.959 37.959 38.999 -1.040 19946
2368 1 5 . 1 1 105 105 ASN H H 105 8.150 8.150 8.512 -0.362 19946
2369 1 5 . 1 1 106 106 LYS N N 106 123.804 123.804 125.683 -1.879 19946
2370 1 5 . 1 1 106 106 LYS H H 106 8.340 8.340 8.556 -0.216 19946
2371 1 6 . 1 1 2 2 LEU N N 2 120.763 120.763 121.127 -0.364 19946
2372 1 6 . 1 1 2 2 LEU HA H 2 4.384 4.384 4.137 0.247 19946
2373 1 6 . 1 1 2 2 LEU CA C 2 53.827 53.827 56.044 -2.216 19946
2374 1 6 . 1 1 2 2 LEU CB C 2 42.229 42.229 42.303 -0.074 19946
2375 1 6 . 1 1 2 2 LEU H H 2 7.888 7.888 8.372 -0.484 19946
2376 1 6 . 1 1 3 3 THR N N 3 118.330 118.330 108.906 9.424 19946
2377 1 6 . 1 1 3 3 THR HA H 3 4.469 4.469 4.358 0.111 19946
2378 1 6 . 1 1 3 3 THR CA C 3 61.391 61.391 60.993 0.398 19946
2379 1 6 . 1 1 3 3 THR CB C 3 69.496 69.496 70.369 -0.873 19946
2380 1 6 . 1 1 3 3 THR H H 3 7.905 7.905 7.612 0.293 19946
2381 1 6 . 1 1 4 4 THR N N 4 122.024 122.024 115.845 6.179 19946
2382 1 6 . 1 1 4 4 THR HA H 4 5.171 5.171 4.926 0.245 19946
2383 1 6 . 1 1 4 4 THR CA C 4 61.595 61.595 60.840 0.755 19946
2384 1 6 . 1 1 4 4 THR CB C 4 69.027 69.027 70.886 -1.859 19946
2385 1 6 . 1 1 4 4 THR H H 4 8.504 8.504 8.308 0.196 19946
2386 1 6 . 1 1 5 5 ILE N N 5 122.667 122.667 120.937 1.730 19946
2387 1 6 . 1 1 5 5 ILE HA H 5 4.973 4.973 4.412 0.561 19946
2388 1 6 . 1 1 5 5 ILE CA C 5 57.971 57.971 60.883 -2.912 19946
2389 1 6 . 1 1 5 5 ILE CB C 5 41.458 41.458 41.106 0.352 19946
2390 1 6 . 1 1 5 5 ILE H H 5 8.903 8.903 8.447 0.456 19946
2391 1 6 . 1 1 6 6 SER N N 6 123.156 123.156 117.522 5.634 19946
2392 1 6 . 1 1 6 6 SER HA H 6 4.785 4.785 5.060 -0.275 19946
2393 1 6 . 1 1 6 6 SER H H 6 9.138 9.138 8.313 0.825 19946
2394 1 6 . 1 1 7 7 PRO HA H 7 4.004 4.004 4.583 -0.579 19946
2395 1 6 . 1 1 7 7 PRO CA C 7 65.510 65.510 63.361 2.149 19946
2396 1 6 . 1 1 7 7 PRO CB C 7 30.924 30.924 31.001 -0.077 19946
2397 1 6 . 1 1 8 8 HIS N N 8 114.319 114.319 120.240 -5.921 19946
2398 1 6 . 1 1 8 8 HIS HA H 8 3.989 3.989 4.616 -0.627 19946
2399 1 6 . 1 1 8 8 HIS CA C 8 60.050 60.050 57.443 2.607 19946
2400 1 6 . 1 1 8 8 HIS CB C 8 28.613 28.613 31.961 -3.348 19946
2401 1 6 . 1 1 8 8 HIS H H 8 8.127 8.127 8.330 -0.203 19946
2402 1 6 . 1 1 9 9 ASP N N 9 121.300 121.300 121.046 0.254 19946
2403 1 6 . 1 1 9 9 ASP HA H 9 4.301 4.301 4.787 -0.486 19946
2404 1 6 . 1 1 9 9 ASP CA C 9 56.455 56.455 54.894 1.561 19946
2405 1 6 . 1 1 9 9 ASP CB C 9 38.699 38.699 41.821 -3.122 19946
2406 1 6 . 1 1 9 9 ASP H H 9 7.639 7.639 8.290 -0.651 19946
2407 1 6 . 1 1 10 10 ALA N N 10 123.991 123.991 123.025 0.966 19946
2408 1 6 . 1 1 10 10 ALA HA H 10 3.719 3.719 4.020 -0.301 19946
2409 1 6 . 1 1 10 10 ALA CA C 10 54.331 54.331 54.949 -0.618 19946
2410 1 6 . 1 1 10 10 ALA CB C 10 17.549 17.549 18.507 -0.958 19946
2411 1 6 . 1 1 10 10 ALA H H 10 8.820 8.820 7.519 1.301 19946
2412 1 6 . 1 1 11 11 GLN N N 11 118.128 118.128 116.250 1.878 19946
2413 1 6 . 1 1 11 11 GLN HA H 11 3.933 3.933 4.121 -0.188 19946
2414 1 6 . 1 1 11 11 GLN CA C 11 59.389 59.389 57.803 1.586 19946
2415 1 6 . 1 1 11 11 GLN CB C 11 27.948 27.948 28.360 -0.412 19946
2416 1 6 . 1 1 11 11 GLN H H 11 8.353 8.353 8.633 -0.280 19946
2417 1 6 . 1 1 12 12 GLU N N 12 119.307 119.307 119.963 -0.656 19946
2418 1 6 . 1 1 12 12 GLU HA H 12 4.023 4.023 4.269 -0.246 19946
2419 1 6 . 1 1 12 12 GLU CA C 12 58.476 58.476 58.426 0.050 19946
2420 1 6 . 1 1 12 12 GLU CB C 12 28.532 28.532 30.256 -1.724 19946
2421 1 6 . 1 1 12 12 GLU H H 12 7.197 7.197 8.136 -0.939 19946
2422 1 6 . 1 1 13 13 LEU N N 13 120.635 120.635 117.829 2.806 19946
2423 1 6 . 1 1 13 13 LEU HA H 13 3.821 3.821 4.130 -0.309 19946
2424 1 6 . 1 1 13 13 LEU CA C 13 57.065 57.065 58.091 -1.026 19946
2425 1 6 . 1 1 13 13 LEU CB C 13 40.890 40.890 41.571 -0.681 19946
2426 1 6 . 1 1 13 13 LEU H H 13 7.554 7.554 7.478 0.076 19946
2427 1 6 . 1 1 14 14 ILE N N 14 123.021 123.021 119.724 3.297 19946
2428 1 6 . 1 1 14 14 ILE HA H 14 3.827 3.827 3.863 -0.036 19946
2429 1 6 . 1 1 14 14 ILE CA C 14 64.053 64.053 64.652 -0.599 19946
2430 1 6 . 1 1 14 14 ILE CB C 14 38.115 38.115 37.793 0.322 19946
2431 1 6 . 1 1 14 14 ILE H H 14 8.710 8.710 7.950 0.760 19946
2432 1 6 . 1 1 15 15 ALA N N 15 124.504 124.504 120.548 3.956 19946
2433 1 6 . 1 1 15 15 ALA HA H 15 4.115 4.115 4.365 -0.250 19946
2434 1 6 . 1 1 15 15 ALA CA C 15 54.257 54.257 53.863 0.394 19946
2435 1 6 . 1 1 15 15 ALA CB C 15 17.040 17.040 18.424 -1.384 19946
2436 1 6 . 1 1 15 15 ALA H H 15 7.758 7.758 7.876 -0.118 19946
2437 1 6 . 1 1 16 16 ARG N N 16 115.990 115.990 116.313 -0.323 19946
2438 1 6 . 1 1 16 16 ARG HA H 16 4.348 4.348 4.355 -0.007 19946
2439 1 6 . 1 1 16 16 ARG CA C 16 55.416 55.416 56.838 -1.422 19946
2440 1 6 . 1 1 16 16 ARG CB C 16 29.762 29.762 30.935 -1.173 19946
2441 1 6 . 1 1 16 16 ARG H H 16 7.252 7.252 7.612 -0.360 19946
2442 1 6 . 1 1 17 17 GLY N N 17 107.981 107.981 105.618 2.363 19946
2443 1 6 . 1 1 17 17 GLY CA C 17 44.854 44.854 45.354 -0.500 19946
2444 1 6 . 1 1 17 17 GLY H H 17 7.748 7.748 7.541 0.207 19946
2445 1 6 . 1 1 18 18 ALA N N 18 123.914 123.914 124.907 -0.993 19946
2446 1 6 . 1 1 18 18 ALA HA H 18 4.221 4.221 4.282 -0.061 19946
2447 1 6 . 1 1 18 18 ALA CA C 18 52.270 52.270 53.052 -0.782 19946
2448 1 6 . 1 1 18 18 ALA CB C 18 18.638 18.638 19.514 -0.876 19946
2449 1 6 . 1 1 18 18 ALA H H 18 7.940 7.940 7.745 0.195 19946
2450 1 6 . 1 1 19 19 LYS N N 19 119.436 119.436 122.185 -2.749 19946
2451 1 6 . 1 1 19 19 LYS HA H 19 4.301 4.301 4.333 -0.032 19946
2452 1 6 . 1 1 19 19 LYS CA C 19 53.105 53.105 55.429 -2.324 19946
2453 1 6 . 1 1 19 19 LYS CB C 19 32.856 32.856 34.796 -1.940 19946
2454 1 6 . 1 1 19 19 LYS H H 19 7.565 7.565 8.241 -0.676 19946
2455 1 6 . 1 1 20 20 LEU N N 20 127.401 127.401 124.349 3.052 19946
2456 1 6 . 1 1 20 20 LEU HA H 20 5.042 5.042 4.839 0.203 19946
2457 1 6 . 1 1 20 20 LEU CA C 20 52.314 52.314 54.279 -1.965 19946
2458 1 6 . 1 1 20 20 LEU CB C 20 43.234 43.234 44.565 -1.331 19946
2459 1 6 . 1 1 20 20 LEU H H 20 8.727 8.727 8.463 0.264 19946
2460 1 6 . 1 1 21 21 ILE N N 21 128.186 128.186 127.519 0.667 19946
2461 1 6 . 1 1 21 21 ILE HA H 21 4.547 4.547 4.225 0.322 19946
2462 1 6 . 1 1 21 21 ILE CA C 21 59.589 59.589 59.971 -0.382 19946
2463 1 6 . 1 1 21 21 ILE CB C 21 38.545 38.545 40.808 -2.263 19946
2464 1 6 . 1 1 21 21 ILE H H 21 9.366 9.366 7.822 1.544 19946
2465 1 6 . 1 1 22 22 ASP N N 22 129.968 129.968 125.018 4.950 19946
2466 1 6 . 1 1 22 22 ASP HA H 22 3.803 3.803 4.673 -0.870 19946
2467 1 6 . 1 1 22 22 ASP CA C 22 51.435 51.435 52.860 -1.425 19946
2468 1 6 . 1 1 22 22 ASP CB C 22 42.062 42.062 42.248 -0.186 19946
2469 1 6 . 1 1 22 22 ASP H H 22 8.583 8.583 7.790 0.793 19946
2470 1 6 . 1 1 23 23 ILE N N 23 116.266 116.266 119.547 -3.281 19946
2471 1 6 . 1 1 23 23 ILE HA H 23 5.229 5.229 4.333 0.896 19946
2472 1 6 . 1 1 23 23 ILE CA C 23 59.374 59.374 59.784 -0.410 19946
2473 1 6 . 1 1 23 23 ILE CB C 23 37.327 37.327 36.726 0.601 19946
2474 1 6 . 1 1 23 23 ILE H H 23 7.836 7.836 7.315 0.521 19946
2475 1 6 . 1 1 24 24 ARG N N 24 125.001 125.001 119.955 5.046 19946
2476 1 6 . 1 1 24 24 ARG HA H 24 4.116 4.116 4.530 -0.414 19946
2477 1 6 . 1 1 24 24 ARG CA C 24 55.943 55.943 54.154 1.789 19946
2478 1 6 . 1 1 24 24 ARG CB C 24 30.135 30.135 32.051 -1.916 19946
2479 1 6 . 1 1 24 24 ARG H H 24 8.195 8.195 7.183 1.012 19946
2480 1 6 . 1 1 25 25 ASP N N 25 112.839 112.839 120.563 -7.724 19946
2481 1 6 . 1 1 25 25 ASP HA H 25 4.545 4.545 4.533 0.012 19946
2482 1 6 . 1 1 25 25 ASP CA C 25 53.870 53.870 54.827 -0.957 19946
2483 1 6 . 1 1 25 25 ASP CB C 25 41.327 41.327 41.430 -0.103 19946
2484 1 6 . 1 1 25 25 ASP H H 25 7.660 7.660 8.474 -0.814 19946
2485 1 6 . 1 1 26 26 ALA N N 26 122.145 122.145 123.842 -1.697 19946
2486 1 6 . 1 1 26 26 ALA HA H 26 3.897 3.897 4.159 -0.262 19946
2487 1 6 . 1 1 26 26 ALA CA C 26 54.958 54.958 54.839 0.119 19946
2488 1 6 . 1 1 26 26 ALA CB C 26 17.520 17.520 19.001 -1.481 19946
2489 1 6 . 1 1 26 26 ALA H H 26 8.766 8.766 8.415 0.351 19946
2490 1 6 . 1 1 27 27 ASP N N 27 115.380 115.380 118.042 -2.662 19946
2491 1 6 . 1 1 27 27 ASP HA H 27 4.299 4.299 4.381 -0.082 19946
2492 1 6 . 1 1 27 27 ASP CA C 27 56.451 56.451 56.878 -0.427 19946
2493 1 6 . 1 1 27 27 ASP CB C 27 39.156 39.156 40.068 -0.912 19946
2494 1 6 . 1 1 27 27 ASP H H 27 8.686 8.686 8.613 0.073 19946
2495 1 6 . 1 1 28 28 GLU N N 28 120.081 120.081 117.582 2.499 19946
2496 1 6 . 1 1 28 28 GLU HA H 28 4.086 4.086 4.144 -0.058 19946
2497 1 6 . 1 1 28 28 GLU CA C 28 58.389 58.389 58.610 -0.221 19946
2498 1 6 . 1 1 28 28 GLU CB C 28 28.728 28.728 29.599 -0.871 19946
2499 1 6 . 1 1 28 28 GLU H H 28 7.397 7.397 8.611 -1.214 19946
2500 1 6 . 1 1 29 29 TYR N N 29 121.205 121.205 119.614 1.591 19946
2501 1 6 . 1 1 29 29 TYR HA H 29 4.083 4.083 4.583 -0.500 19946
2502 1 6 . 1 1 29 29 TYR CA C 29 60.378 60.378 59.005 1.373 19946
2503 1 6 . 1 1 29 29 TYR CB C 29 38.699 38.699 38.889 -0.190 19946
2504 1 6 . 1 1 29 29 TYR H H 29 7.506 7.506 8.189 -0.683 19946
2505 1 6 . 1 1 30 30 LEU N N 30 118.828 118.828 120.113 -1.285 19946
2506 1 6 . 1 1 30 30 LEU HA H 30 3.850 3.850 3.868 -0.018 19946
2507 1 6 . 1 1 30 30 LEU CA C 30 56.348 56.348 57.011 -0.663 19946
2508 1 6 . 1 1 30 30 LEU CB C 30 41.220 41.220 42.174 -0.954 19946
2509 1 6 . 1 1 30 30 LEU H H 30 8.211 8.211 8.000 0.211 19946
2510 1 6 . 1 1 31 31 ARG N N 31 118.220 118.220 117.638 0.582 19946
2511 1 6 . 1 1 31 31 ARG HA H 31 4.101 4.101 4.354 -0.253 19946
2512 1 6 . 1 1 31 31 ARG CA C 31 58.365 58.365 56.960 1.405 19946
2513 1 6 . 1 1 31 31 ARG CB C 31 30.074 30.074 31.165 -1.091 19946
2514 1 6 . 1 1 31 31 ARG H H 31 7.120 7.120 7.920 -0.800 19946
2515 1 6 . 1 1 32 32 GLU N N 32 117.980 117.980 119.588 -1.608 19946
2516 1 6 . 1 1 32 32 GLU HA H 32 4.884 4.884 4.191 0.693 19946
2517 1 6 . 1 1 32 32 GLU CA C 32 55.339 55.339 57.682 -2.343 19946
2518 1 6 . 1 1 32 32 GLU CB C 32 31.698 31.698 30.593 1.105 19946
2519 1 6 . 1 1 32 32 GLU H H 32 7.506 7.506 8.209 -0.703 19946
2520 1 6 . 1 1 33 33 HIS N N 33 118.257 118.257 119.517 -1.260 19946
2521 1 6 . 1 1 33 33 HIS HA H 33 4.643 4.643 4.917 -0.274 19946
2522 1 6 . 1 1 33 33 HIS CA C 33 53.766 53.766 55.422 -1.657 19946
2523 1 6 . 1 1 33 33 HIS CB C 33 29.940 29.940 29.886 0.054 19946
2524 1 6 . 1 1 33 33 HIS H H 33 8.269 8.269 8.630 -0.361 19946
2525 1 6 . 1 1 34 34 ILE N N 34 127.809 127.809 127.132 0.677 19946
2526 1 6 . 1 1 34 34 ILE HA H 34 3.920 3.920 3.797 0.123 19946
2527 1 6 . 1 1 34 34 ILE CA C 34 59.648 59.648 62.502 -2.854 19946
2528 1 6 . 1 1 34 34 ILE CB C 34 37.959 37.959 38.140 -0.181 19946
2529 1 6 . 1 1 34 34 ILE H H 34 9.989 9.989 8.891 1.098 19946
2530 1 6 . 1 1 35 35 PRO HA H 35 4.198 4.198 4.018 0.180 19946
2531 1 6 . 1 1 36 36 GLU N N 36 114.414 114.414 116.690 -2.276 19946
2532 1 6 . 1 1 36 36 GLU HA H 36 4.082 4.082 4.201 -0.119 19946
2533 1 6 . 1 1 36 36 GLU CA C 36 57.861 57.861 56.452 1.409 19946
2534 1 6 . 1 1 36 36 GLU CB C 36 28.109 28.109 30.172 -2.063 19946
2535 1 6 . 1 1 36 36 GLU H H 36 8.557 8.557 7.764 0.793 19946
2536 1 6 . 1 1 37 37 ALA N N 37 122.882 122.882 123.746 -0.864 19946
2537 1 6 . 1 1 37 37 ALA HA H 37 4.439 4.439 5.163 -0.724 19946
2538 1 6 . 1 1 37 37 ALA CA C 37 52.005 52.005 51.506 0.499 19946
2539 1 6 . 1 1 37 37 ALA CB C 37 20.438 20.438 21.922 -1.484 19946
2540 1 6 . 1 1 37 37 ALA H H 37 8.096 8.096 8.127 -0.031 19946
2541 1 6 . 1 1 38 38 ASP N N 38 124.471 124.471 118.628 5.843 19946
2542 1 6 . 1 1 38 38 ASP HA H 38 4.844 4.844 4.791 0.053 19946
2543 1 6 . 1 1 38 38 ASP CA C 38 52.614 52.614 54.046 -1.432 19946
2544 1 6 . 1 1 38 38 ASP CB C 38 44.407 44.407 44.252 0.155 19946
2545 1 6 . 1 1 38 38 ASP H H 38 9.004 9.004 8.441 0.563 19946
2546 1 6 . 1 1 39 39 LEU N N 39 123.936 123.936 125.079 -1.143 19946
2547 1 6 . 1 1 39 39 LEU HA H 39 4.328 4.328 3.795 0.533 19946
2548 1 6 . 1 1 39 39 LEU CA C 39 54.037 54.037 55.937 -1.900 19946
2549 1 6 . 1 1 39 39 LEU CB C 39 41.220 41.220 41.333 -0.113 19946
2550 1 6 . 1 1 39 39 LEU H H 39 8.125 8.125 8.153 -0.028 19946
2551 1 6 . 1 1 40 40 ALA N N 40 131.297 131.297 127.228 4.069 19946
2552 1 6 . 1 1 40 40 ALA HA H 40 4.408 4.408 4.406 0.002 19946
2553 1 6 . 1 1 40 40 ALA CA C 40 48.784 48.784 50.906 -2.122 19946
2554 1 6 . 1 1 40 40 ALA CB C 40 17.979 17.979 19.284 -1.305 19946
2555 1 6 . 1 1 40 40 ALA H H 40 8.654 8.654 7.898 0.756 19946
2556 1 6 . 1 1 41 41 PRO HA H 41 4.101 4.101 4.667 -0.566 19946
2557 1 6 . 1 1 41 41 PRO CA C 41 61.391 61.391 62.369 -0.978 19946
2558 1 6 . 1 1 41 41 PRO CB C 41 32.097 32.097 32.395 -0.298 19946
2559 1 6 . 1 1 42 42 LEU N N 42 125.312 125.312 121.142 4.170 19946
2560 1 6 . 1 1 42 42 LEU HA H 42 3.871 3.871 3.895 -0.024 19946
2561 1 6 . 1 1 42 42 LEU CA C 42 57.861 57.861 58.781 -0.920 19946
2562 1 6 . 1 1 42 42 LEU CB C 42 40.941 40.941 41.171 -0.230 19946
2563 1 6 . 1 1 42 42 LEU H H 42 8.285 8.285 8.437 -0.152 19946
2564 1 6 . 1 1 43 43 SER N N 43 110.669 110.669 114.486 -3.817 19946
2565 1 6 . 1 1 43 43 SER HA H 43 4.106 4.106 4.054 0.052 19946
2566 1 6 . 1 1 43 43 SER CA C 43 60.497 60.497 62.943 -2.446 19946
2567 1 6 . 1 1 43 43 SER CB C 43 61.391 61.391 62.774 -1.383 19946
2568 1 6 . 1 1 43 43 SER H H 43 8.453 8.453 8.265 0.188 19946
2569 1 6 . 1 1 44 44 VAL N N 44 123.933 123.933 121.421 2.512 19946
2570 1 6 . 1 1 44 44 VAL HA H 44 3.821 3.821 3.685 0.136 19946
2571 1 6 . 1 1 44 44 VAL CA C 44 64.752 64.752 66.360 -1.608 19946
2572 1 6 . 1 1 44 44 VAL CB C 44 31.135 31.135 31.721 -0.586 19946
2573 1 6 . 1 1 44 44 VAL H H 44 7.156 7.156 7.746 -0.590 19946
2574 1 6 . 1 1 45 45 LEU N N 45 121.150 121.150 119.501 1.649 19946
2575 1 6 . 1 1 45 45 LEU HA H 45 3.767 3.767 3.931 -0.164 19946
2576 1 6 . 1 1 45 45 LEU CA C 45 56.599 56.599 57.967 -1.368 19946
2577 1 6 . 1 1 45 45 LEU CB C 45 40.890 40.890 41.501 -0.611 19946
2578 1 6 . 1 1 45 45 LEU H H 45 7.997 7.997 8.943 -0.946 19946
2579 1 6 . 1 1 46 46 GLU N N 46 116.256 116.256 118.516 -2.260 19946
2580 1 6 . 1 1 46 46 GLU HA H 46 3.678 3.678 4.077 -0.399 19946
2581 1 6 . 1 1 46 46 GLU CA C 46 58.365 58.365 58.590 -0.225 19946
2582 1 6 . 1 1 46 46 GLU CB C 46 29.622 29.622 29.964 -0.342 19946
2583 1 6 . 1 1 46 46 GLU H H 46 8.501 8.501 8.155 0.346 19946
2584 1 6 . 1 1 47 47 GLN N N 47 117.261 117.261 116.885 0.376 19946
2585 1 6 . 1 1 47 47 GLN HA H 47 4.216 4.216 4.152 0.064 19946
2586 1 6 . 1 1 47 47 GLN CA C 47 56.852 56.852 57.997 -1.145 19946
2587 1 6 . 1 1 47 47 GLN CB C 47 29.119 29.119 29.094 0.025 19946
2588 1 6 . 1 1 47 47 GLN H H 47 7.407 7.407 7.943 -0.536 19946
2589 1 6 . 1 1 48 48 SER N N 48 111.890 111.890 112.358 -0.468 19946
2590 1 6 . 1 1 48 48 SER HA H 48 4.641 4.641 4.486 0.155 19946
2591 1 6 . 1 1 48 48 SER CA C 48 57.956 57.956 57.998 -0.042 19946
2592 1 6 . 1 1 48 48 SER CB C 48 63.912 63.912 64.874 -0.962 19946
2593 1 6 . 1 1 48 48 SER H H 48 8.566 8.566 8.433 0.133 19946
2594 1 6 . 1 1 49 49 GLY N N 49 111.545 111.545 109.211 2.334 19946
2595 1 6 . 1 1 49 49 GLY CA C 49 43.894 43.894 44.613 -0.719 19946
2596 1 6 . 1 1 49 49 GLY H H 49 7.836 7.836 7.553 0.283 19946
2597 1 6 . 1 1 50 50 LEU N N 50 121.541 121.541 124.811 -3.270 19946
2598 1 6 . 1 1 50 50 LEU HA H 50 4.239 4.239 4.295 -0.056 19946
2599 1 6 . 1 1 50 50 LEU CA C 50 51.985 51.985 54.681 -2.696 19946
2600 1 6 . 1 1 50 50 LEU CB C 50 42.648 42.648 41.691 0.957 19946
2601 1 6 . 1 1 50 50 LEU H H 50 8.564 8.564 8.482 0.082 19946
2602 1 6 . 1 1 51 51 PRO HA H 51 4.243 4.243 4.602 -0.359 19946
2603 1 6 . 1 1 51 51 PRO CB C 51 31.639 31.639 32.713 -1.074 19946
2604 1 6 . 1 1 52 52 ALA N N 52 127.008 127.008 125.138 1.870 19946
2605 1 6 . 1 1 52 52 ALA HA H 52 3.790 3.790 4.146 -0.356 19946
2606 1 6 . 1 1 52 52 ALA CA C 52 54.835 54.835 54.893 -0.058 19946
2607 1 6 . 1 1 52 52 ALA CB C 52 17.715 17.715 18.514 -0.799 19946
2608 1 6 . 1 1 52 52 ALA H H 52 8.564 8.564 8.564 0.000 19946
2609 1 6 . 1 1 53 53 LYS N N 53 114.535 114.535 115.875 -1.340 19946
2610 1 6 . 1 1 53 53 LYS HA H 53 4.106 4.106 4.101 0.005 19946
2611 1 6 . 1 1 53 53 LYS CA C 53 56.852 56.852 58.314 -1.462 19946
2612 1 6 . 1 1 53 53 LYS CB C 53 31.386 31.386 31.696 -0.310 19946
2613 1 6 . 1 1 53 53 LYS H H 53 8.364 8.364 8.417 -0.053 19946
2614 1 6 . 1 1 54 54 LEU N N 54 118.515 118.515 116.974 1.541 19946
2615 1 6 . 1 1 54 54 LEU HA H 54 4.247 4.247 4.471 -0.224 19946
2616 1 6 . 1 1 54 54 LEU CA C 54 53.338 53.338 53.867 -0.529 19946
2617 1 6 . 1 1 54 54 LEU CB C 54 40.890 40.890 42.098 -1.208 19946
2618 1 6 . 1 1 54 54 LEU H H 54 7.745 7.745 7.227 0.518 19946
2619 1 6 . 1 1 55 55 ARG N N 55 117.612 117.612 121.380 -3.768 19946
2620 1 6 . 1 1 55 55 ARG HA H 55 3.927 3.927 4.610 -0.683 19946
2621 1 6 . 1 1 55 55 ARG CA C 55 56.832 56.832 55.328 1.504 19946
2622 1 6 . 1 1 55 55 ARG CB C 55 28.610 28.610 32.088 -3.478 19946
2623 1 6 . 1 1 55 55 ARG H H 55 6.938 6.938 8.058 -1.120 19946
2624 1 6 . 1 1 56 56 HIS N N 56 123.269 123.269 122.726 0.543 19946
2625 1 6 . 1 1 56 56 HIS HA H 56 4.614 4.614 4.798 -0.184 19946
2626 1 6 . 1 1 56 56 HIS CA C 56 54.835 54.835 55.262 -0.427 19946
2627 1 6 . 1 1 56 56 HIS CB C 56 32.648 32.648 32.320 0.328 19946
2628 1 6 . 1 1 56 56 HIS H H 56 7.237 7.237 8.582 -1.345 19946
2629 1 6 . 1 1 57 57 GLU N N 57 120.895 120.895 118.660 2.235 19946
2630 1 6 . 1 1 57 57 GLU HA H 57 3.976 3.976 4.282 -0.306 19946
2631 1 6 . 1 1 57 57 GLU CA C 57 58.871 58.871 58.038 0.832 19946
2632 1 6 . 1 1 57 57 GLU CB C 57 29.158 29.158 30.545 -1.387 19946
2633 1 6 . 1 1 57 57 GLU H H 57 7.625 7.625 8.486 -0.861 19946
2634 1 6 . 1 1 58 58 GLN N N 58 118.485 118.485 115.163 3.322 19946
2635 1 6 . 1 1 58 58 GLN HA H 58 5.425 5.425 5.128 0.297 19946
2636 1 6 . 1 1 58 58 GLN CA C 58 54.910 54.910 54.586 0.324 19946
2637 1 6 . 1 1 58 58 GLN CB C 58 32.285 32.285 29.009 3.276 19946
2638 1 6 . 1 1 58 58 GLN H H 58 8.335 8.335 7.834 0.501 19946
2639 1 6 . 1 1 59 59 ILE N N 59 123.505 123.505 118.590 4.915 19946
2640 1 6 . 1 1 59 59 ILE HA H 59 4.492 4.492 4.982 -0.490 19946
2641 1 6 . 1 1 59 59 ILE CA C 59 58.869 58.869 60.092 -1.223 19946
2642 1 6 . 1 1 59 59 ILE CB C 59 42.332 42.332 40.122 2.210 19946
2643 1 6 . 1 1 59 59 ILE H H 59 8.704 8.704 8.366 0.338 19946
2644 1 6 . 1 1 60 60 ILE N N 60 126.464 126.464 119.412 7.052 19946
2645 1 6 . 1 1 60 60 ILE HA H 60 4.954 4.954 5.113 -0.159 19946
2646 1 6 . 1 1 60 60 ILE CA C 60 57.357 57.357 59.216 -1.859 19946
2647 1 6 . 1 1 60 60 ILE CB C 60 39.131 39.131 42.317 -3.186 19946
2648 1 6 . 1 1 60 60 ILE H H 60 9.006 9.006 8.812 0.194 19946
2649 1 6 . 1 1 61 61 PHE N N 61 124.441 124.441 121.278 3.163 19946
2650 1 6 . 1 1 61 61 PHE HA H 61 5.795 5.795 5.049 0.746 19946
2651 1 6 . 1 1 61 61 PHE CA C 61 56.131 56.131 56.622 -0.491 19946
2652 1 6 . 1 1 61 61 PHE CB C 61 42.879 42.879 43.874 -0.995 19946
2653 1 6 . 1 1 61 61 PHE H H 61 8.938 8.938 8.395 0.543 19946
2654 1 6 . 1 1 62 62 HIS N N 62 117.494 117.494 115.069 2.425 19946
2655 1 6 . 1 1 62 62 HIS HA H 62 5.928 5.928 5.023 0.905 19946
2656 1 6 . 1 1 62 62 HIS CA C 62 53.322 53.322 55.582 -2.260 19946
2657 1 6 . 1 1 62 62 HIS CB C 62 35.673 35.673 31.819 3.854 19946
2658 1 6 . 1 1 62 62 HIS H H 62 9.230 9.230 7.990 1.240 19946
2659 1 6 . 1 1 63 63 CYS N N 63 120.220 120.220 121.624 -1.404 19946
2660 1 6 . 1 1 63 63 CYS HA H 63 5.033 5.033 4.694 0.339 19946
2661 1 6 . 1 1 63 63 CYS CA C 63 56.131 56.131 55.856 0.275 19946
2662 1 6 . 1 1 63 63 CYS CB C 63 28.109 28.109 31.446 -3.337 19946
2663 1 6 . 1 1 63 63 CYS H H 63 8.131 8.131 8.808 -0.677 19946
2664 1 6 . 1 1 65 65 ALA N N 65 119.272 119.272 120.180 -0.908 19946
2665 1 6 . 1 1 65 65 ALA HA H 65 5.063 5.063 4.590 0.473 19946
2666 1 6 . 1 1 65 65 ALA CA C 65 49.793 49.793 51.714 -1.921 19946
2667 1 6 . 1 1 65 65 ALA CB C 65 19.775 19.775 19.366 0.409 19946
2668 1 6 . 1 1 65 65 ALA H H 65 8.967 8.967 7.368 1.599 19946
2669 1 6 . 1 1 66 66 GLY N N 66 113.296 113.296 108.847 4.449 19946
2670 1 6 . 1 1 66 66 GLY CA C 66 44.934 44.934 46.219 -1.285 19946
2671 1 6 . 1 1 66 66 GLY H H 66 8.778 8.778 8.236 0.542 19946
2672 1 6 . 1 1 67 67 LYS N N 67 121.300 121.300 126.069 -4.769 19946
2673 1 6 . 1 1 67 67 LYS HA H 67 4.211 4.211 4.404 -0.193 19946
2674 1 6 . 1 1 67 67 LYS H H 67 8.111 8.111 7.919 0.192 19946
2675 1 6 . 1 1 68 68 ARG N N 68 126.092 126.092 122.283 3.809 19946
2676 1 6 . 1 1 68 68 ARG H H 68 9.067 9.067 8.605 0.462 19946
2677 1 6 . 1 1 69 69 THR N N 69 117.153 117.153 112.973 4.180 19946
2678 1 6 . 1 1 69 69 THR HA H 69 3.576 3.576 4.365 -0.789 19946
2679 1 6 . 1 1 69 69 THR CA C 69 65.397 65.397 62.036 3.361 19946
2680 1 6 . 1 1 69 69 THR CB C 69 66.938 66.938 69.489 -2.551 19946
2681 1 6 . 1 1 69 69 THR H H 69 10.233 10.233 8.188 2.045 19946
2682 1 6 . 1 1 70 70 SER N N 70 113.686 113.686 116.968 -3.282 19946
2683 1 6 . 1 1 70 70 SER HA H 70 4.091 4.091 4.262 -0.171 19946
2684 1 6 . 1 1 70 70 SER CA C 70 61.391 61.391 60.139 1.252 19946
2685 1 6 . 1 1 70 70 SER CB C 70 65.425 65.425 62.713 2.712 19946
2686 1 6 . 1 1 70 70 SER H H 70 7.322 7.322 8.397 -1.075 19946
2687 1 6 . 1 1 71 71 ASN N N 71 118.257 118.257 119.152 -0.895 19946
2688 1 6 . 1 1 71 71 ASN HA H 71 4.177 4.177 4.525 -0.348 19946
2689 1 6 . 1 1 71 71 ASN CA C 71 54.736 54.736 55.271 -0.535 19946
2690 1 6 . 1 1 71 71 ASN CB C 71 38.391 38.391 38.551 -0.160 19946
2691 1 6 . 1 1 71 71 ASN H H 71 7.863 7.863 8.643 -0.780 19946
2692 1 6 . 1 1 72 72 ASN N N 72 115.529 115.529 115.268 0.261 19946
2693 1 6 . 1 1 72 72 ASN HA H 72 5.127 5.127 4.900 0.227 19946
2694 1 6 . 1 1 72 72 ASN CA C 72 52.173 52.173 52.896 -0.723 19946
2695 1 6 . 1 1 72 72 ASN CB C 72 39.165 39.165 38.805 0.360 19946
2696 1 6 . 1 1 72 72 ASN H H 72 7.238 7.238 8.027 -0.789 19946
2697 1 6 . 1 1 73 73 ALA N N 73 125.388 125.388 122.083 3.305 19946
2698 1 6 . 1 1 73 73 ALA HA H 73 3.639 3.639 4.238 -0.599 19946
2699 1 6 . 1 1 73 73 ALA CA C 73 56.133 56.133 54.108 2.025 19946
2700 1 6 . 1 1 73 73 ALA CB C 73 18.528 18.528 19.506 -0.978 19946
2701 1 6 . 1 1 73 73 ALA H H 73 7.081 7.081 7.529 -0.448 19946
2702 1 6 . 1 1 74 74 ASP N N 74 115.501 115.501 119.476 -3.975 19946
2703 1 6 . 1 1 74 74 ASP HA H 74 4.135 4.135 4.207 -0.072 19946
2704 1 6 . 1 1 74 74 ASP CA C 74 55.891 55.891 57.852 -1.962 19946
2705 1 6 . 1 1 74 74 ASP CB C 74 38.699 38.699 40.379 -1.679 19946
2706 1 6 . 1 1 74 74 ASP H H 74 8.346 8.346 8.682 -0.336 19946
2707 1 6 . 1 1 75 75 LYS N N 75 122.469 122.469 118.316 4.153 19946
2708 1 6 . 1 1 75 75 LYS HA H 75 4.024 4.024 4.079 -0.055 19946
2709 1 6 . 1 1 75 75 LYS CA C 75 57.861 57.861 59.157 -1.296 19946
2710 1 6 . 1 1 75 75 LYS CB C 75 31.660 31.660 32.240 -0.580 19946
2711 1 6 . 1 1 75 75 LYS H H 75 7.583 7.583 8.280 -0.697 19946
2712 1 6 . 1 1 76 76 LEU N N 76 119.196 119.196 120.274 -1.078 19946
2713 1 6 . 1 1 76 76 LEU HA H 76 3.570 3.570 3.780 -0.210 19946
2714 1 6 . 1 1 76 76 LEU CA C 76 56.852 56.852 57.367 -0.515 19946
2715 1 6 . 1 1 76 76 LEU CB C 76 39.245 39.245 41.111 -1.866 19946
2716 1 6 . 1 1 76 76 LEU H H 76 8.069 8.069 7.825 0.244 19946
2717 1 6 . 1 1 77 77 ALA N N 77 120.302 120.302 121.870 -1.568 19946
2718 1 6 . 1 1 77 77 ALA HA H 77 3.985 3.985 3.888 0.097 19946
2719 1 6 . 1 1 77 77 ALA CA C 77 53.794 53.794 54.767 -0.973 19946
2720 1 6 . 1 1 77 77 ALA CB C 77 17.353 17.353 18.179 -0.826 19946
2721 1 6 . 1 1 77 77 ALA H H 77 8.063 8.063 7.882 0.181 19946
2722 1 6 . 1 1 78 78 ALA N N 78 119.602 119.602 120.045 -0.443 19946
2723 1 6 . 1 1 78 78 ALA HA H 78 4.138 4.138 4.123 0.015 19946
2724 1 6 . 1 1 78 78 ALA CA C 78 54.049 54.049 54.161 -0.112 19946
2725 1 6 . 1 1 78 78 ALA CB C 78 17.520 17.520 18.754 -1.234 19946
2726 1 6 . 1 1 78 78 ALA H H 78 7.274 7.274 7.606 -0.332 19946
2727 1 6 . 1 1 79 79 ILE N N 79 118.809 118.809 118.769 0.040 19946
2728 1 6 . 1 1 79 79 ILE HA H 79 3.798 3.798 3.785 0.013 19946
2729 1 6 . 1 1 79 79 ILE CA C 79 63.354 63.354 63.698 -0.344 19946
2730 1 6 . 1 1 79 79 ILE CB C 79 38.422 38.422 38.708 -0.286 19946
2731 1 6 . 1 1 79 79 ILE H H 79 8.170 8.170 7.786 0.384 19946
2732 1 6 . 1 1 80 80 ALA N N 80 118.736 118.736 117.741 0.995 19946
2733 1 6 . 1 1 80 80 ALA HA H 80 4.412 4.412 4.577 -0.165 19946
2734 1 6 . 1 1 80 80 ALA CA C 80 50.801 50.801 50.288 0.513 19946
2735 1 6 . 1 1 80 80 ALA CB C 80 19.537 19.537 18.697 0.840 19946
2736 1 6 . 1 1 80 80 ALA H H 80 7.857 7.857 7.742 0.115 19946
2737 1 6 . 1 1 81 81 ALA N N 81 124.485 124.485 123.073 1.412 19946
2738 1 6 . 1 1 81 81 ALA HA H 81 4.353 4.353 5.121 -0.768 19946
2739 1 6 . 1 1 81 81 ALA CA C 81 51.305 51.305 49.278 2.027 19946
2740 1 6 . 1 1 81 81 ALA CB C 81 16.511 16.511 18.953 -2.442 19946
2741 1 6 . 1 1 81 81 ALA H H 81 7.191 7.191 7.260 -0.069 19946
2742 1 6 . 1 1 82 82 PRO CA C 82 62.903 62.903 62.884 0.019 19946
2743 1 6 . 1 1 83 83 ALA N N 83 128.367 128.367 122.214 6.153 19946
2744 1 6 . 1 1 83 83 ALA HA H 83 4.058 4.058 4.094 -0.036 19946
2745 1 6 . 1 1 83 83 ALA CA C 83 52.314 52.314 52.890 -0.576 19946
2746 1 6 . 1 1 83 83 ALA CB C 83 19.001 19.001 19.374 -0.373 19946
2747 1 6 . 1 1 83 83 ALA H H 83 8.472 8.472 7.682 0.790 19946
2748 1 6 . 1 1 84 84 GLU N N 84 122.108 122.108 122.812 -0.704 19946
2749 1 6 . 1 1 84 84 GLU HA H 84 4.164 4.164 4.470 -0.306 19946
2750 1 6 . 1 1 84 84 GLU CA C 84 55.937 55.937 56.952 -1.015 19946
2751 1 6 . 1 1 84 84 GLU CB C 84 30.213 30.213 31.198 -0.985 19946
2752 1 6 . 1 1 84 84 GLU H H 84 8.106 8.106 8.030 0.076 19946
2753 1 6 . 1 1 85 85 ILE N N 85 122.808 122.808 121.466 1.342 19946
2754 1 6 . 1 1 85 85 ILE HA H 85 5.211 5.211 4.781 0.430 19946
2755 1 6 . 1 1 85 85 ILE CA C 85 58.365 58.365 58.725 -0.360 19946
2756 1 6 . 1 1 85 85 ILE CB C 85 39.707 39.707 40.365 -0.658 19946
2757 1 6 . 1 1 85 85 ILE H H 85 7.850 7.850 8.419 -0.569 19946
2758 1 6 . 1 1 86 86 PHE N N 86 122.937 122.937 120.860 2.077 19946
2759 1 6 . 1 1 86 86 PHE HA H 86 5.388 5.388 4.773 0.615 19946
2760 1 6 . 1 1 86 86 PHE CA C 86 54.509 54.509 56.800 -2.292 19946
2761 1 6 . 1 1 86 86 PHE CB C 86 42.878 42.878 43.274 -0.396 19946
2762 1 6 . 1 1 86 86 PHE H H 86 9.004 9.004 8.178 0.826 19946
2763 1 6 . 1 1 87 87 LEU N N 87 120.712 120.712 119.291 1.421 19946
2764 1 6 . 1 1 87 87 LEU HA H 87 5.295 5.295 4.880 0.415 19946
2765 1 6 . 1 1 87 87 LEU CA C 87 51.810 51.810 53.869 -2.059 19946
2766 1 6 . 1 1 87 87 LEU CB C 87 42.059 42.059 44.321 -2.262 19946
2767 1 6 . 1 1 87 87 LEU H H 87 8.785 8.785 8.285 0.500 19946
2768 1 6 . 1 1 88 88 LEU N N 88 124.779 124.779 121.823 2.956 19946
2769 1 6 . 1 1 88 88 LEU HA H 88 4.434 4.434 4.780 -0.346 19946
2770 1 6 . 1 1 88 88 LEU CA C 88 54.331 54.331 53.517 0.814 19946
2771 1 6 . 1 1 88 88 LEU CB C 88 42.648 42.648 44.687 -2.039 19946
2772 1 6 . 1 1 88 88 LEU H H 88 8.243 8.243 8.539 -0.296 19946
2773 1 6 . 1 1 89 89 GLU N N 89 112.478 112.478 126.132 -13.654 19946
2774 1 6 . 1 1 89 89 GLU HA H 89 3.881 3.881 3.954 -0.073 19946
2775 1 6 . 1 1 89 89 GLU H H 89 9.343 9.343 8.323 1.020 19946
2776 1 6 . 1 1 90 90 ASP N N 90 120.709 120.709 112.772 7.937 19946
2777 1 6 . 1 1 90 90 ASP HA H 90 4.168 4.168 4.969 -0.801 19946
2778 1 6 . 1 1 90 90 ASP H H 90 9.062 9.062 7.631 1.431 19946
2779 1 6 . 1 1 91 91 GLY N N 91 105.049 105.049 110.431 -5.382 19946
2780 1 6 . 1 1 91 91 GLY CA C 91 46.263 46.263 46.376 -0.113 19946
2781 1 6 . 1 1 91 91 GLY H H 91 7.848 7.848 8.635 -0.787 19946
2782 1 6 . 1 1 92 92 ILE N N 92 122.127 122.127 121.294 0.833 19946
2783 1 6 . 1 1 92 92 ILE HA H 92 3.811 3.811 3.808 0.003 19946
2784 1 6 . 1 1 92 92 ILE CA C 92 62.656 62.656 64.520 -1.864 19946
2785 1 6 . 1 1 92 92 ILE CB C 92 37.243 37.243 37.021 0.222 19946
2786 1 6 . 1 1 92 92 ILE H H 92 8.077 8.077 8.046 0.031 19946
2787 1 6 . 1 1 93 93 ASP N N 93 127.038 127.038 118.656 8.382 19946
2788 1 6 . 1 1 93 93 ASP HA H 93 4.452 4.452 4.489 -0.037 19946
2789 1 6 . 1 1 93 93 ASP CA C 93 57.357 57.357 56.589 0.768 19946
2790 1 6 . 1 1 93 93 ASP CB C 93 38.194 38.194 40.182 -1.988 19946
2791 1 6 . 1 1 93 93 ASP H H 93 9.094 9.094 8.664 0.430 19946
2792 1 6 . 1 1 94 94 GLY N N 94 111.411 111.411 106.889 4.522 19946
2793 1 6 . 1 1 94 94 GLY CA C 94 44.750 44.750 46.116 -1.366 19946
2794 1 6 . 1 1 94 94 GLY H H 94 8.047 8.047 8.099 -0.052 19946
2795 1 6 . 1 1 95 95 TRP N N 95 127.574 127.574 125.259 2.315 19946
2796 1 6 . 1 1 95 95 TRP HA H 95 3.738 3.738 4.346 -0.608 19946
2797 1 6 . 1 1 95 95 TRP CA C 95 60.852 60.852 58.971 1.881 19946
2798 1 6 . 1 1 95 95 TRP CB C 95 28.613 28.613 30.060 -1.447 19946
2799 1 6 . 1 1 95 95 TRP H H 95 7.918 7.918 7.883 0.035 19946
2800 1 6 . 1 1 96 96 LYS N N 96 117.374 117.374 117.883 -0.509 19946
2801 1 6 . 1 1 96 96 LYS HA H 96 4.079 4.079 4.165 -0.086 19946
2802 1 6 . 1 1 96 96 LYS CA C 96 59.091 59.091 57.243 1.847 19946
2803 1 6 . 1 1 96 96 LYS H H 96 8.625 8.625 8.592 0.033 19946
2804 1 6 . 1 1 97 97 LYS N N 97 123.490 123.490 121.659 1.831 19946
2805 1 6 . 1 1 97 97 LYS HA H 97 4.021 4.021 4.085 -0.064 19946
2806 1 6 . 1 1 97 97 LYS CB C 97 31.542 31.542 32.434 -0.892 19946
2807 1 6 . 1 1 97 97 LYS H H 97 8.233 8.233 7.842 0.391 19946
2808 1 6 . 1 1 98 98 ALA N N 98 120.321 120.321 119.230 1.091 19946
2809 1 6 . 1 1 98 98 ALA HA H 98 4.248 4.248 4.579 -0.331 19946
2810 1 6 . 1 1 98 98 ALA CA C 98 51.305 51.305 51.255 0.050 19946
2811 1 6 . 1 1 98 98 ALA CB C 98 17.744 17.744 18.705 -0.961 19946
2812 1 6 . 1 1 98 98 ALA H H 98 7.480 7.480 7.211 0.269 19946
2813 1 6 . 1 1 99 99 GLY N N 99 106.984 106.984 108.319 -1.335 19946
2814 1 6 . 1 1 99 99 GLY CA C 99 44.246 44.246 45.707 -1.461 19946
2815 1 6 . 1 1 99 99 GLY H H 99 7.867 7.867 7.931 -0.064 19946
2816 1 6 . 1 1 100 100 LEU N N 100 122.993 122.993 120.508 2.485 19946
2817 1 6 . 1 1 100 100 LEU HA H 100 4.277 4.277 4.334 -0.057 19946
2818 1 6 . 1 1 100 100 LEU CA C 100 52.314 52.314 50.729 1.585 19946
2819 1 6 . 1 1 100 100 LEU CB C 100 36.786 36.786 41.371 -4.585 19946
2820 1 6 . 1 1 100 100 LEU H H 100 6.958 6.958 7.108 -0.150 19946
2821 1 6 . 1 1 101 101 PRO HA H 101 4.492 4.492 4.593 -0.101 19946
2822 1 6 . 1 1 101 101 PRO CB C 101 32.097 32.097 32.182 -0.085 19946
2823 1 6 . 1 1 102 102 VAL N N 102 111.514 111.514 116.487 -4.973 19946
2824 1 6 . 1 1 102 102 VAL HA H 102 4.367 4.367 4.305 0.062 19946
2825 1 6 . 1 1 102 102 VAL CA C 102 58.869 58.869 61.056 -2.187 19946
2826 1 6 . 1 1 102 102 VAL CB C 102 35.351 35.351 32.373 2.978 19946
2827 1 6 . 1 1 102 102 VAL H H 102 7.988 7.988 8.593 -0.605 19946
2828 1 6 . 1 1 103 103 ALA N N 103 126.676 126.676 123.278 3.398 19946
2829 1 6 . 1 1 103 103 ALA HA H 103 4.524 4.524 4.333 0.191 19946
2830 1 6 . 1 1 103 103 ALA CA C 103 49.793 49.793 51.844 -2.051 19946
2831 1 6 . 1 1 103 103 ALA CB C 103 18.600 18.600 17.270 1.330 19946
2832 1 6 . 1 1 103 103 ALA H H 103 8.919 8.919 7.750 1.169 19946
2833 1 6 . 1 1 104 104 VAL N N 104 121.148 121.148 122.202 -1.054 19946
2834 1 6 . 1 1 104 104 VAL HA H 104 4.475 4.475 4.360 0.115 19946
2835 1 6 . 1 1 104 104 VAL CA C 104 59.374 59.374 60.525 -1.151 19946
2836 1 6 . 1 1 104 104 VAL CB C 104 33.884 33.884 33.644 0.240 19946
2837 1 6 . 1 1 104 104 VAL H H 104 8.241 8.241 7.612 0.629 19946
2838 1 6 . 1 1 105 105 ASN N N 105 123.816 123.816 121.253 2.563 19946
2839 1 6 . 1 1 105 105 ASN HA H 105 4.674 4.674 4.577 0.097 19946
2840 1 6 . 1 1 105 105 ASN CA C 105 53.200 53.200 54.044 -0.844 19946
2841 1 6 . 1 1 105 105 ASN CB C 105 37.959 37.959 38.185 -0.226 19946
2842 1 6 . 1 1 105 105 ASN H H 105 8.150 8.150 8.542 -0.392 19946
2843 1 6 . 1 1 106 106 LYS N N 106 123.804 123.804 124.296 -0.492 19946
2844 1 6 . 1 1 106 106 LYS H H 106 8.340 8.340 8.857 -0.517 19946
2845 1 7 . 1 1 2 2 LEU N N 2 120.763 120.763 121.986 -1.223 19946
2846 1 7 . 1 1 2 2 LEU HA H 2 4.384 4.384 4.204 0.180 19946
2847 1 7 . 1 1 2 2 LEU CA C 2 53.827 53.827 55.454 -1.627 19946
2848 1 7 . 1 1 2 2 LEU CB C 2 42.229 42.229 40.782 1.447 19946
2849 1 7 . 1 1 2 2 LEU H H 2 7.888 7.888 8.494 -0.606 19946
2850 1 7 . 1 1 3 3 THR N N 3 118.330 118.330 120.051 -1.721 19946
2851 1 7 . 1 1 3 3 THR HA H 3 4.469 4.469 4.519 -0.050 19946
2852 1 7 . 1 1 3 3 THR CA C 3 61.391 61.391 60.564 0.827 19946
2853 1 7 . 1 1 3 3 THR CB C 3 69.496 69.496 71.086 -1.590 19946
2854 1 7 . 1 1 3 3 THR H H 3 7.905 7.905 7.532 0.373 19946
2855 1 7 . 1 1 4 4 THR N N 4 122.024 122.024 117.623 4.401 19946
2856 1 7 . 1 1 4 4 THR HA H 4 5.171 5.171 5.829 -0.658 19946
2857 1 7 . 1 1 4 4 THR CA C 4 61.595 61.595 60.890 0.705 19946
2858 1 7 . 1 1 4 4 THR CB C 4 69.027 69.027 70.562 -1.535 19946
2859 1 7 . 1 1 4 4 THR H H 4 8.504 8.504 8.411 0.093 19946
2860 1 7 . 1 1 5 5 ILE N N 5 122.667 122.667 118.870 3.797 19946
2861 1 7 . 1 1 5 5 ILE HA H 5 4.973 4.973 4.689 0.284 19946
2862 1 7 . 1 1 5 5 ILE CA C 5 57.971 57.971 59.280 -1.309 19946
2863 1 7 . 1 1 5 5 ILE CB C 5 41.458 41.458 39.772 1.686 19946
2864 1 7 . 1 1 5 5 ILE H H 5 8.903 8.903 8.149 0.754 19946
2865 1 7 . 1 1 6 6 SER N N 6 123.156 123.156 115.124 8.032 19946
2866 1 7 . 1 1 6 6 SER HA H 6 4.785 4.785 5.013 -0.228 19946
2867 1 7 . 1 1 6 6 SER H H 6 9.138 9.138 8.362 0.776 19946
2868 1 7 . 1 1 7 7 PRO HA H 7 4.004 4.004 4.518 -0.514 19946
2869 1 7 . 1 1 7 7 PRO CA C 7 65.510 65.510 65.446 0.064 19946
2870 1 7 . 1 1 7 7 PRO CB C 7 30.924 30.924 32.234 -1.310 19946
2871 1 7 . 1 1 8 8 HIS N N 8 114.319 114.319 117.726 -3.407 19946
2872 1 7 . 1 1 8 8 HIS HA H 8 3.989 3.989 4.372 -0.383 19946
2873 1 7 . 1 1 8 8 HIS CA C 8 60.050 60.050 58.150 1.900 19946
2874 1 7 . 1 1 8 8 HIS CB C 8 28.613 28.613 29.772 -1.159 19946
2875 1 7 . 1 1 8 8 HIS H H 8 8.127 8.127 8.439 -0.312 19946
2876 1 7 . 1 1 9 9 ASP N N 9 121.300 121.300 117.419 3.881 19946
2877 1 7 . 1 1 9 9 ASP HA H 9 4.301 4.301 4.607 -0.306 19946
2878 1 7 . 1 1 9 9 ASP CA C 9 56.455 56.455 55.916 0.539 19946
2879 1 7 . 1 1 9 9 ASP CB C 9 38.699 38.699 40.913 -2.214 19946
2880 1 7 . 1 1 9 9 ASP H H 9 7.639 7.639 8.295 -0.656 19946
2881 1 7 . 1 1 10 10 ALA N N 10 123.991 123.991 123.557 0.434 19946
2882 1 7 . 1 1 10 10 ALA HA H 10 3.719 3.719 4.086 -0.367 19946
2883 1 7 . 1 1 10 10 ALA CA C 10 54.331 54.331 54.797 -0.466 19946
2884 1 7 . 1 1 10 10 ALA CB C 10 17.549 17.549 18.316 -0.767 19946
2885 1 7 . 1 1 10 10 ALA H H 10 8.820 8.820 7.726 1.094 19946
2886 1 7 . 1 1 11 11 GLN N N 11 118.128 118.128 116.814 1.314 19946
2887 1 7 . 1 1 11 11 GLN HA H 11 3.933 3.933 4.163 -0.230 19946
2888 1 7 . 1 1 11 11 GLN CA C 11 59.389 59.389 57.510 1.879 19946
2889 1 7 . 1 1 11 11 GLN CB C 11 27.948 27.948 28.690 -0.742 19946
2890 1 7 . 1 1 11 11 GLN H H 11 8.353 8.353 8.341 0.012 19946
2891 1 7 . 1 1 12 12 GLU N N 12 119.307 119.307 119.010 0.297 19946
2892 1 7 . 1 1 12 12 GLU HA H 12 4.023 4.023 4.273 -0.250 19946
2893 1 7 . 1 1 12 12 GLU CA C 12 58.476 58.476 57.058 1.418 19946
2894 1 7 . 1 1 12 12 GLU CB C 12 28.532 28.532 30.400 -1.868 19946
2895 1 7 . 1 1 12 12 GLU H H 12 7.197 7.197 8.043 -0.846 19946
2896 1 7 . 1 1 13 13 LEU N N 13 120.635 120.635 118.430 2.205 19946
2897 1 7 . 1 1 13 13 LEU HA H 13 3.821 3.821 4.127 -0.306 19946
2898 1 7 . 1 1 13 13 LEU CA C 13 57.065 57.065 57.436 -0.371 19946
2899 1 7 . 1 1 13 13 LEU CB C 13 40.890 40.890 42.085 -1.195 19946
2900 1 7 . 1 1 13 13 LEU H H 13 7.554 7.554 7.380 0.174 19946
2901 1 7 . 1 1 14 14 ILE N N 14 123.021 123.021 119.513 3.508 19946
2902 1 7 . 1 1 14 14 ILE HA H 14 3.827 3.827 3.792 0.035 19946
2903 1 7 . 1 1 14 14 ILE CA C 14 64.053 64.053 64.698 -0.645 19946
2904 1 7 . 1 1 14 14 ILE CB C 14 38.115 38.115 37.789 0.326 19946
2905 1 7 . 1 1 14 14 ILE H H 14 8.710 8.710 7.962 0.748 19946
2906 1 7 . 1 1 15 15 ALA N N 15 124.504 124.504 118.232 6.272 19946
2907 1 7 . 1 1 15 15 ALA HA H 15 4.115 4.115 4.173 -0.058 19946
2908 1 7 . 1 1 15 15 ALA CA C 15 54.257 54.257 53.287 0.970 19946
2909 1 7 . 1 1 15 15 ALA CB C 15 17.040 17.040 18.663 -1.623 19946
2910 1 7 . 1 1 15 15 ALA H H 15 7.758 7.758 8.156 -0.398 19946
2911 1 7 . 1 1 16 16 ARG N N 16 115.990 115.990 117.199 -1.209 19946
2912 1 7 . 1 1 16 16 ARG HA H 16 4.348 4.348 4.367 -0.019 19946
2913 1 7 . 1 1 16 16 ARG CA C 16 55.416 55.416 56.676 -1.260 19946
2914 1 7 . 1 1 16 16 ARG CB C 16 29.762 29.762 31.351 -1.589 19946
2915 1 7 . 1 1 16 16 ARG H H 16 7.252 7.252 7.804 -0.552 19946
2916 1 7 . 1 1 17 17 GLY N N 17 107.981 107.981 105.408 2.573 19946
2917 1 7 . 1 1 17 17 GLY CA C 17 44.854 44.854 44.911 -0.057 19946
2918 1 7 . 1 1 17 17 GLY H H 17 7.748 7.748 7.616 0.132 19946
2919 1 7 . 1 1 18 18 ALA N N 18 123.914 123.914 123.865 0.049 19946
2920 1 7 . 1 1 18 18 ALA HA H 18 4.221 4.221 4.101 0.120 19946
2921 1 7 . 1 1 18 18 ALA CA C 18 52.270 52.270 52.336 -0.066 19946
2922 1 7 . 1 1 18 18 ALA CB C 18 18.638 18.638 19.938 -1.300 19946
2923 1 7 . 1 1 18 18 ALA H H 18 7.940 7.940 7.987 -0.047 19946
2924 1 7 . 1 1 19 19 LYS N N 19 119.436 119.436 120.045 -0.609 19946
2925 1 7 . 1 1 19 19 LYS HA H 19 4.301 4.301 4.471 -0.170 19946
2926 1 7 . 1 1 19 19 LYS CA C 19 53.105 53.105 54.956 -1.851 19946
2927 1 7 . 1 1 19 19 LYS CB C 19 32.856 32.856 36.004 -3.148 19946
2928 1 7 . 1 1 19 19 LYS H H 19 7.565 7.565 8.300 -0.735 19946
2929 1 7 . 1 1 20 20 LEU N N 20 127.401 127.401 120.660 6.741 19946
2930 1 7 . 1 1 20 20 LEU HA H 20 5.042 5.042 4.847 0.195 19946
2931 1 7 . 1 1 20 20 LEU CA C 20 52.314 52.314 53.394 -1.080 19946
2932 1 7 . 1 1 20 20 LEU CB C 20 43.234 43.234 46.106 -2.872 19946
2933 1 7 . 1 1 20 20 LEU H H 20 8.727 8.727 8.212 0.515 19946
2934 1 7 . 1 1 21 21 ILE N N 21 128.186 128.186 121.742 6.444 19946
2935 1 7 . 1 1 21 21 ILE HA H 21 4.547 4.547 4.343 0.204 19946
2936 1 7 . 1 1 21 21 ILE CA C 21 59.589 59.589 58.775 0.814 19946
2937 1 7 . 1 1 21 21 ILE CB C 21 38.545 38.545 39.475 -0.930 19946
2938 1 7 . 1 1 21 21 ILE H H 21 9.366 9.366 7.825 1.541 19946
2939 1 7 . 1 1 22 22 ASP N N 22 129.968 129.968 125.402 4.566 19946
2940 1 7 . 1 1 22 22 ASP HA H 22 3.803 3.803 5.083 -1.280 19946
2941 1 7 . 1 1 22 22 ASP CA C 22 51.435 51.435 53.484 -2.049 19946
2942 1 7 . 1 1 22 22 ASP CB C 22 42.062 42.062 42.593 -0.531 19946
2943 1 7 . 1 1 22 22 ASP H H 22 8.583 8.583 8.207 0.376 19946
2944 1 7 . 1 1 23 23 ILE N N 23 116.266 116.266 114.647 1.619 19946
2945 1 7 . 1 1 23 23 ILE HA H 23 5.229 5.229 4.551 0.678 19946
2946 1 7 . 1 1 23 23 ILE CA C 23 59.374 59.374 60.319 -0.945 19946
2947 1 7 . 1 1 23 23 ILE CB C 23 37.327 37.327 37.920 -0.593 19946
2948 1 7 . 1 1 23 23 ILE H H 23 7.836 7.836 7.814 0.022 19946
2949 1 7 . 1 1 24 24 ARG N N 24 125.001 125.001 120.507 4.494 19946
2950 1 7 . 1 1 24 24 ARG HA H 24 4.116 4.116 4.504 -0.388 19946
2951 1 7 . 1 1 24 24 ARG CA C 24 55.943 55.943 54.325 1.618 19946
2952 1 7 . 1 1 24 24 ARG CB C 24 30.135 30.135 32.258 -2.123 19946
2953 1 7 . 1 1 24 24 ARG H H 24 8.195 8.195 7.492 0.703 19946
2954 1 7 . 1 1 25 25 ASP N N 25 112.839 112.839 119.692 -6.853 19946
2955 1 7 . 1 1 25 25 ASP HA H 25 4.545 4.545 4.722 -0.177 19946
2956 1 7 . 1 1 25 25 ASP CA C 25 53.870 53.870 53.868 0.002 19946
2957 1 7 . 1 1 25 25 ASP CB C 25 41.327 41.327 41.268 0.059 19946
2958 1 7 . 1 1 25 25 ASP H H 25 7.660 7.660 8.599 -0.939 19946
2959 1 7 . 1 1 26 26 ALA N N 26 122.145 122.145 121.638 0.507 19946
2960 1 7 . 1 1 26 26 ALA HA H 26 3.897 3.897 4.209 -0.312 19946
2961 1 7 . 1 1 26 26 ALA CA C 26 54.958 54.958 55.024 -0.066 19946
2962 1 7 . 1 1 26 26 ALA CB C 26 17.520 17.520 18.962 -1.442 19946
2963 1 7 . 1 1 26 26 ALA H H 26 8.766 8.766 8.298 0.468 19946
2964 1 7 . 1 1 27 27 ASP N N 27 115.380 115.380 118.661 -3.281 19946
2965 1 7 . 1 1 27 27 ASP HA H 27 4.299 4.299 4.325 -0.026 19946
2966 1 7 . 1 1 27 27 ASP CA C 27 56.451 56.451 57.357 -0.906 19946
2967 1 7 . 1 1 27 27 ASP CB C 27 39.156 39.156 39.873 -0.717 19946
2968 1 7 . 1 1 27 27 ASP H H 27 8.686 8.686 8.554 0.132 19946
2969 1 7 . 1 1 28 28 GLU N N 28 120.081 120.081 117.845 2.236 19946
2970 1 7 . 1 1 28 28 GLU HA H 28 4.086 4.086 4.066 0.020 19946
2971 1 7 . 1 1 28 28 GLU CA C 28 58.389 58.389 59.227 -0.838 19946
2972 1 7 . 1 1 28 28 GLU CB C 28 28.728 28.728 29.367 -0.639 19946
2973 1 7 . 1 1 28 28 GLU H H 28 7.397 7.397 8.783 -1.386 19946
2974 1 7 . 1 1 29 29 TYR N N 29 121.205 121.205 120.140 1.065 19946
2975 1 7 . 1 1 29 29 TYR HA H 29 4.083 4.083 4.783 -0.700 19946
2976 1 7 . 1 1 29 29 TYR CA C 29 60.378 60.378 59.543 0.835 19946
2977 1 7 . 1 1 29 29 TYR CB C 29 38.699 38.699 38.626 0.073 19946
2978 1 7 . 1 1 29 29 TYR H H 29 7.506 7.506 8.241 -0.735 19946
2979 1 7 . 1 1 30 30 LEU N N 30 118.828 118.828 118.312 0.516 19946
2980 1 7 . 1 1 30 30 LEU HA H 30 3.850 3.850 3.929 -0.079 19946
2981 1 7 . 1 1 30 30 LEU CA C 30 56.348 56.348 57.350 -1.002 19946
2982 1 7 . 1 1 30 30 LEU CB C 30 41.220 41.220 42.051 -0.831 19946
2983 1 7 . 1 1 30 30 LEU H H 30 8.211 8.211 8.211 -0.000 19946
2984 1 7 . 1 1 31 31 ARG N N 31 118.220 118.220 115.939 2.281 19946
2985 1 7 . 1 1 31 31 ARG HA H 31 4.101 4.101 4.323 -0.222 19946
2986 1 7 . 1 1 31 31 ARG CA C 31 58.365 58.365 56.843 1.522 19946
2987 1 7 . 1 1 31 31 ARG CB C 31 30.074 30.074 32.324 -2.250 19946
2988 1 7 . 1 1 31 31 ARG H H 31 7.120 7.120 7.363 -0.243 19946
2989 1 7 . 1 1 32 32 GLU N N 32 117.980 117.980 118.550 -0.570 19946
2990 1 7 . 1 1 32 32 GLU HA H 32 4.884 4.884 5.177 -0.293 19946
2991 1 7 . 1 1 32 32 GLU CA C 32 55.339 55.339 55.333 0.006 19946
2992 1 7 . 1 1 32 32 GLU CB C 32 31.698 31.698 31.552 0.146 19946
2993 1 7 . 1 1 32 32 GLU H H 32 7.506 7.506 8.240 -0.734 19946
2994 1 7 . 1 1 33 33 HIS N N 33 118.257 118.257 116.431 1.826 19946
2995 1 7 . 1 1 33 33 HIS HA H 33 4.643 4.643 4.865 -0.222 19946
2996 1 7 . 1 1 33 33 HIS CA C 33 53.766 53.766 56.160 -2.394 19946
2997 1 7 . 1 1 33 33 HIS CB C 33 29.940 29.940 30.856 -0.916 19946
2998 1 7 . 1 1 33 33 HIS H H 33 8.269 8.269 7.947 0.322 19946
2999 1 7 . 1 1 34 34 ILE N N 34 127.809 127.809 118.951 8.858 19946
3000 1 7 . 1 1 34 34 ILE HA H 34 3.920 3.920 4.301 -0.381 19946
3001 1 7 . 1 1 34 34 ILE CA C 34 59.648 59.648 57.452 2.196 19946
3002 1 7 . 1 1 34 34 ILE CB C 34 37.959 37.959 42.435 -4.476 19946
3003 1 7 . 1 1 34 34 ILE H H 34 9.989 9.989 8.093 1.896 19946
3004 1 7 . 1 1 35 35 PRO HA H 35 4.198 4.198 4.246 -0.048 19946
3005 1 7 . 1 1 36 36 GLU N N 36 114.414 114.414 122.008 -7.594 19946
3006 1 7 . 1 1 36 36 GLU HA H 36 4.082 4.082 3.874 0.208 19946
3007 1 7 . 1 1 36 36 GLU CA C 36 57.861 57.861 56.941 0.920 19946
3008 1 7 . 1 1 36 36 GLU CB C 36 28.109 28.109 28.897 -0.788 19946
3009 1 7 . 1 1 36 36 GLU H H 36 8.557 8.557 8.252 0.305 19946
3010 1 7 . 1 1 37 37 ALA N N 37 122.882 122.882 121.920 0.962 19946
3011 1 7 . 1 1 37 37 ALA HA H 37 4.439 4.439 4.694 -0.255 19946
3012 1 7 . 1 1 37 37 ALA CA C 37 52.005 52.005 51.610 0.395 19946
3013 1 7 . 1 1 37 37 ALA CB C 37 20.438 20.438 22.144 -1.706 19946
3014 1 7 . 1 1 37 37 ALA H H 37 8.096 8.096 8.074 0.022 19946
3015 1 7 . 1 1 38 38 ASP N N 38 124.471 124.471 119.356 5.115 19946
3016 1 7 . 1 1 38 38 ASP HA H 38 4.844 4.844 4.946 -0.102 19946
3017 1 7 . 1 1 38 38 ASP CA C 38 52.614 52.614 53.621 -1.007 19946
3018 1 7 . 1 1 38 38 ASP CB C 38 44.407 44.407 44.128 0.279 19946
3019 1 7 . 1 1 38 38 ASP H H 38 9.004 9.004 8.202 0.802 19946
3020 1 7 . 1 1 39 39 LEU N N 39 123.936 123.936 121.910 2.026 19946
3021 1 7 . 1 1 39 39 LEU HA H 39 4.328 4.328 4.401 -0.073 19946
3022 1 7 . 1 1 39 39 LEU CA C 39 54.037 54.037 54.959 -0.923 19946
3023 1 7 . 1 1 39 39 LEU CB C 39 41.220 41.220 40.273 0.947 19946
3024 1 7 . 1 1 39 39 LEU H H 39 8.125 8.125 7.982 0.143 19946
3025 1 7 . 1 1 40 40 ALA N N 40 131.297 131.297 126.524 4.773 19946
3026 1 7 . 1 1 40 40 ALA HA H 40 4.408 4.408 4.660 -0.252 19946
3027 1 7 . 1 1 40 40 ALA CA C 40 48.784 48.784 50.472 -1.688 19946
3028 1 7 . 1 1 40 40 ALA CB C 40 17.979 17.979 20.096 -2.117 19946
3029 1 7 . 1 1 40 40 ALA H H 40 8.654 8.654 8.834 -0.180 19946
3030 1 7 . 1 1 41 41 PRO HA H 41 4.101 4.101 4.680 -0.579 19946
3031 1 7 . 1 1 41 41 PRO CA C 41 61.391 61.391 62.229 -0.838 19946
3032 1 7 . 1 1 41 41 PRO CB C 41 32.097 32.097 32.637 -0.540 19946
3033 1 7 . 1 1 42 42 LEU N N 42 125.312 125.312 119.697 5.615 19946
3034 1 7 . 1 1 42 42 LEU HA H 42 3.871 3.871 3.836 0.035 19946
3035 1 7 . 1 1 42 42 LEU CA C 42 57.861 57.861 58.396 -0.535 19946
3036 1 7 . 1 1 42 42 LEU CB C 42 40.941 40.941 41.086 -0.145 19946
3037 1 7 . 1 1 42 42 LEU H H 42 8.285 8.285 8.513 -0.228 19946
3038 1 7 . 1 1 43 43 SER N N 43 110.669 110.669 114.325 -3.656 19946
3039 1 7 . 1 1 43 43 SER HA H 43 4.106 4.106 4.104 0.002 19946
3040 1 7 . 1 1 43 43 SER CA C 43 60.497 60.497 62.146 -1.649 19946
3041 1 7 . 1 1 43 43 SER CB C 43 61.391 61.391 62.499 -1.108 19946
3042 1 7 . 1 1 43 43 SER H H 43 8.453 8.453 8.111 0.342 19946
3043 1 7 . 1 1 44 44 VAL N N 44 123.933 123.933 122.945 0.988 19946
3044 1 7 . 1 1 44 44 VAL HA H 44 3.821 3.821 3.794 0.027 19946
3045 1 7 . 1 1 44 44 VAL CA C 44 64.752 64.752 66.265 -1.513 19946
3046 1 7 . 1 1 44 44 VAL CB C 44 31.135 31.135 32.031 -0.896 19946
3047 1 7 . 1 1 44 44 VAL H H 44 7.156 7.156 8.060 -0.904 19946
3048 1 7 . 1 1 45 45 LEU N N 45 121.150 121.150 119.038 2.112 19946
3049 1 7 . 1 1 45 45 LEU HA H 45 3.767 3.767 4.022 -0.255 19946
3050 1 7 . 1 1 45 45 LEU CA C 45 56.599 56.599 57.786 -1.187 19946
3051 1 7 . 1 1 45 45 LEU CB C 45 40.890 40.890 41.251 -0.361 19946
3052 1 7 . 1 1 45 45 LEU H H 45 7.997 7.997 8.757 -0.760 19946
3053 1 7 . 1 1 46 46 GLU N N 46 116.256 116.256 119.362 -3.106 19946
3054 1 7 . 1 1 46 46 GLU HA H 46 3.678 3.678 4.262 -0.584 19946
3055 1 7 . 1 1 46 46 GLU CA C 46 58.365 58.365 58.397 -0.032 19946
3056 1 7 . 1 1 46 46 GLU CB C 46 29.622 29.622 29.792 -0.170 19946
3057 1 7 . 1 1 46 46 GLU H H 46 8.501 8.501 8.207 0.294 19946
3058 1 7 . 1 1 47 47 GLN N N 47 117.261 117.261 118.322 -1.061 19946
3059 1 7 . 1 1 47 47 GLN HA H 47 4.216 4.216 4.146 0.070 19946
3060 1 7 . 1 1 47 47 GLN CA C 47 56.852 56.852 58.162 -1.310 19946
3061 1 7 . 1 1 47 47 GLN CB C 47 29.119 29.119 29.322 -0.203 19946
3062 1 7 . 1 1 47 47 GLN H H 47 7.407 7.407 8.371 -0.964 19946
3063 1 7 . 1 1 48 48 SER N N 48 111.890 111.890 112.623 -0.733 19946
3064 1 7 . 1 1 48 48 SER HA H 48 4.641 4.641 4.420 0.221 19946
3065 1 7 . 1 1 48 48 SER CA C 48 57.956 57.956 59.305 -1.349 19946
3066 1 7 . 1 1 48 48 SER CB C 48 63.912 63.912 64.610 -0.698 19946
3067 1 7 . 1 1 48 48 SER H H 48 8.566 8.566 8.253 0.313 19946
3068 1 7 . 1 1 49 49 GLY N N 49 111.545 111.545 110.135 1.410 19946
3069 1 7 . 1 1 49 49 GLY CA C 49 43.894 43.894 44.468 -0.574 19946
3070 1 7 . 1 1 49 49 GLY H H 49 7.836 7.836 7.871 -0.035 19946
3071 1 7 . 1 1 50 50 LEU N N 50 121.541 121.541 123.138 -1.597 19946
3072 1 7 . 1 1 50 50 LEU HA H 50 4.239 4.239 4.321 -0.082 19946
3073 1 7 . 1 1 50 50 LEU CA C 50 51.985 51.985 54.419 -2.434 19946
3074 1 7 . 1 1 50 50 LEU CB C 50 42.648 42.648 42.200 0.448 19946
3075 1 7 . 1 1 50 50 LEU H H 50 8.564 8.564 8.504 0.060 19946
3076 1 7 . 1 1 51 51 PRO HA H 51 4.243 4.243 4.551 -0.308 19946
3077 1 7 . 1 1 51 51 PRO CB C 51 31.639 31.639 32.616 -0.977 19946
3078 1 7 . 1 1 52 52 ALA N N 52 127.008 127.008 128.212 -1.204 19946
3079 1 7 . 1 1 52 52 ALA HA H 52 3.790 3.790 4.069 -0.279 19946
3080 1 7 . 1 1 52 52 ALA CA C 52 54.835 54.835 55.171 -0.336 19946
3081 1 7 . 1 1 52 52 ALA CB C 52 17.715 17.715 18.586 -0.871 19946
3082 1 7 . 1 1 52 52 ALA H H 52 8.564 8.564 8.646 -0.082 19946
3083 1 7 . 1 1 53 53 LYS N N 53 114.535 114.535 116.552 -2.017 19946
3084 1 7 . 1 1 53 53 LYS HA H 53 4.106 4.106 4.130 -0.024 19946
3085 1 7 . 1 1 53 53 LYS CA C 53 56.852 56.852 58.219 -1.367 19946
3086 1 7 . 1 1 53 53 LYS CB C 53 31.386 31.386 31.776 -0.390 19946
3087 1 7 . 1 1 53 53 LYS H H 53 8.364 8.364 8.693 -0.329 19946
3088 1 7 . 1 1 54 54 LEU N N 54 118.515 118.515 117.927 0.588 19946
3089 1 7 . 1 1 54 54 LEU HA H 54 4.247 4.247 4.477 -0.230 19946
3090 1 7 . 1 1 54 54 LEU CA C 54 53.338 53.338 53.645 -0.307 19946
3091 1 7 . 1 1 54 54 LEU CB C 54 40.890 40.890 42.599 -1.709 19946
3092 1 7 . 1 1 54 54 LEU H H 54 7.745 7.745 7.370 0.375 19946
3093 1 7 . 1 1 55 55 ARG N N 55 117.612 117.612 121.052 -3.440 19946
3094 1 7 . 1 1 55 55 ARG HA H 55 3.927 3.927 4.622 -0.695 19946
3095 1 7 . 1 1 55 55 ARG CA C 55 56.832 56.832 55.425 1.407 19946
3096 1 7 . 1 1 55 55 ARG CB C 55 28.610 28.610 32.435 -3.825 19946
3097 1 7 . 1 1 55 55 ARG H H 55 6.938 6.938 8.179 -1.241 19946
3098 1 7 . 1 1 56 56 HIS N N 56 123.269 123.269 123.107 0.162 19946
3099 1 7 . 1 1 56 56 HIS HA H 56 4.614 4.614 4.766 -0.152 19946
3100 1 7 . 1 1 56 56 HIS CA C 56 54.835 54.835 55.336 -0.501 19946
3101 1 7 . 1 1 56 56 HIS CB C 56 32.648 32.648 32.371 0.277 19946
3102 1 7 . 1 1 56 56 HIS H H 56 7.237 7.237 8.589 -1.352 19946
3103 1 7 . 1 1 57 57 GLU N N 57 120.895 120.895 119.020 1.875 19946
3104 1 7 . 1 1 57 57 GLU HA H 57 3.976 3.976 4.296 -0.320 19946
3105 1 7 . 1 1 57 57 GLU CA C 57 58.871 58.871 58.269 0.602 19946
3106 1 7 . 1 1 57 57 GLU CB C 57 29.158 29.158 30.826 -1.668 19946
3107 1 7 . 1 1 57 57 GLU H H 57 7.625 7.625 8.500 -0.875 19946
3108 1 7 . 1 1 58 58 GLN N N 58 118.485 118.485 117.574 0.911 19946
3109 1 7 . 1 1 58 58 GLN HA H 58 5.425 5.425 5.136 0.289 19946
3110 1 7 . 1 1 58 58 GLN CA C 58 54.910 54.910 54.591 0.319 19946
3111 1 7 . 1 1 58 58 GLN CB C 58 32.285 32.285 30.245 2.040 19946
3112 1 7 . 1 1 58 58 GLN H H 58 8.335 8.335 8.211 0.124 19946
3113 1 7 . 1 1 59 59 ILE N N 59 123.505 123.505 121.785 1.720 19946
3114 1 7 . 1 1 59 59 ILE HA H 59 4.492 4.492 4.897 -0.405 19946
3115 1 7 . 1 1 59 59 ILE CA C 59 58.869 58.869 59.217 -0.348 19946
3116 1 7 . 1 1 59 59 ILE CB C 59 42.332 42.332 40.609 1.722 19946
3117 1 7 . 1 1 59 59 ILE H H 59 8.704 8.704 8.402 0.302 19946
3118 1 7 . 1 1 60 60 ILE N N 60 126.464 126.464 116.930 9.534 19946
3119 1 7 . 1 1 60 60 ILE HA H 60 4.954 4.954 4.734 0.220 19946
3120 1 7 . 1 1 60 60 ILE CA C 60 57.357 57.357 60.057 -2.700 19946
3121 1 7 . 1 1 60 60 ILE CB C 60 39.131 39.131 42.471 -3.340 19946
3122 1 7 . 1 1 60 60 ILE H H 60 9.006 9.006 7.614 1.392 19946
3123 1 7 . 1 1 61 61 PHE N N 61 124.441 124.441 121.206 3.235 19946
3124 1 7 . 1 1 61 61 PHE HA H 61 5.795 5.795 5.366 0.429 19946
3125 1 7 . 1 1 61 61 PHE CA C 61 56.131 56.131 56.739 -0.608 19946
3126 1 7 . 1 1 61 61 PHE CB C 61 42.879 42.879 43.542 -0.663 19946
3127 1 7 . 1 1 61 61 PHE H H 61 8.938 8.938 8.476 0.462 19946
3128 1 7 . 1 1 62 62 HIS N N 62 117.494 117.494 119.574 -2.080 19946
3129 1 7 . 1 1 62 62 HIS HA H 62 5.928 5.928 5.193 0.735 19946
3130 1 7 . 1 1 62 62 HIS CA C 62 53.322 53.322 55.259 -1.937 19946
3131 1 7 . 1 1 62 62 HIS CB C 62 35.673 35.673 32.524 3.149 19946
3132 1 7 . 1 1 62 62 HIS H H 62 9.230 9.230 8.668 0.562 19946
3133 1 7 . 1 1 63 63 CYS N N 63 120.220 120.220 122.967 -2.747 19946
3134 1 7 . 1 1 63 63 CYS HA H 63 5.033 5.033 4.184 0.849 19946
3135 1 7 . 1 1 63 63 CYS CA C 63 56.131 56.131 61.170 -5.039 19946
3136 1 7 . 1 1 63 63 CYS CB C 63 28.109 28.109 29.181 -1.072 19946
3137 1 7 . 1 1 63 63 CYS H H 63 8.131 8.131 9.011 -0.880 19946
3138 1 7 . 1 1 65 65 ALA N N 65 119.272 119.272 122.178 -2.906 19946
3139 1 7 . 1 1 65 65 ALA HA H 65 5.063 5.063 4.669 0.394 19946
3140 1 7 . 1 1 65 65 ALA CA C 65 49.793 49.793 51.913 -2.120 19946
3141 1 7 . 1 1 65 65 ALA CB C 65 19.775 19.775 18.909 0.866 19946
3142 1 7 . 1 1 65 65 ALA H H 65 8.967 8.967 8.093 0.874 19946
3143 1 7 . 1 1 66 66 GLY N N 66 113.296 113.296 109.319 3.977 19946
3144 1 7 . 1 1 66 66 GLY CA C 66 44.934 44.934 46.039 -1.105 19946
3145 1 7 . 1 1 66 66 GLY H H 66 8.778 8.778 8.387 0.391 19946
3146 1 7 . 1 1 67 67 LYS N N 67 121.300 121.300 120.178 1.122 19946
3147 1 7 . 1 1 67 67 LYS HA H 67 4.211 4.211 3.870 0.341 19946
3148 1 7 . 1 1 67 67 LYS H H 67 8.111 8.111 8.250 -0.139 19946
3149 1 7 . 1 1 68 68 ARG N N 68 126.092 126.092 121.224 4.868 19946
3150 1 7 . 1 1 68 68 ARG H H 68 9.067 9.067 8.347 0.720 19946
3151 1 7 . 1 1 69 69 THR N N 69 117.153 117.153 115.133 2.020 19946
3152 1 7 . 1 1 69 69 THR HA H 69 3.576 3.576 4.279 -0.703 19946
3153 1 7 . 1 1 69 69 THR CA C 69 65.397 65.397 62.501 2.896 19946
3154 1 7 . 1 1 69 69 THR CB C 69 66.938 66.938 68.917 -1.979 19946
3155 1 7 . 1 1 69 69 THR H H 69 10.233 10.233 8.226 2.007 19946
3156 1 7 . 1 1 70 70 SER N N 70 113.686 113.686 118.906 -5.220 19946
3157 1 7 . 1 1 70 70 SER HA H 70 4.091 4.091 4.175 -0.084 19946
3158 1 7 . 1 1 70 70 SER CA C 70 61.391 61.391 60.416 0.975 19946
3159 1 7 . 1 1 70 70 SER CB C 70 65.425 65.425 62.203 3.222 19946
3160 1 7 . 1 1 70 70 SER H H 70 7.322 7.322 8.416 -1.094 19946
3161 1 7 . 1 1 71 71 ASN N N 71 118.257 118.257 118.956 -0.699 19946
3162 1 7 . 1 1 71 71 ASN HA H 71 4.177 4.177 4.518 -0.341 19946
3163 1 7 . 1 1 71 71 ASN CA C 71 54.736 54.736 55.282 -0.546 19946
3164 1 7 . 1 1 71 71 ASN CB C 71 38.391 38.391 38.742 -0.351 19946
3165 1 7 . 1 1 71 71 ASN H H 71 7.863 7.863 8.443 -0.580 19946
3166 1 7 . 1 1 72 72 ASN N N 72 115.529 115.529 115.961 -0.432 19946
3167 1 7 . 1 1 72 72 ASN HA H 72 5.127 5.127 4.888 0.239 19946
3168 1 7 . 1 1 72 72 ASN CA C 72 52.173 52.173 53.190 -1.016 19946
3169 1 7 . 1 1 72 72 ASN CB C 72 39.165 39.165 38.831 0.334 19946
3170 1 7 . 1 1 72 72 ASN H H 72 7.238 7.238 7.781 -0.543 19946
3171 1 7 . 1 1 73 73 ALA N N 73 125.388 125.388 123.161 2.227 19946
3172 1 7 . 1 1 73 73 ALA HA H 73 3.639 3.639 4.064 -0.425 19946
3173 1 7 . 1 1 73 73 ALA CA C 73 56.133 56.133 54.091 2.042 19946
3174 1 7 . 1 1 73 73 ALA CB C 73 18.528 18.528 19.482 -0.954 19946
3175 1 7 . 1 1 73 73 ALA H H 73 7.081 7.081 7.467 -0.386 19946
3176 1 7 . 1 1 74 74 ASP N N 74 115.501 115.501 118.927 -3.426 19946
3177 1 7 . 1 1 74 74 ASP HA H 74 4.135 4.135 4.405 -0.270 19946
3178 1 7 . 1 1 74 74 ASP CA C 74 55.891 55.891 56.584 -0.694 19946
3179 1 7 . 1 1 74 74 ASP CB C 74 38.699 38.699 40.400 -1.701 19946
3180 1 7 . 1 1 74 74 ASP H H 74 8.346 8.346 8.501 -0.155 19946
3181 1 7 . 1 1 75 75 LYS N N 75 122.469 122.469 120.355 2.114 19946
3182 1 7 . 1 1 75 75 LYS HA H 75 4.024 4.024 4.079 -0.055 19946
3183 1 7 . 1 1 75 75 LYS CA C 75 57.861 57.861 58.992 -1.131 19946
3184 1 7 . 1 1 75 75 LYS CB C 75 31.660 31.660 32.223 -0.563 19946
3185 1 7 . 1 1 75 75 LYS H H 75 7.583 7.583 7.960 -0.377 19946
3186 1 7 . 1 1 76 76 LEU N N 76 119.196 119.196 119.085 0.111 19946
3187 1 7 . 1 1 76 76 LEU HA H 76 3.570 3.570 3.853 -0.283 19946
3188 1 7 . 1 1 76 76 LEU CA C 76 56.852 56.852 57.779 -0.927 19946
3189 1 7 . 1 1 76 76 LEU CB C 76 39.245 39.245 41.446 -2.200 19946
3190 1 7 . 1 1 76 76 LEU H H 76 8.069 8.069 7.435 0.634 19946
3191 1 7 . 1 1 77 77 ALA N N 77 120.302 120.302 120.318 -0.016 19946
3192 1 7 . 1 1 77 77 ALA HA H 77 3.985 3.985 4.046 -0.061 19946
3193 1 7 . 1 1 77 77 ALA CA C 77 53.794 53.794 54.434 -0.639 19946
3194 1 7 . 1 1 77 77 ALA CB C 77 17.353 17.353 18.465 -1.112 19946
3195 1 7 . 1 1 77 77 ALA H H 77 8.063 8.063 7.662 0.401 19946
3196 1 7 . 1 1 78 78 ALA N N 78 119.602 119.602 118.901 0.701 19946
3197 1 7 . 1 1 78 78 ALA HA H 78 4.138 4.138 4.246 -0.108 19946
3198 1 7 . 1 1 78 78 ALA CA C 78 54.049 54.049 53.503 0.546 19946
3199 1 7 . 1 1 78 78 ALA CB C 78 17.520 17.520 19.170 -1.650 19946
3200 1 7 . 1 1 78 78 ALA H H 78 7.274 7.274 7.482 -0.208 19946
3201 1 7 . 1 1 79 79 ILE N N 79 118.809 118.809 120.554 -1.745 19946
3202 1 7 . 1 1 79 79 ILE HA H 79 3.798 3.798 3.772 0.026 19946
3203 1 7 . 1 1 79 79 ILE CA C 79 63.354 63.354 63.896 -0.542 19946
3204 1 7 . 1 1 79 79 ILE CB C 79 38.422 38.422 38.723 -0.301 19946
3205 1 7 . 1 1 79 79 ILE H H 79 8.170 8.170 8.018 0.152 19946
3206 1 7 . 1 1 80 80 ALA N N 80 118.736 118.736 119.423 -0.687 19946
3207 1 7 . 1 1 80 80 ALA HA H 80 4.412 4.412 4.646 -0.234 19946
3208 1 7 . 1 1 80 80 ALA CA C 80 50.801 50.801 50.350 0.451 19946
3209 1 7 . 1 1 80 80 ALA CB C 80 19.537 19.537 18.245 1.292 19946
3210 1 7 . 1 1 80 80 ALA H H 80 7.857 7.857 7.792 0.065 19946
3211 1 7 . 1 1 81 81 ALA N N 81 124.485 124.485 122.551 1.934 19946
3212 1 7 . 1 1 81 81 ALA HA H 81 4.353 4.353 5.064 -0.711 19946
3213 1 7 . 1 1 81 81 ALA CA C 81 51.305 51.305 49.284 2.021 19946
3214 1 7 . 1 1 81 81 ALA CB C 81 16.511 16.511 18.556 -2.045 19946
3215 1 7 . 1 1 81 81 ALA H H 81 7.191 7.191 7.291 -0.100 19946
3216 1 7 . 1 1 82 82 PRO CA C 82 62.903 62.903 63.017 -0.114 19946
3217 1 7 . 1 1 83 83 ALA N N 83 128.367 128.367 122.410 5.957 19946
3218 1 7 . 1 1 83 83 ALA HA H 83 4.058 4.058 4.092 -0.034 19946
3219 1 7 . 1 1 83 83 ALA CA C 83 52.314 52.314 53.036 -0.722 19946
3220 1 7 . 1 1 83 83 ALA CB C 83 19.001 19.001 19.418 -0.417 19946
3221 1 7 . 1 1 83 83 ALA H H 83 8.472 8.472 7.654 0.818 19946
3222 1 7 . 1 1 84 84 GLU N N 84 122.108 122.108 123.213 -1.105 19946
3223 1 7 . 1 1 84 84 GLU HA H 84 4.164 4.164 4.528 -0.364 19946
3224 1 7 . 1 1 84 84 GLU CA C 84 55.937 55.937 56.634 -0.697 19946
3225 1 7 . 1 1 84 84 GLU CB C 84 30.213 30.213 30.256 -0.043 19946
3226 1 7 . 1 1 84 84 GLU H H 84 8.106 8.106 8.315 -0.209 19946
3227 1 7 . 1 1 85 85 ILE N N 85 122.808 122.808 123.609 -0.801 19946
3228 1 7 . 1 1 85 85 ILE HA H 85 5.211 5.211 4.772 0.439 19946
3229 1 7 . 1 1 85 85 ILE CA C 85 58.365 58.365 58.750 -0.385 19946
3230 1 7 . 1 1 85 85 ILE CB C 85 39.707 39.707 39.545 0.162 19946
3231 1 7 . 1 1 85 85 ILE H H 85 7.850 7.850 8.337 -0.487 19946
3232 1 7 . 1 1 86 86 PHE N N 86 122.937 122.937 120.379 2.558 19946
3233 1 7 . 1 1 86 86 PHE HA H 86 5.388 5.388 4.892 0.496 19946
3234 1 7 . 1 1 86 86 PHE CA C 86 54.509 54.509 57.092 -2.583 19946
3235 1 7 . 1 1 86 86 PHE CB C 86 42.878 42.878 43.786 -0.908 19946
3236 1 7 . 1 1 86 86 PHE H H 86 9.004 9.004 8.068 0.936 19946
3237 1 7 . 1 1 87 87 LEU N N 87 120.712 120.712 118.677 2.035 19946
3238 1 7 . 1 1 87 87 LEU HA H 87 5.295 5.295 5.052 0.243 19946
3239 1 7 . 1 1 87 87 LEU CA C 87 51.810 51.810 53.500 -1.690 19946
3240 1 7 . 1 1 87 87 LEU CB C 87 42.059 42.059 44.963 -2.904 19946
3241 1 7 . 1 1 87 87 LEU H H 87 8.785 8.785 9.196 -0.411 19946
3242 1 7 . 1 1 88 88 LEU N N 88 124.779 124.779 121.622 3.157 19946
3243 1 7 . 1 1 88 88 LEU HA H 88 4.434 4.434 4.405 0.029 19946
3244 1 7 . 1 1 88 88 LEU CA C 88 54.331 54.331 55.552 -1.221 19946
3245 1 7 . 1 1 88 88 LEU CB C 88 42.648 42.648 43.568 -0.920 19946
3246 1 7 . 1 1 88 88 LEU H H 88 8.243 8.243 8.859 -0.616 19946
3247 1 7 . 1 1 89 89 GLU N N 89 112.478 112.478 123.913 -11.435 19946
3248 1 7 . 1 1 89 89 GLU HA H 89 3.881 3.881 4.217 -0.336 19946
3249 1 7 . 1 1 89 89 GLU H H 89 9.343 9.343 8.730 0.613 19946
3250 1 7 . 1 1 90 90 ASP N N 90 120.709 120.709 119.864 0.845 19946
3251 1 7 . 1 1 90 90 ASP HA H 90 4.168 4.168 4.325 -0.157 19946
3252 1 7 . 1 1 90 90 ASP H H 90 9.062 9.062 8.527 0.535 19946
3253 1 7 . 1 1 91 91 GLY N N 91 105.049 105.049 108.539 -3.490 19946
3254 1 7 . 1 1 91 91 GLY CA C 91 46.263 46.263 45.172 1.091 19946
3255 1 7 . 1 1 91 91 GLY H H 91 7.848 7.848 8.552 -0.704 19946
3256 1 7 . 1 1 92 92 ILE N N 92 122.127 122.127 119.733 2.394 19946
3257 1 7 . 1 1 92 92 ILE HA H 92 3.811 3.811 4.028 -0.217 19946
3258 1 7 . 1 1 92 92 ILE CA C 92 62.656 62.656 61.544 1.112 19946
3259 1 7 . 1 1 92 92 ILE CB C 92 37.243 37.243 38.216 -0.973 19946
3260 1 7 . 1 1 92 92 ILE H H 92 8.077 8.077 8.393 -0.316 19946
3261 1 7 . 1 1 93 93 ASP N N 93 127.038 127.038 120.835 6.203 19946
3262 1 7 . 1 1 93 93 ASP HA H 93 4.452 4.452 4.316 0.136 19946
3263 1 7 . 1 1 93 93 ASP CA C 93 57.357 57.357 57.367 -0.010 19946
3264 1 7 . 1 1 93 93 ASP CB C 93 38.194 38.194 40.275 -2.081 19946
3265 1 7 . 1 1 93 93 ASP H H 93 9.094 9.094 8.364 0.730 19946
3266 1 7 . 1 1 94 94 GLY N N 94 111.411 111.411 108.512 2.899 19946
3267 1 7 . 1 1 94 94 GLY CA C 94 44.750 44.750 46.641 -1.891 19946
3268 1 7 . 1 1 94 94 GLY H H 94 8.047 8.047 8.321 -0.274 19946
3269 1 7 . 1 1 95 95 TRP N N 95 127.574 127.574 125.552 2.022 19946
3270 1 7 . 1 1 95 95 TRP HA H 95 3.738 3.738 4.153 -0.415 19946
3271 1 7 . 1 1 95 95 TRP CA C 95 60.852 60.852 59.556 1.296 19946
3272 1 7 . 1 1 95 95 TRP CB C 95 28.613 28.613 29.083 -0.470 19946
3273 1 7 . 1 1 95 95 TRP H H 95 7.918 7.918 8.414 -0.496 19946
3274 1 7 . 1 1 96 96 LYS N N 96 117.374 117.374 118.228 -0.854 19946
3275 1 7 . 1 1 96 96 LYS HA H 96 4.079 4.079 3.755 0.324 19946
3276 1 7 . 1 1 96 96 LYS CA C 96 59.091 59.091 58.537 0.554 19946
3277 1 7 . 1 1 96 96 LYS H H 96 8.625 8.625 8.156 0.469 19946
3278 1 7 . 1 1 97 97 LYS N N 97 123.490 123.490 120.132 3.358 19946
3279 1 7 . 1 1 97 97 LYS HA H 97 4.021 4.021 4.007 0.014 19946
3280 1 7 . 1 1 97 97 LYS CB C 97 31.542 31.542 32.131 -0.589 19946
3281 1 7 . 1 1 97 97 LYS H H 97 8.233 8.233 7.271 0.962 19946
3282 1 7 . 1 1 98 98 ALA N N 98 120.321 120.321 119.188 1.133 19946
3283 1 7 . 1 1 98 98 ALA HA H 98 4.248 4.248 4.363 -0.115 19946
3284 1 7 . 1 1 98 98 ALA CA C 98 51.305 51.305 51.584 -0.279 19946
3285 1 7 . 1 1 98 98 ALA CB C 98 17.744 17.744 19.058 -1.315 19946
3286 1 7 . 1 1 98 98 ALA H H 98 7.480 7.480 7.913 -0.433 19946
3287 1 7 . 1 1 99 99 GLY N N 99 106.984 106.984 107.346 -0.362 19946
3288 1 7 . 1 1 99 99 GLY CA C 99 44.246 44.246 45.498 -1.252 19946
3289 1 7 . 1 1 99 99 GLY H H 99 7.867 7.867 8.284 -0.417 19946
3290 1 7 . 1 1 100 100 LEU N N 100 122.993 122.993 119.641 3.352 19946
3291 1 7 . 1 1 100 100 LEU HA H 100 4.277 4.277 4.416 -0.139 19946
3292 1 7 . 1 1 100 100 LEU CA C 100 52.314 52.314 50.660 1.654 19946
3293 1 7 . 1 1 100 100 LEU CB C 100 36.786 36.786 43.488 -6.702 19946
3294 1 7 . 1 1 100 100 LEU H H 100 6.958 6.958 6.928 0.030 19946
3295 1 7 . 1 1 101 101 PRO HA H 101 4.492 4.492 4.492 0.000 19946
3296 1 7 . 1 1 101 101 PRO CB C 101 32.097 32.097 31.866 0.231 19946
3297 1 7 . 1 1 102 102 VAL N N 102 111.514 111.514 114.160 -2.646 19946
3298 1 7 . 1 1 102 102 VAL HA H 102 4.367 4.367 4.320 0.047 19946
3299 1 7 . 1 1 102 102 VAL CA C 102 58.869 58.869 60.338 -1.469 19946
3300 1 7 . 1 1 102 102 VAL CB C 102 35.351 35.351 32.797 2.554 19946
3301 1 7 . 1 1 102 102 VAL H H 102 7.988 7.988 8.086 -0.098 19946
3302 1 7 . 1 1 103 103 ALA N N 103 126.676 126.676 122.435 4.241 19946
3303 1 7 . 1 1 103 103 ALA HA H 103 4.524 4.524 4.260 0.264 19946
3304 1 7 . 1 1 103 103 ALA CA C 103 49.793 49.793 51.594 -1.801 19946
3305 1 7 . 1 1 103 103 ALA CB C 103 18.600 18.600 17.981 0.619 19946
3306 1 7 . 1 1 103 103 ALA H H 103 8.919 8.919 7.938 0.981 19946
3307 1 7 . 1 1 104 104 VAL N N 104 121.148 121.148 122.371 -1.223 19946
3308 1 7 . 1 1 104 104 VAL HA H 104 4.475 4.475 4.467 0.008 19946
3309 1 7 . 1 1 104 104 VAL CA C 104 59.374 59.374 59.959 -0.585 19946
3310 1 7 . 1 1 104 104 VAL CB C 104 33.884 33.884 34.029 -0.145 19946
3311 1 7 . 1 1 104 104 VAL H H 104 8.241 8.241 7.924 0.317 19946
3312 1 7 . 1 1 105 105 ASN N N 105 123.816 123.816 118.429 5.387 19946
3313 1 7 . 1 1 105 105 ASN HA H 105 4.674 4.674 4.428 0.246 19946
3314 1 7 . 1 1 105 105 ASN CA C 105 53.200 53.200 54.499 -1.299 19946
3315 1 7 . 1 1 105 105 ASN CB C 105 37.959 37.959 37.895 0.064 19946
3316 1 7 . 1 1 105 105 ASN H H 105 8.150 8.150 8.534 -0.384 19946
3317 1 7 . 1 1 106 106 LYS N N 106 123.804 123.804 124.159 -0.355 19946
3318 1 7 . 1 1 106 106 LYS H H 106 8.340 8.340 8.413 -0.073 19946
3319 1 8 . 1 1 2 2 LEU N N 2 120.763 120.763 123.200 -2.437 19946
3320 1 8 . 1 1 2 2 LEU HA H 2 4.384 4.384 4.056 0.328 19946
3321 1 8 . 1 1 2 2 LEU CA C 2 53.827 53.827 55.928 -2.101 19946
3322 1 8 . 1 1 2 2 LEU CB C 2 42.229 42.229 41.987 0.242 19946
3323 1 8 . 1 1 2 2 LEU H H 2 7.888 7.888 8.457 -0.569 19946
3324 1 8 . 1 1 3 3 THR N N 3 118.330 118.330 120.621 -2.291 19946
3325 1 8 . 1 1 3 3 THR HA H 3 4.469 4.469 4.683 -0.214 19946
3326 1 8 . 1 1 3 3 THR CA C 3 61.391 61.391 60.695 0.696 19946
3327 1 8 . 1 1 3 3 THR CB C 3 69.496 69.496 71.482 -1.986 19946
3328 1 8 . 1 1 3 3 THR H H 3 7.905 7.905 7.880 0.025 19946
3329 1 8 . 1 1 4 4 THR N N 4 122.024 122.024 116.403 5.621 19946
3330 1 8 . 1 1 4 4 THR HA H 4 5.171 5.171 5.583 -0.412 19946
3331 1 8 . 1 1 4 4 THR CA C 4 61.595 61.595 60.780 0.815 19946
3332 1 8 . 1 1 4 4 THR CB C 4 69.027 69.027 70.090 -1.063 19946
3333 1 8 . 1 1 4 4 THR H H 4 8.504 8.504 8.366 0.138 19946
3334 1 8 . 1 1 5 5 ILE N N 5 122.667 122.667 121.351 1.316 19946
3335 1 8 . 1 1 5 5 ILE HA H 5 4.973 4.973 4.762 0.211 19946
3336 1 8 . 1 1 5 5 ILE CA C 5 57.971 57.971 59.072 -1.101 19946
3337 1 8 . 1 1 5 5 ILE CB C 5 41.458 41.458 41.388 0.070 19946
3338 1 8 . 1 1 5 5 ILE H H 5 8.903 8.903 8.232 0.671 19946
3339 1 8 . 1 1 6 6 SER N N 6 123.156 123.156 114.110 9.046 19946
3340 1 8 . 1 1 6 6 SER HA H 6 4.785 4.785 4.901 -0.116 19946
3341 1 8 . 1 1 6 6 SER H H 6 9.138 9.138 8.232 0.906 19946
3342 1 8 . 1 1 7 7 PRO HA H 7 4.004 4.004 4.597 -0.593 19946
3343 1 8 . 1 1 7 7 PRO CA C 7 65.510 65.510 63.434 2.076 19946
3344 1 8 . 1 1 7 7 PRO CB C 7 30.924 30.924 30.064 0.860 19946
3345 1 8 . 1 1 8 8 HIS N N 8 114.319 114.319 117.836 -3.517 19946
3346 1 8 . 1 1 8 8 HIS HA H 8 3.989 3.989 4.720 -0.731 19946
3347 1 8 . 1 1 8 8 HIS CA C 8 60.050 60.050 56.891 3.159 19946
3348 1 8 . 1 1 8 8 HIS CB C 8 28.613 28.613 32.454 -3.841 19946
3349 1 8 . 1 1 8 8 HIS H H 8 8.127 8.127 8.503 -0.376 19946
3350 1 8 . 1 1 9 9 ASP N N 9 121.300 121.300 120.870 0.430 19946
3351 1 8 . 1 1 9 9 ASP HA H 9 4.301 4.301 4.658 -0.357 19946
3352 1 8 . 1 1 9 9 ASP CA C 9 56.455 56.455 56.232 0.223 19946
3353 1 8 . 1 1 9 9 ASP CB C 9 38.699 38.699 41.345 -2.646 19946
3354 1 8 . 1 1 9 9 ASP H H 9 7.639 7.639 8.207 -0.568 19946
3355 1 8 . 1 1 10 10 ALA N N 10 123.991 123.991 123.346 0.645 19946
3356 1 8 . 1 1 10 10 ALA HA H 10 3.719 3.719 3.998 -0.279 19946
3357 1 8 . 1 1 10 10 ALA CA C 10 54.331 54.331 54.952 -0.621 19946
3358 1 8 . 1 1 10 10 ALA CB C 10 17.549 17.549 18.243 -0.694 19946
3359 1 8 . 1 1 10 10 ALA H H 10 8.820 8.820 7.527 1.293 19946
3360 1 8 . 1 1 11 11 GLN N N 11 118.128 118.128 116.828 1.300 19946
3361 1 8 . 1 1 11 11 GLN HA H 11 3.933 3.933 4.156 -0.223 19946
3362 1 8 . 1 1 11 11 GLN CA C 11 59.389 59.389 57.959 1.430 19946
3363 1 8 . 1 1 11 11 GLN CB C 11 27.948 27.948 28.514 -0.566 19946
3364 1 8 . 1 1 11 11 GLN H H 11 8.353 8.353 8.423 -0.070 19946
3365 1 8 . 1 1 12 12 GLU N N 12 119.307 119.307 119.654 -0.347 19946
3366 1 8 . 1 1 12 12 GLU HA H 12 4.023 4.023 4.276 -0.253 19946
3367 1 8 . 1 1 12 12 GLU CA C 12 58.476 58.476 58.082 0.394 19946
3368 1 8 . 1 1 12 12 GLU CB C 12 28.532 28.532 29.851 -1.319 19946
3369 1 8 . 1 1 12 12 GLU H H 12 7.197 7.197 8.227 -1.030 19946
3370 1 8 . 1 1 13 13 LEU N N 13 120.635 120.635 118.329 2.306 19946
3371 1 8 . 1 1 13 13 LEU HA H 13 3.821 3.821 4.169 -0.348 19946
3372 1 8 . 1 1 13 13 LEU CA C 13 57.065 57.065 57.269 -0.204 19946
3373 1 8 . 1 1 13 13 LEU CB C 13 40.890 40.890 42.059 -1.169 19946
3374 1 8 . 1 1 13 13 LEU H H 13 7.554 7.554 7.161 0.393 19946
3375 1 8 . 1 1 14 14 ILE N N 14 123.021 123.021 118.709 4.312 19946
3376 1 8 . 1 1 14 14 ILE HA H 14 3.827 3.827 3.946 -0.119 19946
3377 1 8 . 1 1 14 14 ILE CA C 14 64.053 64.053 63.059 0.994 19946
3378 1 8 . 1 1 14 14 ILE CB C 14 38.115 38.115 36.693 1.422 19946
3379 1 8 . 1 1 14 14 ILE H H 14 8.710 8.710 7.977 0.733 19946
3380 1 8 . 1 1 15 15 ALA N N 15 124.504 124.504 120.282 4.222 19946
3381 1 8 . 1 1 15 15 ALA HA H 15 4.115 4.115 4.204 -0.089 19946
3382 1 8 . 1 1 15 15 ALA CA C 15 54.257 54.257 53.461 0.796 19946
3383 1 8 . 1 1 15 15 ALA CB C 15 17.040 17.040 18.404 -1.364 19946
3384 1 8 . 1 1 15 15 ALA H H 15 7.758 7.758 7.723 0.035 19946
3385 1 8 . 1 1 16 16 ARG N N 16 115.990 115.990 117.339 -1.349 19946
3386 1 8 . 1 1 16 16 ARG HA H 16 4.348 4.348 4.340 0.008 19946
3387 1 8 . 1 1 16 16 ARG CA C 16 55.416 55.416 56.669 -1.253 19946
3388 1 8 . 1 1 16 16 ARG CB C 16 29.762 29.762 31.123 -1.361 19946
3389 1 8 . 1 1 16 16 ARG H H 16 7.252 7.252 7.856 -0.604 19946
3390 1 8 . 1 1 17 17 GLY N N 17 107.981 107.981 105.346 2.635 19946
3391 1 8 . 1 1 17 17 GLY CA C 17 44.854 44.854 44.457 0.397 19946
3392 1 8 . 1 1 17 17 GLY H H 17 7.748 7.748 7.309 0.439 19946
3393 1 8 . 1 1 18 18 ALA N N 18 123.914 123.914 124.828 -0.914 19946
3394 1 8 . 1 1 18 18 ALA HA H 18 4.221 4.221 4.433 -0.212 19946
3395 1 8 . 1 1 18 18 ALA CA C 18 52.270 52.270 52.064 0.206 19946
3396 1 8 . 1 1 18 18 ALA CB C 18 18.638 18.638 20.122 -1.484 19946
3397 1 8 . 1 1 18 18 ALA H H 18 7.940 7.940 8.062 -0.122 19946
3398 1 8 . 1 1 19 19 LYS N N 19 119.436 119.436 121.353 -1.917 19946
3399 1 8 . 1 1 19 19 LYS HA H 19 4.301 4.301 4.392 -0.091 19946
3400 1 8 . 1 1 19 19 LYS CA C 19 53.105 53.105 55.614 -2.509 19946
3401 1 8 . 1 1 19 19 LYS CB C 19 32.856 32.856 34.945 -2.089 19946
3402 1 8 . 1 1 19 19 LYS H H 19 7.565 7.565 8.445 -0.880 19946
3403 1 8 . 1 1 20 20 LEU N N 20 127.401 127.401 120.818 6.583 19946
3404 1 8 . 1 1 20 20 LEU HA H 20 5.042 5.042 4.603 0.439 19946
3405 1 8 . 1 1 20 20 LEU CA C 20 52.314 52.314 54.188 -1.874 19946
3406 1 8 . 1 1 20 20 LEU CB C 20 43.234 43.234 44.313 -1.079 19946
3407 1 8 . 1 1 20 20 LEU H H 20 8.727 8.727 8.256 0.471 19946
3408 1 8 . 1 1 21 21 ILE N N 21 128.186 128.186 124.125 4.061 19946
3409 1 8 . 1 1 21 21 ILE HA H 21 4.547 4.547 4.467 0.080 19946
3410 1 8 . 1 1 21 21 ILE CA C 21 59.589 59.589 59.736 -0.147 19946
3411 1 8 . 1 1 21 21 ILE CB C 21 38.545 38.545 42.098 -3.553 19946
3412 1 8 . 1 1 21 21 ILE H H 21 9.366 9.366 7.757 1.609 19946
3413 1 8 . 1 1 22 22 ASP N N 22 129.968 129.968 121.727 8.241 19946
3414 1 8 . 1 1 22 22 ASP HA H 22 3.803 3.803 5.044 -1.241 19946
3415 1 8 . 1 1 22 22 ASP CA C 22 51.435 51.435 53.118 -1.683 19946
3416 1 8 . 1 1 22 22 ASP CB C 22 42.062 42.062 44.898 -2.837 19946
3417 1 8 . 1 1 22 22 ASP H H 22 8.583 8.583 8.025 0.558 19946
3418 1 8 . 1 1 23 23 ILE N N 23 116.266 116.266 117.672 -1.406 19946
3419 1 8 . 1 1 23 23 ILE HA H 23 5.229 5.229 4.396 0.833 19946
3420 1 8 . 1 1 23 23 ILE CA C 23 59.374 59.374 59.786 -0.412 19946
3421 1 8 . 1 1 23 23 ILE CB C 23 37.327 37.327 36.880 0.447 19946
3422 1 8 . 1 1 23 23 ILE H H 23 7.836 7.836 8.513 -0.677 19946
3423 1 8 . 1 1 24 24 ARG N N 24 125.001 125.001 121.091 3.910 19946
3424 1 8 . 1 1 24 24 ARG HA H 24 4.116 4.116 4.195 -0.079 19946
3425 1 8 . 1 1 24 24 ARG CA C 24 55.943 55.943 56.836 -0.892 19946
3426 1 8 . 1 1 24 24 ARG CB C 24 30.135 30.135 30.702 -0.567 19946
3427 1 8 . 1 1 24 24 ARG H H 24 8.195 8.195 7.257 0.938 19946
3428 1 8 . 1 1 25 25 ASP N N 25 112.839 112.839 118.079 -5.240 19946
3429 1 8 . 1 1 25 25 ASP HA H 25 4.545 4.545 4.664 -0.119 19946
3430 1 8 . 1 1 25 25 ASP CA C 25 53.870 53.870 53.316 0.554 19946
3431 1 8 . 1 1 25 25 ASP CB C 25 41.327 41.327 42.387 -1.060 19946
3432 1 8 . 1 1 25 25 ASP H H 25 7.660 7.660 8.200 -0.540 19946
3433 1 8 . 1 1 26 26 ALA N N 26 122.145 122.145 123.282 -1.137 19946
3434 1 8 . 1 1 26 26 ALA HA H 26 3.897 3.897 4.139 -0.242 19946
3435 1 8 . 1 1 26 26 ALA CA C 26 54.958 54.958 54.938 0.021 19946
3436 1 8 . 1 1 26 26 ALA CB C 26 17.520 17.520 19.171 -1.651 19946
3437 1 8 . 1 1 26 26 ALA H H 26 8.766 8.766 8.509 0.257 19946
3438 1 8 . 1 1 27 27 ASP N N 27 115.380 115.380 118.793 -3.413 19946
3439 1 8 . 1 1 27 27 ASP HA H 27 4.299 4.299 4.345 -0.046 19946
3440 1 8 . 1 1 27 27 ASP CA C 27 56.451 56.451 56.979 -0.528 19946
3441 1 8 . 1 1 27 27 ASP CB C 27 39.156 39.156 40.677 -1.521 19946
3442 1 8 . 1 1 27 27 ASP H H 27 8.686 8.686 8.577 0.109 19946
3443 1 8 . 1 1 28 28 GLU N N 28 120.081 120.081 117.853 2.228 19946
3444 1 8 . 1 1 28 28 GLU HA H 28 4.086 4.086 4.153 -0.067 19946
3445 1 8 . 1 1 28 28 GLU CA C 28 58.389 58.389 57.769 0.620 19946
3446 1 8 . 1 1 28 28 GLU CB C 28 28.728 28.728 29.945 -1.217 19946
3447 1 8 . 1 1 28 28 GLU H H 28 7.397 7.397 7.956 -0.559 19946
3448 1 8 . 1 1 29 29 TYR N N 29 121.205 121.205 118.244 2.961 19946
3449 1 8 . 1 1 29 29 TYR HA H 29 4.083 4.083 4.531 -0.448 19946
3450 1 8 . 1 1 29 29 TYR CA C 29 60.378 60.378 57.694 2.684 19946
3451 1 8 . 1 1 29 29 TYR CB C 29 38.699 38.699 39.359 -0.660 19946
3452 1 8 . 1 1 29 29 TYR H H 29 7.506 7.506 8.361 -0.855 19946
3453 1 8 . 1 1 30 30 LEU N N 30 118.828 118.828 121.298 -2.470 19946
3454 1 8 . 1 1 30 30 LEU HA H 30 3.850 3.850 4.088 -0.238 19946
3455 1 8 . 1 1 30 30 LEU CA C 30 56.348 56.348 57.556 -1.208 19946
3456 1 8 . 1 1 30 30 LEU CB C 30 41.220 41.220 42.254 -1.034 19946
3457 1 8 . 1 1 30 30 LEU H H 30 8.211 8.211 7.274 0.937 19946
3458 1 8 . 1 1 31 31 ARG N N 31 118.220 118.220 118.036 0.184 19946
3459 1 8 . 1 1 31 31 ARG HA H 31 4.101 4.101 4.233 -0.132 19946
3460 1 8 . 1 1 31 31 ARG CA C 31 58.365 58.365 57.865 0.500 19946
3461 1 8 . 1 1 31 31 ARG CB C 31 30.074 30.074 31.409 -1.335 19946
3462 1 8 . 1 1 31 31 ARG H H 31 7.120 7.120 8.136 -1.016 19946
3463 1 8 . 1 1 32 32 GLU N N 32 117.980 117.980 117.234 0.746 19946
3464 1 8 . 1 1 32 32 GLU HA H 32 4.884 4.884 4.261 0.623 19946
3465 1 8 . 1 1 32 32 GLU CA C 32 55.339 55.339 56.709 -1.370 19946
3466 1 8 . 1 1 32 32 GLU CB C 32 31.698 31.698 30.508 1.190 19946
3467 1 8 . 1 1 32 32 GLU H H 32 7.506 7.506 8.402 -0.896 19946
3468 1 8 . 1 1 33 33 HIS N N 33 118.257 118.257 118.911 -0.654 19946
3469 1 8 . 1 1 33 33 HIS HA H 33 4.643 4.643 4.024 0.619 19946
3470 1 8 . 1 1 33 33 HIS CA C 33 53.766 53.766 54.701 -0.935 19946
3471 1 8 . 1 1 33 33 HIS CB C 33 29.940 29.940 31.080 -1.140 19946
3472 1 8 . 1 1 33 33 HIS H H 33 8.269 8.269 8.596 -0.327 19946
3473 1 8 . 1 1 34 34 ILE N N 34 127.809 127.809 118.145 9.664 19946
3474 1 8 . 1 1 34 34 ILE HA H 34 3.920 3.920 3.875 0.045 19946
3475 1 8 . 1 1 34 34 ILE CA C 34 59.648 59.648 62.266 -2.618 19946
3476 1 8 . 1 1 34 34 ILE CB C 34 37.959 37.959 38.746 -0.787 19946
3477 1 8 . 1 1 34 34 ILE H H 34 9.989 9.989 8.036 1.953 19946
3478 1 8 . 1 1 35 35 PRO HA H 35 4.198 4.198 4.358 -0.160 19946
3479 1 8 . 1 1 36 36 GLU N N 36 114.414 114.414 122.199 -7.785 19946
3480 1 8 . 1 1 36 36 GLU HA H 36 4.082 4.082 3.859 0.223 19946
3481 1 8 . 1 1 36 36 GLU CA C 36 57.861 57.861 57.529 0.332 19946
3482 1 8 . 1 1 36 36 GLU CB C 36 28.109 28.109 28.736 -0.627 19946
3483 1 8 . 1 1 36 36 GLU H H 36 8.557 8.557 8.315 0.242 19946
3484 1 8 . 1 1 37 37 ALA N N 37 122.882 122.882 125.350 -2.468 19946
3485 1 8 . 1 1 37 37 ALA HA H 37 4.439 4.439 4.795 -0.356 19946
3486 1 8 . 1 1 37 37 ALA CA C 37 52.005 52.005 51.259 0.746 19946
3487 1 8 . 1 1 37 37 ALA CB C 37 20.438 20.438 22.389 -1.951 19946
3488 1 8 . 1 1 37 37 ALA H H 37 8.096 8.096 8.172 -0.076 19946
3489 1 8 . 1 1 38 38 ASP N N 38 124.471 124.471 118.599 5.872 19946
3490 1 8 . 1 1 38 38 ASP HA H 38 4.844 4.844 5.029 -0.185 19946
3491 1 8 . 1 1 38 38 ASP CA C 38 52.614 52.614 54.177 -1.563 19946
3492 1 8 . 1 1 38 38 ASP CB C 38 44.407 44.407 44.920 -0.513 19946
3493 1 8 . 1 1 38 38 ASP H H 38 9.004 9.004 8.174 0.830 19946
3494 1 8 . 1 1 39 39 LEU N N 39 123.936 123.936 125.721 -1.785 19946
3495 1 8 . 1 1 39 39 LEU HA H 39 4.328 4.328 4.293 0.035 19946
3496 1 8 . 1 1 39 39 LEU CA C 39 54.037 54.037 55.465 -1.428 19946
3497 1 8 . 1 1 39 39 LEU CB C 39 41.220 41.220 42.386 -1.166 19946
3498 1 8 . 1 1 39 39 LEU H H 39 8.125 8.125 8.137 -0.012 19946
3499 1 8 . 1 1 40 40 ALA N N 40 131.297 131.297 128.696 2.601 19946
3500 1 8 . 1 1 40 40 ALA HA H 40 4.408 4.408 4.654 -0.246 19946
3501 1 8 . 1 1 40 40 ALA CA C 40 48.784 48.784 50.647 -1.863 19946
3502 1 8 . 1 1 40 40 ALA CB C 40 17.979 17.979 19.267 -1.288 19946
3503 1 8 . 1 1 40 40 ALA H H 40 8.654 8.654 8.252 0.402 19946
3504 1 8 . 1 1 41 41 PRO HA H 41 4.101 4.101 4.685 -0.584 19946
3505 1 8 . 1 1 41 41 PRO CA C 41 61.391 61.391 62.311 -0.920 19946
3506 1 8 . 1 1 41 41 PRO CB C 41 32.097 32.097 32.628 -0.531 19946
3507 1 8 . 1 1 42 42 LEU N N 42 125.312 125.312 120.285 5.027 19946
3508 1 8 . 1 1 42 42 LEU HA H 42 3.871 3.871 3.824 0.047 19946
3509 1 8 . 1 1 42 42 LEU CA C 42 57.861 57.861 58.694 -0.833 19946
3510 1 8 . 1 1 42 42 LEU CB C 42 40.941 40.941 41.317 -0.376 19946
3511 1 8 . 1 1 42 42 LEU H H 42 8.285 8.285 8.454 -0.169 19946
3512 1 8 . 1 1 43 43 SER N N 43 110.669 110.669 113.833 -3.164 19946
3513 1 8 . 1 1 43 43 SER HA H 43 4.106 4.106 4.155 -0.049 19946
3514 1 8 . 1 1 43 43 SER CA C 43 60.497 60.497 62.075 -1.578 19946
3515 1 8 . 1 1 43 43 SER CB C 43 61.391 61.391 62.831 -1.440 19946
3516 1 8 . 1 1 43 43 SER H H 43 8.453 8.453 8.100 0.353 19946
3517 1 8 . 1 1 44 44 VAL N N 44 123.933 123.933 121.635 2.298 19946
3518 1 8 . 1 1 44 44 VAL HA H 44 3.821 3.821 3.805 0.016 19946
3519 1 8 . 1 1 44 44 VAL CA C 44 64.752 64.752 65.779 -1.027 19946
3520 1 8 . 1 1 44 44 VAL CB C 44 31.135 31.135 31.501 -0.366 19946
3521 1 8 . 1 1 44 44 VAL H H 44 7.156 7.156 8.058 -0.902 19946
3522 1 8 . 1 1 45 45 LEU N N 45 121.150 121.150 119.434 1.716 19946
3523 1 8 . 1 1 45 45 LEU HA H 45 3.767 3.767 4.057 -0.290 19946
3524 1 8 . 1 1 45 45 LEU CA C 45 56.599 56.599 57.724 -1.125 19946
3525 1 8 . 1 1 45 45 LEU CB C 45 40.890 40.890 41.289 -0.399 19946
3526 1 8 . 1 1 45 45 LEU H H 45 7.997 7.997 8.951 -0.954 19946
3527 1 8 . 1 1 46 46 GLU N N 46 116.256 116.256 118.700 -2.444 19946
3528 1 8 . 1 1 46 46 GLU HA H 46 3.678 3.678 4.243 -0.565 19946
3529 1 8 . 1 1 46 46 GLU CA C 46 58.365 58.365 58.347 0.018 19946
3530 1 8 . 1 1 46 46 GLU CB C 46 29.622 29.622 30.081 -0.459 19946
3531 1 8 . 1 1 46 46 GLU H H 46 8.501 8.501 8.206 0.295 19946
3532 1 8 . 1 1 47 47 GLN N N 47 117.261 117.261 117.486 -0.225 19946
3533 1 8 . 1 1 47 47 GLN HA H 47 4.216 4.216 4.255 -0.039 19946
3534 1 8 . 1 1 47 47 GLN CA C 47 56.852 56.852 58.240 -1.388 19946
3535 1 8 . 1 1 47 47 GLN CB C 47 29.119 29.119 29.730 -0.611 19946
3536 1 8 . 1 1 47 47 GLN H H 47 7.407 7.407 8.221 -0.814 19946
3537 1 8 . 1 1 48 48 SER N N 48 111.890 111.890 111.921 -0.031 19946
3538 1 8 . 1 1 48 48 SER HA H 48 4.641 4.641 4.624 0.017 19946
3539 1 8 . 1 1 48 48 SER CA C 48 57.956 57.956 58.086 -0.130 19946
3540 1 8 . 1 1 48 48 SER CB C 48 63.912 63.912 65.446 -1.534 19946
3541 1 8 . 1 1 48 48 SER H H 48 8.566 8.566 8.397 0.169 19946
3542 1 8 . 1 1 49 49 GLY N N 49 111.545 111.545 109.510 2.035 19946
3543 1 8 . 1 1 49 49 GLY CA C 49 43.894 43.894 44.576 -0.682 19946
3544 1 8 . 1 1 49 49 GLY H H 49 7.836 7.836 7.920 -0.084 19946
3545 1 8 . 1 1 50 50 LEU N N 50 121.541 121.541 122.722 -1.181 19946
3546 1 8 . 1 1 50 50 LEU HA H 50 4.239 4.239 4.364 -0.125 19946
3547 1 8 . 1 1 50 50 LEU CA C 50 51.985 51.985 54.640 -2.655 19946
3548 1 8 . 1 1 50 50 LEU CB C 50 42.648 42.648 42.116 0.532 19946
3549 1 8 . 1 1 50 50 LEU H H 50 8.564 8.564 8.325 0.239 19946
3550 1 8 . 1 1 51 51 PRO HA H 51 4.243 4.243 4.562 -0.319 19946
3551 1 8 . 1 1 51 51 PRO CB C 51 31.639 31.639 32.834 -1.195 19946
3552 1 8 . 1 1 52 52 ALA N N 52 127.008 127.008 129.247 -2.239 19946
3553 1 8 . 1 1 52 52 ALA HA H 52 3.790 3.790 3.974 -0.184 19946
3554 1 8 . 1 1 52 52 ALA CA C 52 54.835 54.835 55.306 -0.471 19946
3555 1 8 . 1 1 52 52 ALA CB C 52 17.715 17.715 18.444 -0.729 19946
3556 1 8 . 1 1 52 52 ALA H H 52 8.564 8.564 8.805 -0.241 19946
3557 1 8 . 1 1 53 53 LYS N N 53 114.535 114.535 115.927 -1.392 19946
3558 1 8 . 1 1 53 53 LYS HA H 53 4.106 4.106 4.096 0.010 19946
3559 1 8 . 1 1 53 53 LYS CA C 53 56.852 56.852 58.356 -1.504 19946
3560 1 8 . 1 1 53 53 LYS CB C 53 31.386 31.386 31.715 -0.330 19946
3561 1 8 . 1 1 53 53 LYS H H 53 8.364 8.364 8.434 -0.070 19946
3562 1 8 . 1 1 54 54 LEU N N 54 118.515 118.515 116.460 2.055 19946
3563 1 8 . 1 1 54 54 LEU HA H 54 4.247 4.247 4.536 -0.289 19946
3564 1 8 . 1 1 54 54 LEU CA C 54 53.338 53.338 53.965 -0.627 19946
3565 1 8 . 1 1 54 54 LEU CB C 54 40.890 40.890 41.943 -1.053 19946
3566 1 8 . 1 1 54 54 LEU H H 54 7.745 7.745 7.831 -0.086 19946
3567 1 8 . 1 1 55 55 ARG N N 55 117.612 117.612 121.004 -3.392 19946
3568 1 8 . 1 1 55 55 ARG HA H 55 3.927 3.927 4.666 -0.739 19946
3569 1 8 . 1 1 55 55 ARG CA C 55 56.832 56.832 55.105 1.727 19946
3570 1 8 . 1 1 55 55 ARG CB C 55 28.610 28.610 32.700 -4.090 19946
3571 1 8 . 1 1 55 55 ARG H H 55 6.938 6.938 8.287 -1.349 19946
3572 1 8 . 1 1 56 56 HIS N N 56 123.269 123.269 121.015 2.254 19946
3573 1 8 . 1 1 56 56 HIS HA H 56 4.614 4.614 4.711 -0.097 19946
3574 1 8 . 1 1 56 56 HIS CA C 56 54.835 54.835 55.705 -0.870 19946
3575 1 8 . 1 1 56 56 HIS CB C 56 32.648 32.648 32.148 0.500 19946
3576 1 8 . 1 1 56 56 HIS H H 56 7.237 7.237 8.423 -1.186 19946
3577 1 8 . 1 1 57 57 GLU N N 57 120.895 120.895 120.361 0.534 19946
3578 1 8 . 1 1 57 57 GLU HA H 57 3.976 3.976 4.199 -0.223 19946
3579 1 8 . 1 1 57 57 GLU CA C 57 58.871 58.871 58.579 0.292 19946
3580 1 8 . 1 1 57 57 GLU CB C 57 29.158 29.158 30.403 -1.245 19946
3581 1 8 . 1 1 57 57 GLU H H 57 7.625 7.625 8.856 -1.231 19946
3582 1 8 . 1 1 58 58 GLN N N 58 118.485 118.485 112.137 6.348 19946
3583 1 8 . 1 1 58 58 GLN HA H 58 5.425 5.425 5.422 0.003 19946
3584 1 8 . 1 1 58 58 GLN CA C 58 54.910 54.910 54.235 0.675 19946
3585 1 8 . 1 1 58 58 GLN CB C 58 32.285 32.285 32.739 -0.454 19946
3586 1 8 . 1 1 58 58 GLN H H 58 8.335 8.335 7.657 0.678 19946
3587 1 8 . 1 1 59 59 ILE N N 59 123.505 123.505 119.589 3.916 19946
3588 1 8 . 1 1 59 59 ILE HA H 59 4.492 4.492 4.684 -0.192 19946
3589 1 8 . 1 1 59 59 ILE CA C 59 58.869 58.869 59.480 -0.611 19946
3590 1 8 . 1 1 59 59 ILE CB C 59 42.332 42.332 42.229 0.103 19946
3591 1 8 . 1 1 59 59 ILE H H 59 8.704 8.704 9.072 -0.368 19946
3592 1 8 . 1 1 60 60 ILE N N 60 126.464 126.464 122.519 3.945 19946
3593 1 8 . 1 1 60 60 ILE HA H 60 4.954 4.954 4.617 0.337 19946
3594 1 8 . 1 1 60 60 ILE CA C 60 57.357 57.357 59.601 -2.244 19946
3595 1 8 . 1 1 60 60 ILE CB C 60 39.131 39.131 41.566 -2.435 19946
3596 1 8 . 1 1 60 60 ILE H H 60 9.006 9.006 7.973 1.033 19946
3597 1 8 . 1 1 61 61 PHE N N 61 124.441 124.441 117.853 6.588 19946
3598 1 8 . 1 1 61 61 PHE HA H 61 5.795 5.795 5.110 0.685 19946
3599 1 8 . 1 1 61 61 PHE CA C 61 56.131 56.131 57.720 -1.589 19946
3600 1 8 . 1 1 61 61 PHE CB C 61 42.879 42.879 42.206 0.673 19946
3601 1 8 . 1 1 61 61 PHE H H 61 8.938 8.938 8.339 0.599 19946
3602 1 8 . 1 1 62 62 HIS N N 62 117.494 117.494 120.512 -3.018 19946
3603 1 8 . 1 1 62 62 HIS HA H 62 5.928 5.928 5.065 0.863 19946
3604 1 8 . 1 1 62 62 HIS CA C 62 53.322 53.322 55.323 -2.001 19946
3605 1 8 . 1 1 62 62 HIS CB C 62 35.673 35.673 34.323 1.350 19946
3606 1 8 . 1 1 62 62 HIS H H 62 9.230 9.230 8.290 0.940 19946
3607 1 8 . 1 1 63 63 CYS N N 63 120.220 120.220 121.101 -0.881 19946
3608 1 8 . 1 1 63 63 CYS HA H 63 5.033 5.033 4.659 0.374 19946
3609 1 8 . 1 1 63 63 CYS CA C 63 56.131 56.131 58.453 -2.322 19946
3610 1 8 . 1 1 63 63 CYS CB C 63 28.109 28.109 28.856 -0.747 19946
3611 1 8 . 1 1 63 63 CYS H H 63 8.131 8.131 9.032 -0.901 19946
3612 1 8 . 1 1 65 65 ALA N N 65 119.272 119.272 121.896 -2.624 19946
3613 1 8 . 1 1 65 65 ALA HA H 65 5.063 5.063 4.545 0.518 19946
3614 1 8 . 1 1 65 65 ALA CA C 65 49.793 49.793 52.112 -2.320 19946
3615 1 8 . 1 1 65 65 ALA CB C 65 19.775 19.775 19.956 -0.181 19946
3616 1 8 . 1 1 65 65 ALA H H 65 8.967 8.967 7.986 0.981 19946
3617 1 8 . 1 1 66 66 GLY N N 66 113.296 113.296 110.168 3.128 19946
3618 1 8 . 1 1 66 66 GLY CA C 66 44.934 44.934 46.269 -1.335 19946
3619 1 8 . 1 1 66 66 GLY H H 66 8.778 8.778 8.615 0.163 19946
3620 1 8 . 1 1 67 67 LYS N N 67 121.300 121.300 120.756 0.544 19946
3621 1 8 . 1 1 67 67 LYS HA H 67 4.211 4.211 4.402 -0.191 19946
3622 1 8 . 1 1 67 67 LYS H H 67 8.111 8.111 8.074 0.037 19946
3623 1 8 . 1 1 68 68 ARG N N 68 126.092 126.092 118.462 7.630 19946
3624 1 8 . 1 1 68 68 ARG H H 68 9.067 9.067 8.159 0.908 19946
3625 1 8 . 1 1 69 69 THR N N 69 117.153 117.153 114.319 2.834 19946
3626 1 8 . 1 1 69 69 THR HA H 69 3.576 3.576 4.093 -0.517 19946
3627 1 8 . 1 1 69 69 THR CA C 69 65.397 65.397 65.165 0.232 19946
3628 1 8 . 1 1 69 69 THR CB C 69 66.938 66.938 69.134 -2.196 19946
3629 1 8 . 1 1 69 69 THR H H 69 10.233 10.233 8.294 1.939 19946
3630 1 8 . 1 1 70 70 SER N N 70 113.686 113.686 116.097 -2.411 19946
3631 1 8 . 1 1 70 70 SER HA H 70 4.091 4.091 4.116 -0.025 19946
3632 1 8 . 1 1 70 70 SER CA C 70 61.391 61.391 61.111 0.280 19946
3633 1 8 . 1 1 70 70 SER CB C 70 65.425 65.425 62.938 2.487 19946
3634 1 8 . 1 1 70 70 SER H H 70 7.322 7.322 8.347 -1.025 19946
3635 1 8 . 1 1 71 71 ASN N N 71 118.257 118.257 120.643 -2.386 19946
3636 1 8 . 1 1 71 71 ASN HA H 71 4.177 4.177 4.521 -0.344 19946
3637 1 8 . 1 1 71 71 ASN CA C 71 54.736 54.736 55.469 -0.733 19946
3638 1 8 . 1 1 71 71 ASN CB C 71 38.391 38.391 38.514 -0.123 19946
3639 1 8 . 1 1 71 71 ASN H H 71 7.863 7.863 7.815 0.048 19946
3640 1 8 . 1 1 72 72 ASN N N 72 115.529 115.529 116.374 -0.845 19946
3641 1 8 . 1 1 72 72 ASN HA H 72 5.127 5.127 4.840 0.287 19946
3642 1 8 . 1 1 72 72 ASN CA C 72 52.173 52.173 52.260 -0.087 19946
3643 1 8 . 1 1 72 72 ASN CB C 72 39.165 39.165 38.045 1.120 19946
3644 1 8 . 1 1 72 72 ASN H H 72 7.238 7.238 8.021 -0.783 19946
3645 1 8 . 1 1 73 73 ALA N N 73 125.388 125.388 122.926 2.462 19946
3646 1 8 . 1 1 73 73 ALA HA H 73 3.639 3.639 4.228 -0.589 19946
3647 1 8 . 1 1 73 73 ALA CA C 73 56.133 56.133 53.438 2.695 19946
3648 1 8 . 1 1 73 73 ALA CB C 73 18.528 18.528 19.337 -0.808 19946
3649 1 8 . 1 1 73 73 ALA H H 73 7.081 7.081 7.968 -0.887 19946
3650 1 8 . 1 1 74 74 ASP N N 74 115.501 115.501 119.535 -4.034 19946
3651 1 8 . 1 1 74 74 ASP HA H 74 4.135 4.135 4.335 -0.200 19946
3652 1 8 . 1 1 74 74 ASP CA C 74 55.891 55.891 57.313 -1.422 19946
3653 1 8 . 1 1 74 74 ASP CB C 74 38.699 38.699 40.698 -1.999 19946
3654 1 8 . 1 1 74 74 ASP H H 74 8.346 8.346 8.619 -0.273 19946
3655 1 8 . 1 1 75 75 LYS N N 75 122.469 122.469 119.728 2.741 19946
3656 1 8 . 1 1 75 75 LYS HA H 75 4.024 4.024 4.064 -0.040 19946
3657 1 8 . 1 1 75 75 LYS CA C 75 57.861 57.861 59.047 -1.186 19946
3658 1 8 . 1 1 75 75 LYS CB C 75 31.660 31.660 31.725 -0.065 19946
3659 1 8 . 1 1 75 75 LYS H H 75 7.583 7.583 8.000 -0.416 19946
3660 1 8 . 1 1 76 76 LEU N N 76 119.196 119.196 120.330 -1.134 19946
3661 1 8 . 1 1 76 76 LEU HA H 76 3.570 3.570 3.686 -0.116 19946
3662 1 8 . 1 1 76 76 LEU CA C 76 56.852 56.852 57.295 -0.443 19946
3663 1 8 . 1 1 76 76 LEU CB C 76 39.245 39.245 41.189 -1.944 19946
3664 1 8 . 1 1 76 76 LEU H H 76 8.069 8.069 7.510 0.559 19946
3665 1 8 . 1 1 77 77 ALA N N 77 120.302 120.302 121.060 -0.758 19946
3666 1 8 . 1 1 77 77 ALA HA H 77 3.985 3.985 3.823 0.162 19946
3667 1 8 . 1 1 77 77 ALA CA C 77 53.794 53.794 54.772 -0.978 19946
3668 1 8 . 1 1 77 77 ALA CB C 77 17.353 17.353 17.882 -0.529 19946
3669 1 8 . 1 1 77 77 ALA H H 77 8.063 8.063 7.390 0.673 19946
3670 1 8 . 1 1 78 78 ALA N N 78 119.602 119.602 121.822 -2.220 19946
3671 1 8 . 1 1 78 78 ALA HA H 78 4.138 4.138 3.982 0.156 19946
3672 1 8 . 1 1 78 78 ALA CA C 78 54.049 54.049 54.741 -0.692 19946
3673 1 8 . 1 1 78 78 ALA CB C 78 17.520 17.520 18.317 -0.797 19946
3674 1 8 . 1 1 78 78 ALA H H 78 7.274 7.274 7.787 -0.513 19946
3675 1 8 . 1 1 79 79 ILE N N 79 118.809 118.809 116.774 2.035 19946
3676 1 8 . 1 1 79 79 ILE HA H 79 3.798 3.798 3.731 0.067 19946
3677 1 8 . 1 1 79 79 ILE CA C 79 63.354 63.354 64.101 -0.747 19946
3678 1 8 . 1 1 79 79 ILE CB C 79 38.422 38.422 38.107 0.315 19946
3679 1 8 . 1 1 79 79 ILE H H 79 8.170 8.170 8.600 -0.430 19946
3680 1 8 . 1 1 80 80 ALA N N 80 118.736 118.736 119.511 -0.775 19946
3681 1 8 . 1 1 80 80 ALA HA H 80 4.412 4.412 4.663 -0.251 19946
3682 1 8 . 1 1 80 80 ALA CA C 80 50.801 50.801 50.585 0.216 19946
3683 1 8 . 1 1 80 80 ALA CB C 80 19.537 19.537 18.462 1.075 19946
3684 1 8 . 1 1 80 80 ALA H H 80 7.857 7.857 7.671 0.186 19946
3685 1 8 . 1 1 81 81 ALA N N 81 124.485 124.485 122.525 1.960 19946
3686 1 8 . 1 1 81 81 ALA HA H 81 4.353 4.353 4.927 -0.574 19946
3687 1 8 . 1 1 81 81 ALA CA C 81 51.305 51.305 50.033 1.272 19946
3688 1 8 . 1 1 81 81 ALA CB C 81 16.511 16.511 19.746 -3.235 19946
3689 1 8 . 1 1 81 81 ALA H H 81 7.191 7.191 7.345 -0.154 19946
3690 1 8 . 1 1 82 82 PRO CA C 82 62.903 62.903 63.380 -0.477 19946
3691 1 8 . 1 1 83 83 ALA N N 83 128.367 128.367 125.071 3.296 19946
3692 1 8 . 1 1 83 83 ALA HA H 83 4.058 4.058 4.470 -0.412 19946
3693 1 8 . 1 1 83 83 ALA CA C 83 52.314 52.314 51.363 0.951 19946
3694 1 8 . 1 1 83 83 ALA CB C 83 19.001 19.001 22.249 -3.248 19946
3695 1 8 . 1 1 83 83 ALA H H 83 8.472 8.472 7.736 0.736 19946
3696 1 8 . 1 1 84 84 GLU N N 84 122.108 122.108 122.172 -0.064 19946
3697 1 8 . 1 1 84 84 GLU HA H 84 4.164 4.164 4.580 -0.416 19946
3698 1 8 . 1 1 84 84 GLU CA C 84 55.937 55.937 56.072 -0.135 19946
3699 1 8 . 1 1 84 84 GLU CB C 84 30.213 30.213 29.760 0.453 19946
3700 1 8 . 1 1 84 84 GLU H H 84 8.106 8.106 8.313 -0.207 19946
3701 1 8 . 1 1 85 85 ILE N N 85 122.808 122.808 123.047 -0.239 19946
3702 1 8 . 1 1 85 85 ILE HA H 85 5.211 5.211 5.181 0.030 19946
3703 1 8 . 1 1 85 85 ILE CA C 85 58.365 58.365 58.570 -0.205 19946
3704 1 8 . 1 1 85 85 ILE CB C 85 39.707 39.707 39.565 0.142 19946
3705 1 8 . 1 1 85 85 ILE H H 85 7.850 7.850 7.751 0.099 19946
3706 1 8 . 1 1 86 86 PHE N N 86 122.937 122.937 119.926 3.011 19946
3707 1 8 . 1 1 86 86 PHE HA H 86 5.388 5.388 4.689 0.699 19946
3708 1 8 . 1 1 86 86 PHE CA C 86 54.509 54.509 57.123 -2.614 19946
3709 1 8 . 1 1 86 86 PHE CB C 86 42.878 42.878 43.709 -0.831 19946
3710 1 8 . 1 1 86 86 PHE H H 86 9.004 9.004 8.132 0.872 19946
3711 1 8 . 1 1 87 87 LEU N N 87 120.712 120.712 119.761 0.951 19946
3712 1 8 . 1 1 87 87 LEU HA H 87 5.295 5.295 5.208 0.087 19946
3713 1 8 . 1 1 87 87 LEU CA C 87 51.810 51.810 53.679 -1.869 19946
3714 1 8 . 1 1 87 87 LEU CB C 87 42.059 42.059 44.832 -2.773 19946
3715 1 8 . 1 1 87 87 LEU H H 87 8.785 8.785 9.082 -0.297 19946
3716 1 8 . 1 1 88 88 LEU N N 88 124.779 124.779 122.918 1.861 19946
3717 1 8 . 1 1 88 88 LEU HA H 88 4.434 4.434 4.677 -0.243 19946
3718 1 8 . 1 1 88 88 LEU CA C 88 54.331 54.331 53.332 0.999 19946
3719 1 8 . 1 1 88 88 LEU CB C 88 42.648 42.648 42.740 -0.092 19946
3720 1 8 . 1 1 88 88 LEU H H 88 8.243 8.243 8.478 -0.235 19946
3721 1 8 . 1 1 89 89 GLU N N 89 112.478 112.478 123.921 -11.443 19946
3722 1 8 . 1 1 89 89 GLU HA H 89 3.881 3.881 4.100 -0.219 19946
3723 1 8 . 1 1 89 89 GLU H H 89 9.343 9.343 8.225 1.118 19946
3724 1 8 . 1 1 90 90 ASP N N 90 120.709 120.709 123.857 -3.148 19946
3725 1 8 . 1 1 90 90 ASP HA H 90 4.168 4.168 4.799 -0.631 19946
3726 1 8 . 1 1 90 90 ASP H H 90 9.062 9.062 8.298 0.764 19946
3727 1 8 . 1 1 91 91 GLY N N 91 105.049 105.049 111.490 -6.441 19946
3728 1 8 . 1 1 91 91 GLY CA C 91 46.263 46.263 45.952 0.311 19946
3729 1 8 . 1 1 91 91 GLY H H 91 7.848 7.848 8.775 -0.927 19946
3730 1 8 . 1 1 92 92 ILE N N 92 122.127 122.127 126.305 -4.178 19946
3731 1 8 . 1 1 92 92 ILE HA H 92 3.811 3.811 3.706 0.105 19946
3732 1 8 . 1 1 92 92 ILE CA C 92 62.656 62.656 63.413 -0.757 19946
3733 1 8 . 1 1 92 92 ILE CB C 92 37.243 37.243 38.060 -0.817 19946
3734 1 8 . 1 1 92 92 ILE H H 92 8.077 8.077 8.832 -0.755 19946
3735 1 8 . 1 1 93 93 ASP N N 93 127.038 127.038 118.677 8.361 19946
3736 1 8 . 1 1 93 93 ASP HA H 93 4.452 4.452 4.319 0.133 19946
3737 1 8 . 1 1 93 93 ASP CA C 93 57.357 57.357 57.457 -0.100 19946
3738 1 8 . 1 1 93 93 ASP CB C 93 38.194 38.194 39.257 -1.063 19946
3739 1 8 . 1 1 93 93 ASP H H 93 9.094 9.094 8.580 0.514 19946
3740 1 8 . 1 1 94 94 GLY N N 94 111.411 111.411 108.374 3.037 19946
3741 1 8 . 1 1 94 94 GLY CA C 94 44.750 44.750 46.870 -2.120 19946
3742 1 8 . 1 1 94 94 GLY H H 94 8.047 8.047 8.864 -0.817 19946
3743 1 8 . 1 1 95 95 TRP N N 95 127.574 127.574 123.686 3.888 19946
3744 1 8 . 1 1 95 95 TRP HA H 95 3.738 3.738 4.168 -0.430 19946
3745 1 8 . 1 1 95 95 TRP CA C 95 60.852 60.852 59.770 1.082 19946
3746 1 8 . 1 1 95 95 TRP CB C 95 28.613 28.613 29.303 -0.690 19946
3747 1 8 . 1 1 95 95 TRP H H 95 7.918 7.918 8.757 -0.839 19946
3748 1 8 . 1 1 96 96 LYS N N 96 117.374 117.374 120.271 -2.897 19946
3749 1 8 . 1 1 96 96 LYS HA H 96 4.079 4.079 3.731 0.348 19946
3750 1 8 . 1 1 96 96 LYS CA C 96 59.091 59.091 58.945 0.146 19946
3751 1 8 . 1 1 96 96 LYS H H 96 8.625 8.625 8.482 0.143 19946
3752 1 8 . 1 1 97 97 LYS N N 97 123.490 123.490 119.355 4.135 19946
3753 1 8 . 1 1 97 97 LYS HA H 97 4.021 4.021 4.050 -0.029 19946
3754 1 8 . 1 1 97 97 LYS CB C 97 31.542 31.542 32.551 -1.009 19946
3755 1 8 . 1 1 97 97 LYS H H 97 8.233 8.233 8.200 0.033 19946
3756 1 8 . 1 1 98 98 ALA N N 98 120.321 120.321 119.306 1.015 19946
3757 1 8 . 1 1 98 98 ALA HA H 98 4.248 4.248 4.497 -0.249 19946
3758 1 8 . 1 1 98 98 ALA CA C 98 51.305 51.305 51.359 -0.054 19946
3759 1 8 . 1 1 98 98 ALA CB C 98 17.744 17.744 18.886 -1.142 19946
3760 1 8 . 1 1 98 98 ALA H H 98 7.480 7.480 7.863 -0.383 19946
3761 1 8 . 1 1 99 99 GLY N N 99 106.984 106.984 108.212 -1.228 19946
3762 1 8 . 1 1 99 99 GLY CA C 99 44.246 44.246 45.777 -1.531 19946
3763 1 8 . 1 1 99 99 GLY H H 99 7.867 7.867 8.432 -0.565 19946
3764 1 8 . 1 1 100 100 LEU N N 100 122.993 122.993 119.850 3.143 19946
3765 1 8 . 1 1 100 100 LEU HA H 100 4.277 4.277 4.365 -0.088 19946
3766 1 8 . 1 1 100 100 LEU CA C 100 52.314 52.314 50.636 1.678 19946
3767 1 8 . 1 1 100 100 LEU CB C 100 36.786 36.786 43.300 -6.514 19946
3768 1 8 . 1 1 100 100 LEU H H 100 6.958 6.958 7.129 -0.171 19946
3769 1 8 . 1 1 101 101 PRO HA H 101 4.492 4.492 4.529 -0.037 19946
3770 1 8 . 1 1 101 101 PRO CB C 101 32.097 32.097 31.902 0.195 19946
3771 1 8 . 1 1 102 102 VAL N N 102 111.514 111.514 115.384 -3.870 19946
3772 1 8 . 1 1 102 102 VAL HA H 102 4.367 4.367 4.374 -0.007 19946
3773 1 8 . 1 1 102 102 VAL CA C 102 58.869 58.869 60.824 -1.955 19946
3774 1 8 . 1 1 102 102 VAL CB C 102 35.351 35.351 31.881 3.470 19946
3775 1 8 . 1 1 102 102 VAL H H 102 7.988 7.988 8.276 -0.288 19946
3776 1 8 . 1 1 103 103 ALA N N 103 126.676 126.676 123.084 3.592 19946
3777 1 8 . 1 1 103 103 ALA HA H 103 4.524 4.524 4.347 0.177 19946
3778 1 8 . 1 1 103 103 ALA CA C 103 49.793 49.793 51.656 -1.863 19946
3779 1 8 . 1 1 103 103 ALA CB C 103 18.600 18.600 17.078 1.522 19946
3780 1 8 . 1 1 103 103 ALA H H 103 8.919 8.919 7.845 1.074 19946
3781 1 8 . 1 1 104 104 VAL N N 104 121.148 121.148 122.605 -1.457 19946
3782 1 8 . 1 1 104 104 VAL HA H 104 4.475 4.475 4.328 0.147 19946
3783 1 8 . 1 1 104 104 VAL CA C 104 59.374 59.374 61.835 -2.461 19946
3784 1 8 . 1 1 104 104 VAL CB C 104 33.884 33.884 32.513 1.371 19946
3785 1 8 . 1 1 104 104 VAL H H 104 8.241 8.241 7.742 0.499 19946
3786 1 8 . 1 1 105 105 ASN N N 105 123.816 123.816 119.735 4.081 19946
3787 1 8 . 1 1 105 105 ASN HA H 105 4.674 4.674 4.620 0.054 19946
3788 1 8 . 1 1 105 105 ASN CA C 105 53.200 53.200 54.978 -1.778 19946
3789 1 8 . 1 1 105 105 ASN CB C 105 37.959 37.959 38.725 -0.766 19946
3790 1 8 . 1 1 105 105 ASN H H 105 8.150 8.150 8.402 -0.252 19946
3791 1 8 . 1 1 106 106 LYS N N 106 123.804 123.804 122.067 1.737 19946
3792 1 8 . 1 1 106 106 LYS H H 106 8.340 8.340 8.257 0.083 19946
3793 1 9 . 1 1 2 2 LEU N N 2 120.763 120.763 120.903 -0.140 19946
3794 1 9 . 1 1 2 2 LEU HA H 2 4.384 4.384 5.297 -0.913 19946
3795 1 9 . 1 1 2 2 LEU CA C 2 53.827 53.827 53.198 0.629 19946
3796 1 9 . 1 1 2 2 LEU CB C 2 42.229 42.229 39.500 2.729 19946
3797 1 9 . 1 1 2 2 LEU H H 2 7.888 7.888 8.508 -0.620 19946
3798 1 9 . 1 1 3 3 THR N N 3 118.330 118.330 120.118 -1.788 19946
3799 1 9 . 1 1 3 3 THR HA H 3 4.469 4.469 4.673 -0.204 19946
3800 1 9 . 1 1 3 3 THR CA C 3 61.391 61.391 61.901 -0.510 19946
3801 1 9 . 1 1 3 3 THR CB C 3 69.496 69.496 69.974 -0.478 19946
3802 1 9 . 1 1 3 3 THR H H 3 7.905 7.905 8.284 -0.379 19946
3803 1 9 . 1 1 4 4 THR N N 4 122.024 122.024 116.225 5.799 19946
3804 1 9 . 1 1 4 4 THR HA H 4 5.171 5.171 5.647 -0.476 19946
3805 1 9 . 1 1 4 4 THR CA C 4 61.595 61.595 60.825 0.770 19946
3806 1 9 . 1 1 4 4 THR CB C 4 69.027 69.027 70.698 -1.671 19946
3807 1 9 . 1 1 4 4 THR H H 4 8.504 8.504 8.320 0.184 19946
3808 1 9 . 1 1 5 5 ILE N N 5 122.667 122.667 119.847 2.820 19946
3809 1 9 . 1 1 5 5 ILE HA H 5 4.973 4.973 4.268 0.705 19946
3810 1 9 . 1 1 5 5 ILE CA C 5 57.971 57.971 61.112 -3.141 19946
3811 1 9 . 1 1 5 5 ILE CB C 5 41.458 41.458 40.654 0.804 19946
3812 1 9 . 1 1 5 5 ILE H H 5 8.903 8.903 8.247 0.656 19946
3813 1 9 . 1 1 6 6 SER N N 6 123.156 123.156 112.707 10.449 19946
3814 1 9 . 1 1 6 6 SER HA H 6 4.785 4.785 4.613 0.172 19946
3815 1 9 . 1 1 6 6 SER H H 6 9.138 9.138 8.373 0.765 19946
3816 1 9 . 1 1 7 7 PRO HA H 7 4.004 4.004 4.724 -0.720 19946
3817 1 9 . 1 1 7 7 PRO CA C 7 65.510 65.510 62.829 2.681 19946
3818 1 9 . 1 1 7 7 PRO CB C 7 30.924 30.924 32.248 -1.324 19946
3819 1 9 . 1 1 8 8 HIS N N 8 114.319 114.319 118.285 -3.966 19946
3820 1 9 . 1 1 8 8 HIS HA H 8 3.989 3.989 4.192 -0.203 19946
3821 1 9 . 1 1 8 8 HIS CA C 8 60.050 60.050 59.344 0.706 19946
3822 1 9 . 1 1 8 8 HIS CB C 8 28.613 28.613 29.693 -1.080 19946
3823 1 9 . 1 1 8 8 HIS H H 8 8.127 8.127 8.750 -0.623 19946
3824 1 9 . 1 1 9 9 ASP N N 9 121.300 121.300 120.013 1.287 19946
3825 1 9 . 1 1 9 9 ASP HA H 9 4.301 4.301 4.371 -0.070 19946
3826 1 9 . 1 1 9 9 ASP CA C 9 56.455 56.455 57.553 -1.098 19946
3827 1 9 . 1 1 9 9 ASP CB C 9 38.699 38.699 40.284 -1.585 19946
3828 1 9 . 1 1 9 9 ASP H H 9 7.639 7.639 8.611 -0.972 19946
3829 1 9 . 1 1 10 10 ALA N N 10 123.991 123.991 120.180 3.811 19946
3830 1 9 . 1 1 10 10 ALA HA H 10 3.719 3.719 4.356 -0.637 19946
3831 1 9 . 1 1 10 10 ALA CA C 10 54.331 54.331 54.406 -0.075 19946
3832 1 9 . 1 1 10 10 ALA CB C 10 17.549 17.549 18.807 -1.258 19946
3833 1 9 . 1 1 10 10 ALA H H 10 8.820 8.820 8.743 0.077 19946
3834 1 9 . 1 1 11 11 GLN N N 11 118.128 118.128 116.601 1.527 19946
3835 1 9 . 1 1 11 11 GLN HA H 11 3.933 3.933 4.301 -0.368 19946
3836 1 9 . 1 1 11 11 GLN CA C 11 59.389 59.389 57.690 1.699 19946
3837 1 9 . 1 1 11 11 GLN CB C 11 27.948 27.948 28.637 -0.690 19946
3838 1 9 . 1 1 11 11 GLN H H 11 8.353 8.353 8.080 0.273 19946
3839 1 9 . 1 1 12 12 GLU N N 12 119.307 119.307 119.721 -0.414 19946
3840 1 9 . 1 1 12 12 GLU HA H 12 4.023 4.023 4.263 -0.240 19946
3841 1 9 . 1 1 12 12 GLU CA C 12 58.476 58.476 58.092 0.384 19946
3842 1 9 . 1 1 12 12 GLU CB C 12 28.532 28.532 30.053 -1.521 19946
3843 1 9 . 1 1 12 12 GLU H H 12 7.197 7.197 7.565 -0.368 19946
3844 1 9 . 1 1 13 13 LEU N N 13 120.635 120.635 118.881 1.754 19946
3845 1 9 . 1 1 13 13 LEU HA H 13 3.821 3.821 4.232 -0.411 19946
3846 1 9 . 1 1 13 13 LEU CA C 13 57.065 57.065 57.383 -0.318 19946
3847 1 9 . 1 1 13 13 LEU CB C 13 40.890 40.890 42.282 -1.392 19946
3848 1 9 . 1 1 13 13 LEU H H 13 7.554 7.554 7.528 0.026 19946
3849 1 9 . 1 1 14 14 ILE N N 14 123.021 123.021 118.783 4.238 19946
3850 1 9 . 1 1 14 14 ILE HA H 14 3.827 3.827 3.883 -0.056 19946
3851 1 9 . 1 1 14 14 ILE CA C 14 64.053 64.053 64.596 -0.543 19946
3852 1 9 . 1 1 14 14 ILE CB C 14 38.115 38.115 38.006 0.109 19946
3853 1 9 . 1 1 14 14 ILE H H 14 8.710 8.710 7.655 1.055 19946
3854 1 9 . 1 1 15 15 ALA N N 15 124.504 124.504 118.810 5.694 19946
3855 1 9 . 1 1 15 15 ALA HA H 15 4.115 4.115 4.202 -0.087 19946
3856 1 9 . 1 1 15 15 ALA CA C 15 54.257 54.257 53.631 0.626 19946
3857 1 9 . 1 1 15 15 ALA CB C 15 17.040 17.040 18.532 -1.492 19946
3858 1 9 . 1 1 15 15 ALA H H 15 7.758 7.758 7.705 0.053 19946
3859 1 9 . 1 1 16 16 ARG N N 16 115.990 115.990 117.529 -1.539 19946
3860 1 9 . 1 1 16 16 ARG HA H 16 4.348 4.348 4.419 -0.071 19946
3861 1 9 . 1 1 16 16 ARG CA C 16 55.416 55.416 55.977 -0.561 19946
3862 1 9 . 1 1 16 16 ARG CB C 16 29.762 29.762 31.052 -1.290 19946
3863 1 9 . 1 1 16 16 ARG H H 16 7.252 7.252 7.885 -0.633 19946
3864 1 9 . 1 1 17 17 GLY N N 17 107.981 107.981 107.138 0.843 19946
3865 1 9 . 1 1 17 17 GLY CA C 17 44.854 44.854 44.636 0.218 19946
3866 1 9 . 1 1 17 17 GLY H H 17 7.748 7.748 7.467 0.281 19946
3867 1 9 . 1 1 18 18 ALA N N 18 123.914 123.914 121.615 2.299 19946
3868 1 9 . 1 1 18 18 ALA HA H 18 4.221 4.221 4.355 -0.134 19946
3869 1 9 . 1 1 18 18 ALA CA C 18 52.270 52.270 52.356 -0.086 19946
3870 1 9 . 1 1 18 18 ALA CB C 18 18.638 18.638 20.015 -1.377 19946
3871 1 9 . 1 1 18 18 ALA H H 18 7.940 7.940 8.010 -0.070 19946
3872 1 9 . 1 1 19 19 LYS N N 19 119.436 119.436 119.282 0.154 19946
3873 1 9 . 1 1 19 19 LYS HA H 19 4.301 4.301 4.473 -0.172 19946
3874 1 9 . 1 1 19 19 LYS CA C 19 53.105 53.105 55.668 -2.563 19946
3875 1 9 . 1 1 19 19 LYS CB C 19 32.856 32.856 34.394 -1.538 19946
3876 1 9 . 1 1 19 19 LYS H H 19 7.565 7.565 8.385 -0.820 19946
3877 1 9 . 1 1 20 20 LEU N N 20 127.401 127.401 126.600 0.801 19946
3878 1 9 . 1 1 20 20 LEU HA H 20 5.042 5.042 4.546 0.496 19946
3879 1 9 . 1 1 20 20 LEU CA C 20 52.314 52.314 54.537 -2.223 19946
3880 1 9 . 1 1 20 20 LEU CB C 20 43.234 43.234 43.851 -0.617 19946
3881 1 9 . 1 1 20 20 LEU H H 20 8.727 8.727 8.001 0.726 19946
3882 1 9 . 1 1 21 21 ILE N N 21 128.186 128.186 128.089 0.097 19946
3883 1 9 . 1 1 21 21 ILE HA H 21 4.547 4.547 4.612 -0.065 19946
3884 1 9 . 1 1 21 21 ILE CA C 21 59.589 59.589 59.698 -0.109 19946
3885 1 9 . 1 1 21 21 ILE CB C 21 38.545 38.545 40.890 -2.345 19946
3886 1 9 . 1 1 21 21 ILE H H 21 9.366 9.366 8.127 1.239 19946
3887 1 9 . 1 1 22 22 ASP N N 22 129.968 129.968 129.896 0.072 19946
3888 1 9 . 1 1 22 22 ASP HA H 22 3.803 3.803 4.795 -0.992 19946
3889 1 9 . 1 1 22 22 ASP CA C 22 51.435 51.435 53.680 -2.245 19946
3890 1 9 . 1 1 22 22 ASP CB C 22 42.062 42.062 41.268 0.794 19946
3891 1 9 . 1 1 22 22 ASP H H 22 8.583 8.583 8.176 0.407 19946
3892 1 9 . 1 1 23 23 ILE N N 23 116.266 116.266 119.419 -3.153 19946
3893 1 9 . 1 1 23 23 ILE HA H 23 5.229 5.229 4.206 1.023 19946
3894 1 9 . 1 1 23 23 ILE CA C 23 59.374 59.374 59.845 -0.471 19946
3895 1 9 . 1 1 23 23 ILE CB C 23 37.327 37.327 35.676 1.651 19946
3896 1 9 . 1 1 23 23 ILE H H 23 7.836 7.836 7.581 0.255 19946
3897 1 9 . 1 1 24 24 ARG N N 24 125.001 125.001 119.334 5.667 19946
3898 1 9 . 1 1 24 24 ARG HA H 24 4.116 4.116 4.468 -0.352 19946
3899 1 9 . 1 1 24 24 ARG CA C 24 55.943 55.943 54.597 1.346 19946
3900 1 9 . 1 1 24 24 ARG CB C 24 30.135 30.135 32.190 -2.055 19946
3901 1 9 . 1 1 24 24 ARG H H 24 8.195 8.195 7.426 0.769 19946
3902 1 9 . 1 1 25 25 ASP N N 25 112.839 112.839 120.091 -7.252 19946
3903 1 9 . 1 1 25 25 ASP HA H 25 4.545 4.545 4.461 0.084 19946
3904 1 9 . 1 1 25 25 ASP CA C 25 53.870 53.870 55.277 -1.407 19946
3905 1 9 . 1 1 25 25 ASP CB C 25 41.327 41.327 41.016 0.311 19946
3906 1 9 . 1 1 25 25 ASP H H 25 7.660 7.660 8.575 -0.915 19946
3907 1 9 . 1 1 26 26 ALA N N 26 122.145 122.145 124.476 -2.331 19946
3908 1 9 . 1 1 26 26 ALA HA H 26 3.897 3.897 4.393 -0.496 19946
3909 1 9 . 1 1 26 26 ALA CA C 26 54.958 54.958 53.078 1.880 19946
3910 1 9 . 1 1 26 26 ALA CB C 26 17.520 17.520 20.195 -2.675 19946
3911 1 9 . 1 1 26 26 ALA H H 26 8.766 8.766 8.135 0.631 19946
3912 1 9 . 1 1 27 27 ASP N N 27 115.380 115.380 117.866 -2.486 19946
3913 1 9 . 1 1 27 27 ASP HA H 27 4.299 4.299 4.488 -0.189 19946
3914 1 9 . 1 1 27 27 ASP CA C 27 56.451 56.451 55.529 0.922 19946
3915 1 9 . 1 1 27 27 ASP CB C 27 39.156 39.156 40.239 -1.083 19946
3916 1 9 . 1 1 27 27 ASP H H 27 8.686 8.686 8.303 0.383 19946
3917 1 9 . 1 1 28 28 GLU N N 28 120.081 120.081 118.748 1.333 19946
3918 1 9 . 1 1 28 28 GLU HA H 28 4.086 4.086 4.159 -0.073 19946
3919 1 9 . 1 1 28 28 GLU CA C 28 58.389 58.389 58.639 -0.250 19946
3920 1 9 . 1 1 28 28 GLU CB C 28 28.728 28.728 29.651 -0.923 19946
3921 1 9 . 1 1 28 28 GLU H H 28 7.397 7.397 8.656 -1.259 19946
3922 1 9 . 1 1 29 29 TYR N N 29 121.205 121.205 117.331 3.874 19946
3923 1 9 . 1 1 29 29 TYR HA H 29 4.083 4.083 4.497 -0.414 19946
3924 1 9 . 1 1 29 29 TYR CA C 29 60.378 60.378 58.182 2.196 19946
3925 1 9 . 1 1 29 29 TYR CB C 29 38.699 38.699 40.286 -1.587 19946
3926 1 9 . 1 1 29 29 TYR H H 29 7.506 7.506 7.507 -0.001 19946
3927 1 9 . 1 1 30 30 LEU N N 30 118.828 118.828 119.999 -1.171 19946
3928 1 9 . 1 1 30 30 LEU HA H 30 3.850 3.850 3.901 -0.051 19946
3929 1 9 . 1 1 30 30 LEU CA C 30 56.348 56.348 55.824 0.524 19946
3930 1 9 . 1 1 30 30 LEU CB C 30 41.220 41.220 40.467 0.753 19946
3931 1 9 . 1 1 30 30 LEU H H 30 8.211 8.211 8.061 0.150 19946
3932 1 9 . 1 1 31 31 ARG N N 31 118.220 118.220 117.742 0.478 19946
3933 1 9 . 1 1 31 31 ARG HA H 31 4.101 4.101 4.183 -0.082 19946
3934 1 9 . 1 1 31 31 ARG CA C 31 58.365 58.365 56.996 1.369 19946
3935 1 9 . 1 1 31 31 ARG CB C 31 30.074 30.074 30.889 -0.815 19946
3936 1 9 . 1 1 31 31 ARG H H 31 7.120 7.120 8.306 -1.186 19946
3937 1 9 . 1 1 32 32 GLU N N 32 117.980 117.980 117.292 0.688 19946
3938 1 9 . 1 1 32 32 GLU HA H 32 4.884 4.884 4.352 0.532 19946
3939 1 9 . 1 1 32 32 GLU CA C 32 55.339 55.339 56.418 -1.079 19946
3940 1 9 . 1 1 32 32 GLU CB C 32 31.698 31.698 30.793 0.905 19946
3941 1 9 . 1 1 32 32 GLU H H 32 7.506 7.506 8.363 -0.857 19946
3942 1 9 . 1 1 33 33 HIS N N 33 118.257 118.257 118.744 -0.487 19946
3943 1 9 . 1 1 33 33 HIS HA H 33 4.643 4.643 4.726 -0.083 19946
3944 1 9 . 1 1 33 33 HIS CA C 33 53.766 53.766 54.654 -0.888 19946
3945 1 9 . 1 1 33 33 HIS CB C 33 29.940 29.940 32.709 -2.769 19946
3946 1 9 . 1 1 33 33 HIS H H 33 8.269 8.269 8.356 -0.087 19946
3947 1 9 . 1 1 34 34 ILE N N 34 127.809 127.809 118.697 9.112 19946
3948 1 9 . 1 1 34 34 ILE HA H 34 3.920 3.920 4.338 -0.417 19946
3949 1 9 . 1 1 34 34 ILE CA C 34 59.648 59.648 58.510 1.138 19946
3950 1 9 . 1 1 34 34 ILE CB C 34 37.959 37.959 42.604 -4.645 19946
3951 1 9 . 1 1 34 34 ILE H H 34 9.989 9.989 8.108 1.881 19946
3952 1 9 . 1 1 35 35 PRO HA H 35 4.198 4.198 4.249 -0.051 19946
3953 1 9 . 1 1 36 36 GLU N N 36 114.414 114.414 122.663 -8.249 19946
3954 1 9 . 1 1 36 36 GLU HA H 36 4.082 4.082 3.758 0.324 19946
3955 1 9 . 1 1 36 36 GLU CA C 36 57.861 57.861 56.686 1.175 19946
3956 1 9 . 1 1 36 36 GLU CB C 36 28.109 28.109 29.062 -0.954 19946
3957 1 9 . 1 1 36 36 GLU H H 36 8.557 8.557 8.398 0.159 19946
3958 1 9 . 1 1 37 37 ALA N N 37 122.882 122.882 123.950 -1.068 19946
3959 1 9 . 1 1 37 37 ALA HA H 37 4.439 4.439 5.030 -0.591 19946
3960 1 9 . 1 1 37 37 ALA CA C 37 52.005 52.005 50.802 1.203 19946
3961 1 9 . 1 1 37 37 ALA CB C 37 20.438 20.438 22.437 -1.999 19946
3962 1 9 . 1 1 37 37 ALA H H 37 8.096 8.096 8.006 0.090 19946
3963 1 9 . 1 1 38 38 ASP N N 38 124.471 124.471 116.230 8.241 19946
3964 1 9 . 1 1 38 38 ASP HA H 38 4.844 4.844 4.588 0.256 19946
3965 1 9 . 1 1 38 38 ASP CA C 38 52.614 52.614 53.540 -0.926 19946
3966 1 9 . 1 1 38 38 ASP CB C 38 44.407 44.407 41.233 3.174 19946
3967 1 9 . 1 1 38 38 ASP H H 38 9.004 9.004 8.211 0.793 19946
3968 1 9 . 1 1 39 39 LEU N N 39 123.936 123.936 123.976 -0.040 19946
3969 1 9 . 1 1 39 39 LEU HA H 39 4.328 4.328 3.988 0.340 19946
3970 1 9 . 1 1 39 39 LEU CA C 39 54.037 54.037 56.228 -2.191 19946
3971 1 9 . 1 1 39 39 LEU CB C 39 41.220 41.220 41.754 -0.534 19946
3972 1 9 . 1 1 39 39 LEU H H 39 8.125 8.125 8.750 -0.625 19946
3973 1 9 . 1 1 40 40 ALA N N 40 131.297 131.297 127.948 3.349 19946
3974 1 9 . 1 1 40 40 ALA HA H 40 4.408 4.408 4.479 -0.071 19946
3975 1 9 . 1 1 40 40 ALA CA C 40 48.784 48.784 50.704 -1.920 19946
3976 1 9 . 1 1 40 40 ALA CB C 40 17.979 17.979 19.581 -1.603 19946
3977 1 9 . 1 1 40 40 ALA H H 40 8.654 8.654 8.111 0.543 19946
3978 1 9 . 1 1 41 41 PRO HA H 41 4.101 4.101 4.624 -0.523 19946
3979 1 9 . 1 1 41 41 PRO CA C 41 61.391 61.391 62.377 -0.986 19946
3980 1 9 . 1 1 41 41 PRO CB C 41 32.097 32.097 32.384 -0.287 19946
3981 1 9 . 1 1 42 42 LEU N N 42 125.312 125.312 122.038 3.274 19946
3982 1 9 . 1 1 42 42 LEU HA H 42 3.871 3.871 3.911 -0.040 19946
3983 1 9 . 1 1 42 42 LEU CA C 42 57.861 57.861 58.542 -0.681 19946
3984 1 9 . 1 1 42 42 LEU CB C 42 40.941 40.941 41.135 -0.194 19946
3985 1 9 . 1 1 42 42 LEU H H 42 8.285 8.285 8.350 -0.065 19946
3986 1 9 . 1 1 43 43 SER N N 43 110.669 110.669 115.213 -4.544 19946
3987 1 9 . 1 1 43 43 SER HA H 43 4.106 4.106 4.043 0.063 19946
3988 1 9 . 1 1 43 43 SER CA C 43 60.497 60.497 61.776 -1.279 19946
3989 1 9 . 1 1 43 43 SER CB C 43 61.391 61.391 62.797 -1.406 19946
3990 1 9 . 1 1 43 43 SER H H 43 8.453 8.453 8.192 0.261 19946
3991 1 9 . 1 1 44 44 VAL N N 44 123.933 123.933 122.105 1.828 19946
3992 1 9 . 1 1 44 44 VAL HA H 44 3.821 3.821 3.775 0.046 19946
3993 1 9 . 1 1 44 44 VAL CA C 44 64.752 64.752 66.199 -1.447 19946
3994 1 9 . 1 1 44 44 VAL CB C 44 31.135 31.135 31.697 -0.562 19946
3995 1 9 . 1 1 44 44 VAL H H 44 7.156 7.156 8.064 -0.908 19946
3996 1 9 . 1 1 45 45 LEU N N 45 121.150 121.150 119.506 1.644 19946
3997 1 9 . 1 1 45 45 LEU HA H 45 3.767 3.767 3.931 -0.164 19946
3998 1 9 . 1 1 45 45 LEU CA C 45 56.599 56.599 58.170 -1.571 19946
3999 1 9 . 1 1 45 45 LEU CB C 45 40.890 40.890 41.353 -0.463 19946
4000 1 9 . 1 1 45 45 LEU H H 45 7.997 7.997 8.770 -0.773 19946
4001 1 9 . 1 1 46 46 GLU N N 46 116.256 116.256 118.961 -2.705 19946
4002 1 9 . 1 1 46 46 GLU HA H 46 3.678 3.678 4.181 -0.503 19946
4003 1 9 . 1 1 46 46 GLU CA C 46 58.365 58.365 58.741 -0.376 19946
4004 1 9 . 1 1 46 46 GLU CB C 46 29.622 29.622 29.788 -0.166 19946
4005 1 9 . 1 1 46 46 GLU H H 46 8.501 8.501 8.225 0.276 19946
4006 1 9 . 1 1 47 47 GLN N N 47 117.261 117.261 117.800 -0.539 19946
4007 1 9 . 1 1 47 47 GLN HA H 47 4.216 4.216 4.137 0.079 19946
4008 1 9 . 1 1 47 47 GLN CA C 47 56.852 56.852 58.227 -1.375 19946
4009 1 9 . 1 1 47 47 GLN CB C 47 29.119 29.119 29.013 0.106 19946
4010 1 9 . 1 1 47 47 GLN H H 47 7.407 7.407 8.252 -0.845 19946
4011 1 9 . 1 1 48 48 SER N N 48 111.890 111.890 112.862 -0.972 19946
4012 1 9 . 1 1 48 48 SER HA H 48 4.641 4.641 4.519 0.122 19946
4013 1 9 . 1 1 48 48 SER CA C 48 57.956 57.956 58.251 -0.295 19946
4014 1 9 . 1 1 48 48 SER CB C 48 63.912 63.912 64.801 -0.889 19946
4015 1 9 . 1 1 48 48 SER H H 48 8.566 8.566 8.405 0.161 19946
4016 1 9 . 1 1 49 49 GLY N N 49 111.545 111.545 110.065 1.480 19946
4017 1 9 . 1 1 49 49 GLY CA C 49 43.894 43.894 45.232 -1.338 19946
4018 1 9 . 1 1 49 49 GLY H H 49 7.836 7.836 7.379 0.457 19946
4019 1 9 . 1 1 50 50 LEU N N 50 121.541 121.541 122.544 -1.003 19946
4020 1 9 . 1 1 50 50 LEU HA H 50 4.239 4.239 4.061 0.178 19946
4021 1 9 . 1 1 50 50 LEU CA C 50 51.985 51.985 54.534 -2.549 19946
4022 1 9 . 1 1 50 50 LEU CB C 50 42.648 42.648 42.154 0.494 19946
4023 1 9 . 1 1 50 50 LEU H H 50 8.564 8.564 8.216 0.348 19946
4024 1 9 . 1 1 51 51 PRO HA H 51 4.243 4.243 4.515 -0.272 19946
4025 1 9 . 1 1 51 51 PRO CB C 51 31.639 31.639 32.668 -1.029 19946
4026 1 9 . 1 1 52 52 ALA N N 52 127.008 127.008 127.319 -0.311 19946
4027 1 9 . 1 1 52 52 ALA HA H 52 3.790 3.790 4.197 -0.407 19946
4028 1 9 . 1 1 52 52 ALA CA C 52 54.835 54.835 54.205 0.630 19946
4029 1 9 . 1 1 52 52 ALA CB C 52 17.715 17.715 18.666 -0.951 19946
4030 1 9 . 1 1 52 52 ALA H H 52 8.564 8.564 8.648 -0.084 19946
4031 1 9 . 1 1 53 53 LYS N N 53 114.535 114.535 115.987 -1.452 19946
4032 1 9 . 1 1 53 53 LYS HA H 53 4.106 4.106 4.185 -0.079 19946
4033 1 9 . 1 1 53 53 LYS CA C 53 56.852 56.852 57.671 -0.819 19946
4034 1 9 . 1 1 53 53 LYS CB C 53 31.386 31.386 32.255 -0.869 19946
4035 1 9 . 1 1 53 53 LYS H H 53 8.364 8.364 8.333 0.031 19946
4036 1 9 . 1 1 54 54 LEU N N 54 118.515 118.515 118.020 0.495 19946
4037 1 9 . 1 1 54 54 LEU HA H 54 4.247 4.247 4.545 -0.298 19946
4038 1 9 . 1 1 54 54 LEU CA C 54 53.338 53.338 53.672 -0.334 19946
4039 1 9 . 1 1 54 54 LEU CB C 54 40.890 40.890 41.897 -1.007 19946
4040 1 9 . 1 1 54 54 LEU H H 54 7.745 7.745 7.121 0.624 19946
4041 1 9 . 1 1 55 55 ARG N N 55 117.612 117.612 121.459 -3.847 19946
4042 1 9 . 1 1 55 55 ARG HA H 55 3.927 3.927 4.490 -0.563 19946
4043 1 9 . 1 1 55 55 ARG CA C 55 56.832 56.832 55.701 1.131 19946
4044 1 9 . 1 1 55 55 ARG CB C 55 28.610 28.610 31.873 -3.263 19946
4045 1 9 . 1 1 55 55 ARG H H 55 6.938 6.938 7.517 -0.579 19946
4046 1 9 . 1 1 56 56 HIS N N 56 123.269 123.269 120.829 2.440 19946
4047 1 9 . 1 1 56 56 HIS HA H 56 4.614 4.614 4.729 -0.115 19946
4048 1 9 . 1 1 56 56 HIS CA C 56 54.835 54.835 55.210 -0.375 19946
4049 1 9 . 1 1 56 56 HIS CB C 56 32.648 32.648 31.752 0.896 19946
4050 1 9 . 1 1 56 56 HIS H H 56 7.237 7.237 8.469 -1.232 19946
4051 1 9 . 1 1 57 57 GLU N N 57 120.895 120.895 119.596 1.299 19946
4052 1 9 . 1 1 57 57 GLU HA H 57 3.976 3.976 4.429 -0.453 19946
4053 1 9 . 1 1 57 57 GLU CA C 57 58.871 58.871 57.769 1.102 19946
4054 1 9 . 1 1 57 57 GLU CB C 57 29.158 29.158 31.312 -2.154 19946
4055 1 9 . 1 1 57 57 GLU H H 57 7.625 7.625 8.403 -0.778 19946
4056 1 9 . 1 1 58 58 GLN N N 58 118.485 118.485 117.553 0.932 19946
4057 1 9 . 1 1 58 58 GLN HA H 58 5.425 5.425 4.389 1.036 19946
4058 1 9 . 1 1 58 58 GLN CA C 58 54.910 54.910 54.389 0.521 19946
4059 1 9 . 1 1 58 58 GLN CB C 58 32.285 32.285 29.894 2.391 19946
4060 1 9 . 1 1 58 58 GLN H H 58 8.335 8.335 8.169 0.166 19946
4061 1 9 . 1 1 59 59 ILE N N 59 123.505 123.505 118.975 4.530 19946
4062 1 9 . 1 1 59 59 ILE HA H 59 4.492 4.492 4.517 -0.025 19946
4063 1 9 . 1 1 59 59 ILE CA C 59 58.869 58.869 59.273 -0.404 19946
4064 1 9 . 1 1 59 59 ILE CB C 59 42.332 42.332 40.897 1.435 19946
4065 1 9 . 1 1 59 59 ILE H H 59 8.704 8.704 8.304 0.400 19946
4066 1 9 . 1 1 60 60 ILE N N 60 126.464 126.464 118.308 8.156 19946
4067 1 9 . 1 1 60 60 ILE HA H 60 4.954 4.954 5.452 -0.498 19946
4068 1 9 . 1 1 60 60 ILE CA C 60 57.357 57.357 59.074 -1.717 19946
4069 1 9 . 1 1 60 60 ILE CB C 60 39.131 39.131 40.473 -1.342 19946
4070 1 9 . 1 1 60 60 ILE H H 60 9.006 9.006 8.372 0.634 19946
4071 1 9 . 1 1 61 61 PHE N N 61 124.441 124.441 125.672 -1.231 19946
4072 1 9 . 1 1 61 61 PHE HA H 61 5.795 5.795 4.986 0.809 19946
4073 1 9 . 1 1 61 61 PHE CA C 61 56.131 56.131 57.077 -0.946 19946
4074 1 9 . 1 1 61 61 PHE CB C 61 42.879 42.879 41.236 1.643 19946
4075 1 9 . 1 1 61 61 PHE H H 61 8.938 8.938 8.699 0.239 19946
4076 1 9 . 1 1 62 62 HIS N N 62 117.494 117.494 123.529 -6.035 19946
4077 1 9 . 1 1 62 62 HIS HA H 62 5.928 5.928 4.820 1.108 19946
4078 1 9 . 1 1 62 62 HIS CA C 62 53.322 53.322 56.525 -3.203 19946
4079 1 9 . 1 1 62 62 HIS CB C 62 35.673 35.673 33.689 1.984 19946
4080 1 9 . 1 1 62 62 HIS H H 62 9.230 9.230 7.943 1.287 19946
4081 1 9 . 1 1 63 63 CYS N N 63 120.220 120.220 116.636 3.584 19946
4082 1 9 . 1 1 63 63 CYS HA H 63 5.033 5.033 4.573 0.460 19946
4083 1 9 . 1 1 63 63 CYS CA C 63 56.131 56.131 59.459 -3.328 19946
4084 1 9 . 1 1 63 63 CYS CB C 63 28.109 28.109 30.983 -2.874 19946
4085 1 9 . 1 1 63 63 CYS H H 63 8.131 8.131 8.681 -0.550 19946
4086 1 9 . 1 1 65 65 ALA N N 65 119.272 119.272 122.613 -3.341 19946
4087 1 9 . 1 1 65 65 ALA HA H 65 5.063 5.063 4.561 0.502 19946
4088 1 9 . 1 1 65 65 ALA CA C 65 49.793 49.793 52.253 -2.460 19946
4089 1 9 . 1 1 65 65 ALA CB C 65 19.775 19.775 19.983 -0.208 19946
4090 1 9 . 1 1 65 65 ALA H H 65 8.967 8.967 7.920 1.047 19946
4091 1 9 . 1 1 66 66 GLY N N 66 113.296 113.296 106.852 6.444 19946
4092 1 9 . 1 1 66 66 GLY CA C 66 44.934 44.934 45.922 -0.989 19946
4093 1 9 . 1 1 66 66 GLY H H 66 8.778 8.778 7.670 1.108 19946
4094 1 9 . 1 1 67 67 LYS N N 67 121.300 121.300 120.961 0.339 19946
4095 1 9 . 1 1 67 67 LYS HA H 67 4.211 4.211 4.261 -0.050 19946
4096 1 9 . 1 1 67 67 LYS H H 67 8.111 8.111 8.627 -0.516 19946
4097 1 9 . 1 1 68 68 ARG N N 68 126.092 126.092 119.574 6.518 19946
4098 1 9 . 1 1 68 68 ARG H H 68 9.067 9.067 8.727 0.340 19946
4099 1 9 . 1 1 69 69 THR N N 69 117.153 117.153 110.819 6.334 19946
4100 1 9 . 1 1 69 69 THR HA H 69 3.576 3.576 4.089 -0.513 19946
4101 1 9 . 1 1 69 69 THR CA C 69 65.397 65.397 64.394 1.003 19946
4102 1 9 . 1 1 69 69 THR CB C 69 66.938 66.938 68.639 -1.701 19946
4103 1 9 . 1 1 69 69 THR H H 69 10.233 10.233 8.658 1.575 19946
4104 1 9 . 1 1 70 70 SER N N 70 113.686 113.686 116.441 -2.755 19946
4105 1 9 . 1 1 70 70 SER HA H 70 4.091 4.091 4.270 -0.179 19946
4106 1 9 . 1 1 70 70 SER CA C 70 61.391 61.391 60.170 1.221 19946
4107 1 9 . 1 1 70 70 SER CB C 70 65.425 65.425 62.760 2.665 19946
4108 1 9 . 1 1 70 70 SER H H 70 7.322 7.322 8.193 -0.871 19946
4109 1 9 . 1 1 71 71 ASN N N 71 118.257 118.257 120.131 -1.874 19946
4110 1 9 . 1 1 71 71 ASN HA H 71 4.177 4.177 4.660 -0.483 19946
4111 1 9 . 1 1 71 71 ASN CA C 71 54.736 54.736 55.201 -0.465 19946
4112 1 9 . 1 1 71 71 ASN CB C 71 38.391 38.391 38.772 -0.381 19946
4113 1 9 . 1 1 71 71 ASN H H 71 7.863 7.863 7.811 0.052 19946
4114 1 9 . 1 1 72 72 ASN N N 72 115.529 115.529 117.413 -1.884 19946
4115 1 9 . 1 1 72 72 ASN HA H 72 5.127 5.127 4.874 0.253 19946
4116 1 9 . 1 1 72 72 ASN CA C 72 52.173 52.173 52.659 -0.486 19946
4117 1 9 . 1 1 72 72 ASN CB C 72 39.165 39.165 38.668 0.497 19946
4118 1 9 . 1 1 72 72 ASN H H 72 7.238 7.238 7.939 -0.701 19946
4119 1 9 . 1 1 73 73 ALA N N 73 125.388 125.388 123.228 2.160 19946
4120 1 9 . 1 1 73 73 ALA HA H 73 3.639 3.639 3.937 -0.298 19946
4121 1 9 . 1 1 73 73 ALA CA C 73 56.133 56.133 55.260 0.873 19946
4122 1 9 . 1 1 73 73 ALA CB C 73 18.528 18.528 18.712 -0.184 19946
4123 1 9 . 1 1 73 73 ALA H H 73 7.081 7.081 7.937 -0.856 19946
4124 1 9 . 1 1 74 74 ASP N N 74 115.501 115.501 118.056 -2.555 19946
4125 1 9 . 1 1 74 74 ASP HA H 74 4.135 4.135 4.290 -0.155 19946
4126 1 9 . 1 1 74 74 ASP CA C 74 55.891 55.891 58.078 -2.187 19946
4127 1 9 . 1 1 74 74 ASP CB C 74 38.699 38.699 40.775 -2.076 19946
4128 1 9 . 1 1 74 74 ASP H H 74 8.346 8.346 8.228 0.118 19946
4129 1 9 . 1 1 75 75 LYS N N 75 122.469 122.469 118.718 3.751 19946
4130 1 9 . 1 1 75 75 LYS HA H 75 4.024 4.024 4.039 -0.015 19946
4131 1 9 . 1 1 75 75 LYS CA C 75 57.861 57.861 58.786 -0.925 19946
4132 1 9 . 1 1 75 75 LYS CB C 75 31.660 31.660 32.247 -0.587 19946
4133 1 9 . 1 1 75 75 LYS H H 75 7.583 7.583 7.792 -0.209 19946
4134 1 9 . 1 1 76 76 LEU N N 76 119.196 119.196 119.615 -0.419 19946
4135 1 9 . 1 1 76 76 LEU HA H 76 3.570 3.570 3.973 -0.403 19946
4136 1 9 . 1 1 76 76 LEU CA C 76 56.852 56.852 57.411 -0.559 19946
4137 1 9 . 1 1 76 76 LEU CB C 76 39.245 39.245 42.022 -2.777 19946
4138 1 9 . 1 1 76 76 LEU H H 76 8.069 8.069 7.531 0.538 19946
4139 1 9 . 1 1 77 77 ALA N N 77 120.302 120.302 119.276 1.026 19946
4140 1 9 . 1 1 77 77 ALA HA H 77 3.985 3.985 4.037 -0.052 19946
4141 1 9 . 1 1 77 77 ALA CA C 77 53.794 53.794 52.731 1.063 19946
4142 1 9 . 1 1 77 77 ALA CB C 77 17.353 17.353 18.300 -0.947 19946
4143 1 9 . 1 1 77 77 ALA H H 77 8.063 8.063 8.210 -0.147 19946
4144 1 9 . 1 1 78 78 ALA N N 78 119.602 119.602 118.578 1.024 19946
4145 1 9 . 1 1 78 78 ALA HA H 78 4.138 4.138 4.518 -0.380 19946
4146 1 9 . 1 1 78 78 ALA CA C 78 54.049 54.049 52.523 1.526 19946
4147 1 9 . 1 1 78 78 ALA CB C 78 17.520 17.520 18.948 -1.428 19946
4148 1 9 . 1 1 78 78 ALA H H 78 7.274 7.274 7.247 0.027 19946
4149 1 9 . 1 1 79 79 ILE N N 79 118.809 118.809 119.763 -0.954 19946
4150 1 9 . 1 1 79 79 ILE HA H 79 3.798 3.798 3.877 -0.079 19946
4151 1 9 . 1 1 79 79 ILE CA C 79 63.354 63.354 63.302 0.052 19946
4152 1 9 . 1 1 79 79 ILE CB C 79 38.422 38.422 39.309 -0.887 19946
4153 1 9 . 1 1 79 79 ILE H H 79 8.170 8.170 7.270 0.900 19946
4154 1 9 . 1 1 80 80 ALA N N 80 118.736 118.736 119.931 -1.195 19946
4155 1 9 . 1 1 80 80 ALA HA H 80 4.412 4.412 4.461 -0.049 19946
4156 1 9 . 1 1 80 80 ALA CA C 80 50.801 50.801 50.606 0.195 19946
4157 1 9 . 1 1 80 80 ALA CB C 80 19.537 19.537 18.216 1.321 19946
4158 1 9 . 1 1 80 80 ALA H H 80 7.857 7.857 7.309 0.548 19946
4159 1 9 . 1 1 81 81 ALA N N 81 124.485 124.485 123.076 1.409 19946
4160 1 9 . 1 1 81 81 ALA HA H 81 4.353 4.353 4.799 -0.446 19946
4161 1 9 . 1 1 81 81 ALA CA C 81 51.305 51.305 49.637 1.668 19946
4162 1 9 . 1 1 81 81 ALA CB C 81 16.511 16.511 19.232 -2.721 19946
4163 1 9 . 1 1 81 81 ALA H H 81 7.191 7.191 7.366 -0.175 19946
4164 1 9 . 1 1 82 82 PRO CA C 82 62.903 62.903 63.016 -0.113 19946
4165 1 9 . 1 1 83 83 ALA N N 83 128.367 128.367 126.149 2.218 19946
4166 1 9 . 1 1 83 83 ALA HA H 83 4.058 4.058 4.538 -0.480 19946
4167 1 9 . 1 1 83 83 ALA CA C 83 52.314 52.314 51.990 0.324 19946
4168 1 9 . 1 1 83 83 ALA CB C 83 19.001 19.001 21.864 -2.863 19946
4169 1 9 . 1 1 83 83 ALA H H 83 8.472 8.472 8.200 0.272 19946
4170 1 9 . 1 1 84 84 GLU N N 84 122.108 122.108 120.756 1.352 19946
4171 1 9 . 1 1 84 84 GLU HA H 84 4.164 4.164 4.679 -0.515 19946
4172 1 9 . 1 1 84 84 GLU CA C 84 55.937 55.937 54.770 1.167 19946
4173 1 9 . 1 1 84 84 GLU CB C 84 30.213 30.213 29.596 0.617 19946
4174 1 9 . 1 1 84 84 GLU H H 84 8.106 8.106 8.288 -0.182 19946
4175 1 9 . 1 1 85 85 ILE N N 85 122.808 122.808 118.290 4.518 19946
4176 1 9 . 1 1 85 85 ILE HA H 85 5.211 5.211 4.107 1.104 19946
4177 1 9 . 1 1 85 85 ILE CA C 85 58.365 58.365 61.020 -2.655 19946
4178 1 9 . 1 1 85 85 ILE CB C 85 39.707 39.707 38.692 1.015 19946
4179 1 9 . 1 1 85 85 ILE H H 85 7.850 7.850 7.481 0.369 19946
4180 1 9 . 1 1 86 86 PHE N N 86 122.937 122.937 123.221 -0.284 19946
4181 1 9 . 1 1 86 86 PHE HA H 86 5.388 5.388 5.259 0.129 19946
4182 1 9 . 1 1 86 86 PHE CA C 86 54.509 54.509 54.929 -0.420 19946
4183 1 9 . 1 1 86 86 PHE CB C 86 42.878 42.878 41.362 1.516 19946
4184 1 9 . 1 1 86 86 PHE H H 86 9.004 9.004 8.870 0.134 19946
4185 1 9 . 1 1 87 87 LEU N N 87 120.712 120.712 118.948 1.764 19946
4186 1 9 . 1 1 87 87 LEU HA H 87 5.295 5.295 5.087 0.208 19946
4187 1 9 . 1 1 87 87 LEU CA C 87 51.810 51.810 53.855 -2.045 19946
4188 1 9 . 1 1 87 87 LEU CB C 87 42.059 42.059 44.720 -2.661 19946
4189 1 9 . 1 1 87 87 LEU H H 87 8.785 8.785 9.276 -0.491 19946
4190 1 9 . 1 1 88 88 LEU N N 88 124.779 124.779 121.794 2.985 19946
4191 1 9 . 1 1 88 88 LEU HA H 88 4.434 4.434 4.344 0.090 19946
4192 1 9 . 1 1 88 88 LEU CA C 88 54.331 54.331 53.700 0.631 19946
4193 1 9 . 1 1 88 88 LEU CB C 88 42.648 42.648 42.349 0.298 19946
4194 1 9 . 1 1 88 88 LEU H H 88 8.243 8.243 8.242 0.001 19946
4195 1 9 . 1 1 89 89 GLU N N 89 112.478 112.478 123.999 -11.521 19946
4196 1 9 . 1 1 89 89 GLU HA H 89 3.881 3.881 4.140 -0.259 19946
4197 1 9 . 1 1 89 89 GLU H H 89 9.343 9.343 8.028 1.315 19946
4198 1 9 . 1 1 90 90 ASP N N 90 120.709 120.709 120.285 0.424 19946
4199 1 9 . 1 1 90 90 ASP HA H 90 4.168 4.168 4.633 -0.465 19946
4200 1 9 . 1 1 90 90 ASP H H 90 9.062 9.062 8.536 0.526 19946
4201 1 9 . 1 1 91 91 GLY N N 91 105.049 105.049 110.586 -5.537 19946
4202 1 9 . 1 1 91 91 GLY CA C 91 46.263 46.263 44.798 1.465 19946
4203 1 9 . 1 1 91 91 GLY H H 91 7.848 7.848 7.850 -0.002 19946
4204 1 9 . 1 1 92 92 ILE N N 92 122.127 122.127 121.446 0.681 19946
4205 1 9 . 1 1 92 92 ILE HA H 92 3.811 3.811 4.183 -0.372 19946
4206 1 9 . 1 1 92 92 ILE CA C 92 62.656 62.656 61.464 1.192 19946
4207 1 9 . 1 1 92 92 ILE CB C 92 37.243 37.243 38.183 -0.940 19946
4208 1 9 . 1 1 92 92 ILE H H 92 8.077 8.077 8.586 -0.509 19946
4209 1 9 . 1 1 93 93 ASP N N 93 127.038 127.038 120.309 6.729 19946
4210 1 9 . 1 1 93 93 ASP HA H 93 4.452 4.452 4.379 0.073 19946
4211 1 9 . 1 1 93 93 ASP CA C 93 57.357 57.357 57.062 0.295 19946
4212 1 9 . 1 1 93 93 ASP CB C 93 38.194 38.194 39.033 -0.839 19946
4213 1 9 . 1 1 93 93 ASP H H 93 9.094 9.094 8.570 0.524 19946
4214 1 9 . 1 1 94 94 GLY N N 94 111.411 111.411 108.503 2.908 19946
4215 1 9 . 1 1 94 94 GLY CA C 94 44.750 44.750 46.969 -2.219 19946
4216 1 9 . 1 1 94 94 GLY H H 94 8.047 8.047 7.726 0.321 19946
4217 1 9 . 1 1 95 95 TRP N N 95 127.574 127.574 122.976 4.598 19946
4218 1 9 . 1 1 95 95 TRP HA H 95 3.738 3.738 4.366 -0.628 19946
4219 1 9 . 1 1 95 95 TRP CA C 95 60.852 60.852 58.772 2.080 19946
4220 1 9 . 1 1 95 95 TRP CB C 95 28.613 28.613 29.877 -1.264 19946
4221 1 9 . 1 1 95 95 TRP H H 95 7.918 7.918 8.105 -0.187 19946
4222 1 9 . 1 1 96 96 LYS N N 96 117.374 117.374 120.664 -3.290 19946
4223 1 9 . 1 1 96 96 LYS HA H 96 4.079 4.079 3.674 0.405 19946
4224 1 9 . 1 1 96 96 LYS CA C 96 59.091 59.091 58.541 0.550 19946
4225 1 9 . 1 1 96 96 LYS H H 96 8.625 8.625 8.440 0.185 19946
4226 1 9 . 1 1 97 97 LYS N N 97 123.490 123.490 119.591 3.899 19946
4227 1 9 . 1 1 97 97 LYS HA H 97 4.021 4.021 4.073 -0.052 19946
4228 1 9 . 1 1 97 97 LYS CB C 97 31.542 31.542 32.575 -1.033 19946
4229 1 9 . 1 1 97 97 LYS H H 97 8.233 8.233 8.369 -0.136 19946
4230 1 9 . 1 1 98 98 ALA N N 98 120.321 120.321 119.414 0.907 19946
4231 1 9 . 1 1 98 98 ALA HA H 98 4.248 4.248 4.469 -0.221 19946
4232 1 9 . 1 1 98 98 ALA CA C 98 51.305 51.305 51.345 -0.040 19946
4233 1 9 . 1 1 98 98 ALA CB C 98 17.744 17.744 18.947 -1.202 19946
4234 1 9 . 1 1 98 98 ALA H H 98 7.480 7.480 7.627 -0.147 19946
4235 1 9 . 1 1 99 99 GLY N N 99 106.984 106.984 108.049 -1.065 19946
4236 1 9 . 1 1 99 99 GLY CA C 99 44.246 44.246 45.755 -1.509 19946
4237 1 9 . 1 1 99 99 GLY H H 99 7.867 7.867 8.166 -0.299 19946
4238 1 9 . 1 1 100 100 LEU N N 100 122.993 122.993 119.323 3.670 19946
4239 1 9 . 1 1 100 100 LEU HA H 100 4.277 4.277 4.506 -0.229 19946
4240 1 9 . 1 1 100 100 LEU CA C 100 52.314 52.314 50.629 1.685 19946
4241 1 9 . 1 1 100 100 LEU CB C 100 36.786 36.786 42.536 -5.750 19946
4242 1 9 . 1 1 100 100 LEU H H 100 6.958 6.958 7.001 -0.043 19946
4243 1 9 . 1 1 101 101 PRO HA H 101 4.492 4.492 4.500 -0.008 19946
4244 1 9 . 1 1 101 101 PRO CB C 101 32.097 32.097 31.734 0.363 19946
4245 1 9 . 1 1 102 102 VAL N N 102 111.514 111.514 116.732 -5.218 19946
4246 1 9 . 1 1 102 102 VAL HA H 102 4.367 4.367 4.411 -0.044 19946
4247 1 9 . 1 1 102 102 VAL CA C 102 58.869 58.869 60.453 -1.584 19946
4248 1 9 . 1 1 102 102 VAL CB C 102 35.351 35.351 32.239 3.112 19946
4249 1 9 . 1 1 102 102 VAL H H 102 7.988 7.988 8.250 -0.262 19946
4250 1 9 . 1 1 103 103 ALA N N 103 126.676 126.676 123.202 3.474 19946
4251 1 9 . 1 1 103 103 ALA HA H 103 4.524 4.524 4.410 0.114 19946
4252 1 9 . 1 1 103 103 ALA CA C 103 49.793 49.793 51.857 -2.064 19946
4253 1 9 . 1 1 103 103 ALA CB C 103 18.600 18.600 17.605 0.995 19946
4254 1 9 . 1 1 103 103 ALA H H 103 8.919 8.919 8.404 0.515 19946
4255 1 9 . 1 1 104 104 VAL N N 104 121.148 121.148 123.886 -2.738 19946
4256 1 9 . 1 1 104 104 VAL HA H 104 4.475 4.475 4.245 0.230 19946
4257 1 9 . 1 1 104 104 VAL CA C 104 59.374 59.374 60.541 -1.167 19946
4258 1 9 . 1 1 104 104 VAL CB C 104 33.884 33.884 33.093 0.791 19946
4259 1 9 . 1 1 104 104 VAL H H 104 8.241 8.241 7.937 0.304 19946
4260 1 9 . 1 1 105 105 ASN N N 105 123.816 123.816 120.620 3.196 19946
4261 1 9 . 1 1 105 105 ASN HA H 105 4.674 4.674 4.633 0.041 19946
4262 1 9 . 1 1 105 105 ASN CA C 105 53.200 53.200 53.321 -0.121 19946
4263 1 9 . 1 1 105 105 ASN CB C 105 37.959 37.959 37.792 0.167 19946
4264 1 9 . 1 1 105 105 ASN H H 105 8.150 8.150 8.312 -0.162 19946
4265 1 9 . 1 1 106 106 LYS N N 106 123.804 123.804 123.389 0.415 19946
4266 1 9 . 1 1 106 106 LYS H H 106 8.340 8.340 8.403 -0.063 19946
4267 1 10 . 1 1 2 2 LEU N N 2 120.763 120.763 120.079 0.684 19946
4268 1 10 . 1 1 2 2 LEU HA H 2 4.384 4.384 4.283 0.101 19946
4269 1 10 . 1 1 2 2 LEU CA C 2 53.827 53.827 56.148 -2.321 19946
4270 1 10 . 1 1 2 2 LEU CB C 2 42.229 42.229 40.535 1.694 19946
4271 1 10 . 1 1 2 2 LEU H H 2 7.888 7.888 8.540 -0.652 19946
4272 1 10 . 1 1 3 3 THR N N 3 118.330 118.330 121.021 -2.691 19946
4273 1 10 . 1 1 3 3 THR HA H 3 4.469 4.469 4.622 -0.153 19946
4274 1 10 . 1 1 3 3 THR CA C 3 61.391 61.391 60.921 0.470 19946
4275 1 10 . 1 1 3 3 THR CB C 3 69.496 69.496 72.631 -3.135 19946
4276 1 10 . 1 1 3 3 THR H H 3 7.905 7.905 7.928 -0.023 19946
4277 1 10 . 1 1 4 4 THR N N 4 122.024 122.024 118.034 3.990 19946
4278 1 10 . 1 1 4 4 THR HA H 4 5.171 5.171 4.512 0.659 19946
4279 1 10 . 1 1 4 4 THR CA C 4 61.595 61.595 62.227 -0.632 19946
4280 1 10 . 1 1 4 4 THR CB C 4 69.027 69.027 69.796 -0.769 19946
4281 1 10 . 1 1 4 4 THR H H 4 8.504 8.504 8.425 0.079 19946
4282 1 10 . 1 1 5 5 ILE N N 5 122.667 122.667 127.155 -4.488 19946
4283 1 10 . 1 1 5 5 ILE HA H 5 4.973 4.973 4.345 0.628 19946
4284 1 10 . 1 1 5 5 ILE CA C 5 57.971 57.971 58.893 -0.922 19946
4285 1 10 . 1 1 5 5 ILE CB C 5 41.458 41.458 41.775 -0.317 19946
4286 1 10 . 1 1 5 5 ILE H H 5 8.903 8.903 8.753 0.150 19946
4287 1 10 . 1 1 6 6 SER N N 6 123.156 123.156 123.117 0.039 19946
4288 1 10 . 1 1 6 6 SER HA H 6 4.785 4.785 4.674 0.111 19946
4289 1 10 . 1 1 6 6 SER H H 6 9.138 9.138 8.783 0.355 19946
4290 1 10 . 1 1 7 7 PRO HA H 7 4.004 4.004 4.574 -0.570 19946
4291 1 10 . 1 1 7 7 PRO CA C 7 65.510 65.510 64.396 1.114 19946
4292 1 10 . 1 1 7 7 PRO CB C 7 30.924 30.924 32.073 -1.149 19946
4293 1 10 . 1 1 8 8 HIS N N 8 114.319 114.319 115.552 -1.233 19946
4294 1 10 . 1 1 8 8 HIS HA H 8 3.989 3.989 4.538 -0.549 19946
4295 1 10 . 1 1 8 8 HIS CA C 8 60.050 60.050 58.744 1.306 19946
4296 1 10 . 1 1 8 8 HIS CB C 8 28.613 28.613 30.358 -1.745 19946
4297 1 10 . 1 1 8 8 HIS H H 8 8.127 8.127 8.280 -0.153 19946
4298 1 10 . 1 1 9 9 ASP N N 9 121.300 121.300 118.969 2.331 19946
4299 1 10 . 1 1 9 9 ASP HA H 9 4.301 4.301 4.613 -0.312 19946
4300 1 10 . 1 1 9 9 ASP CA C 9 56.455 56.455 55.523 0.932 19946
4301 1 10 . 1 1 9 9 ASP CB C 9 38.699 38.699 41.537 -2.838 19946
4302 1 10 . 1 1 9 9 ASP H H 9 7.639 7.639 7.809 -0.170 19946
4303 1 10 . 1 1 10 10 ALA N N 10 123.991 123.991 123.709 0.282 19946
4304 1 10 . 1 1 10 10 ALA HA H 10 3.719 3.719 4.020 -0.301 19946
4305 1 10 . 1 1 10 10 ALA CA C 10 54.331 54.331 55.198 -0.867 19946
4306 1 10 . 1 1 10 10 ALA CB C 10 17.549 17.549 18.414 -0.865 19946
4307 1 10 . 1 1 10 10 ALA H H 10 8.820 8.820 8.401 0.419 19946
4308 1 10 . 1 1 11 11 GLN N N 11 118.128 118.128 116.571 1.557 19946
4309 1 10 . 1 1 11 11 GLN HA H 11 3.933 3.933 4.181 -0.248 19946
4310 1 10 . 1 1 11 11 GLN CA C 11 59.389 59.389 58.005 1.384 19946
4311 1 10 . 1 1 11 11 GLN CB C 11 27.948 27.948 28.457 -0.510 19946
4312 1 10 . 1 1 11 11 GLN H H 11 8.353 8.353 8.423 -0.070 19946
4313 1 10 . 1 1 12 12 GLU N N 12 119.307 119.307 120.589 -1.282 19946
4314 1 10 . 1 1 12 12 GLU HA H 12 4.023 4.023 4.257 -0.234 19946
4315 1 10 . 1 1 12 12 GLU CA C 12 58.476 58.476 58.640 -0.164 19946
4316 1 10 . 1 1 12 12 GLU CB C 12 28.532 28.532 30.232 -1.700 19946
4317 1 10 . 1 1 12 12 GLU H H 12 7.197 7.197 7.989 -0.792 19946
4318 1 10 . 1 1 13 13 LEU N N 13 120.635 120.635 118.941 1.694 19946
4319 1 10 . 1 1 13 13 LEU HA H 13 3.821 3.821 4.103 -0.282 19946
4320 1 10 . 1 1 13 13 LEU CA C 13 57.065 57.065 58.174 -1.109 19946
4321 1 10 . 1 1 13 13 LEU CB C 13 40.890 40.890 41.349 -0.459 19946
4322 1 10 . 1 1 13 13 LEU H H 13 7.554 7.554 7.591 -0.037 19946
4323 1 10 . 1 1 14 14 ILE N N 14 123.021 123.021 119.856 3.165 19946
4324 1 10 . 1 1 14 14 ILE HA H 14 3.827 3.827 3.784 0.043 19946
4325 1 10 . 1 1 14 14 ILE CA C 14 64.053 64.053 65.162 -1.109 19946
4326 1 10 . 1 1 14 14 ILE CB C 14 38.115 38.115 37.692 0.423 19946
4327 1 10 . 1 1 14 14 ILE H H 14 8.710 8.710 7.989 0.721 19946
4328 1 10 . 1 1 15 15 ALA N N 15 124.504 124.504 120.552 3.952 19946
4329 1 10 . 1 1 15 15 ALA HA H 15 4.115 4.115 4.136 -0.021 19946
4330 1 10 . 1 1 15 15 ALA CA C 15 54.257 54.257 54.023 0.234 19946
4331 1 10 . 1 1 15 15 ALA CB C 15 17.040 17.040 18.430 -1.390 19946
4332 1 10 . 1 1 15 15 ALA H H 15 7.758 7.758 7.852 -0.094 19946
4333 1 10 . 1 1 16 16 ARG N N 16 115.990 115.990 116.270 -0.280 19946
4334 1 10 . 1 1 16 16 ARG HA H 16 4.348 4.348 4.305 0.043 19946
4335 1 10 . 1 1 16 16 ARG CA C 16 55.416 55.416 56.830 -1.414 19946
4336 1 10 . 1 1 16 16 ARG CB C 16 29.762 29.762 30.890 -1.128 19946
4337 1 10 . 1 1 16 16 ARG H H 16 7.252 7.252 7.603 -0.351 19946
4338 1 10 . 1 1 17 17 GLY N N 17 107.981 107.981 105.534 2.447 19946
4339 1 10 . 1 1 17 17 GLY CA C 17 44.854 44.854 44.735 0.119 19946
4340 1 10 . 1 1 17 17 GLY H H 17 7.748 7.748 7.517 0.231 19946
4341 1 10 . 1 1 18 18 ALA N N 18 123.914 123.914 125.103 -1.189 19946
4342 1 10 . 1 1 18 18 ALA HA H 18 4.221 4.221 4.239 -0.018 19946
4343 1 10 . 1 1 18 18 ALA CA C 18 52.270 52.270 53.007 -0.737 19946
4344 1 10 . 1 1 18 18 ALA CB C 18 18.638 18.638 19.533 -0.895 19946
4345 1 10 . 1 1 18 18 ALA H H 18 7.940 7.940 7.895 0.045 19946
4346 1 10 . 1 1 19 19 LYS N N 19 119.436 119.436 122.599 -3.163 19946
4347 1 10 . 1 1 19 19 LYS HA H 19 4.301 4.301 4.771 -0.470 19946
4348 1 10 . 1 1 19 19 LYS CA C 19 53.105 53.105 54.661 -1.556 19946
4349 1 10 . 1 1 19 19 LYS CB C 19 32.856 32.856 36.819 -3.963 19946
4350 1 10 . 1 1 19 19 LYS H H 19 7.565 7.565 7.785 -0.220 19946
4351 1 10 . 1 1 20 20 LEU N N 20 127.401 127.401 121.483 5.918 19946
4352 1 10 . 1 1 20 20 LEU HA H 20 5.042 5.042 5.141 -0.099 19946
4353 1 10 . 1 1 20 20 LEU CA C 20 52.314 52.314 53.471 -1.157 19946
4354 1 10 . 1 1 20 20 LEU CB C 20 43.234 43.234 45.435 -2.201 19946
4355 1 10 . 1 1 20 20 LEU H H 20 8.727 8.727 8.589 0.138 19946
4356 1 10 . 1 1 21 21 ILE N N 21 128.186 128.186 122.023 6.163 19946
4357 1 10 . 1 1 21 21 ILE HA H 21 4.547 4.547 4.522 0.025 19946
4358 1 10 . 1 1 21 21 ILE CA C 21 59.589 59.589 59.886 -0.297 19946
4359 1 10 . 1 1 21 21 ILE CB C 21 38.545 38.545 42.512 -3.967 19946
4360 1 10 . 1 1 21 21 ILE H H 21 9.366 9.366 8.434 0.932 19946
4361 1 10 . 1 1 22 22 ASP N N 22 129.968 129.968 128.601 1.367 19946
4362 1 10 . 1 1 22 22 ASP HA H 22 3.803 3.803 4.865 -1.062 19946
4363 1 10 . 1 1 22 22 ASP CA C 22 51.435 51.435 52.808 -1.373 19946
4364 1 10 . 1 1 22 22 ASP CB C 22 42.062 42.062 40.693 1.369 19946
4365 1 10 . 1 1 22 22 ASP H H 22 8.583 8.583 8.256 0.327 19946
4366 1 10 . 1 1 23 23 ILE N N 23 116.266 116.266 121.070 -4.804 19946
4367 1 10 . 1 1 23 23 ILE HA H 23 5.229 5.229 3.962 1.267 19946
4368 1 10 . 1 1 23 23 ILE CA C 23 59.374 59.374 60.692 -1.318 19946
4369 1 10 . 1 1 23 23 ILE CB C 23 37.327 37.327 36.141 1.186 19946
4370 1 10 . 1 1 23 23 ILE H H 23 7.836 7.836 8.168 -0.332 19946
4371 1 10 . 1 1 24 24 ARG N N 24 125.001 125.001 119.935 5.066 19946
4372 1 10 . 1 1 24 24 ARG HA H 24 4.116 4.116 4.520 -0.404 19946
4373 1 10 . 1 1 24 24 ARG CA C 24 55.943 55.943 54.335 1.608 19946
4374 1 10 . 1 1 24 24 ARG CB C 24 30.135 30.135 31.530 -1.395 19946
4375 1 10 . 1 1 24 24 ARG H H 24 8.195 8.195 7.283 0.912 19946
4376 1 10 . 1 1 25 25 ASP N N 25 112.839 112.839 119.485 -6.646 19946
4377 1 10 . 1 1 25 25 ASP HA H 25 4.545 4.545 4.452 0.093 19946
4378 1 10 . 1 1 25 25 ASP CA C 25 53.870 53.870 55.086 -1.216 19946
4379 1 10 . 1 1 25 25 ASP CB C 25 41.327 41.327 41.278 0.049 19946
4380 1 10 . 1 1 25 25 ASP H H 25 7.660 7.660 8.315 -0.655 19946
4381 1 10 . 1 1 26 26 ALA N N 26 122.145 122.145 122.344 -0.199 19946
4382 1 10 . 1 1 26 26 ALA HA H 26 3.897 3.897 4.275 -0.378 19946
4383 1 10 . 1 1 26 26 ALA CA C 26 54.958 54.958 53.534 1.424 19946
4384 1 10 . 1 1 26 26 ALA CB C 26 17.520 17.520 20.504 -2.984 19946
4385 1 10 . 1 1 26 26 ALA H H 26 8.766 8.766 8.293 0.473 19946
4386 1 10 . 1 1 27 27 ASP N N 27 115.380 115.380 116.775 -1.395 19946
4387 1 10 . 1 1 27 27 ASP HA H 27 4.299 4.299 4.659 -0.360 19946
4388 1 10 . 1 1 27 27 ASP CA C 27 56.451 56.451 54.656 1.795 19946
4389 1 10 . 1 1 27 27 ASP CB C 27 39.156 39.156 41.331 -2.175 19946
4390 1 10 . 1 1 27 27 ASP H H 27 8.686 8.686 8.065 0.621 19946
4391 1 10 . 1 1 28 28 GLU N N 28 120.081 120.081 119.202 0.879 19946
4392 1 10 . 1 1 28 28 GLU HA H 28 4.086 4.086 4.180 -0.094 19946
4393 1 10 . 1 1 28 28 GLU CA C 28 58.389 58.389 58.419 -0.030 19946
4394 1 10 . 1 1 28 28 GLU CB C 28 28.728 28.728 29.928 -1.200 19946
4395 1 10 . 1 1 28 28 GLU H H 28 7.397 7.397 8.454 -1.057 19946
4396 1 10 . 1 1 29 29 TYR N N 29 121.205 121.205 118.061 3.144 19946
4397 1 10 . 1 1 29 29 TYR HA H 29 4.083 4.083 4.515 -0.432 19946
4398 1 10 . 1 1 29 29 TYR CA C 29 60.378 60.378 58.251 2.127 19946
4399 1 10 . 1 1 29 29 TYR CB C 29 38.699 38.699 39.692 -0.993 19946
4400 1 10 . 1 1 29 29 TYR H H 29 7.506 7.506 7.654 -0.148 19946
4401 1 10 . 1 1 30 30 LEU N N 30 118.828 118.828 120.103 -1.275 19946
4402 1 10 . 1 1 30 30 LEU HA H 30 3.850 3.850 3.916 -0.066 19946
4403 1 10 . 1 1 30 30 LEU CA C 30 56.348 56.348 55.280 1.068 19946
4404 1 10 . 1 1 30 30 LEU CB C 30 41.220 41.220 40.864 0.357 19946
4405 1 10 . 1 1 30 30 LEU H H 30 8.211 8.211 8.034 0.177 19946
4406 1 10 . 1 1 31 31 ARG N N 31 118.220 118.220 118.673 -0.453 19946
4407 1 10 . 1 1 31 31 ARG HA H 31 4.101 4.101 4.160 -0.059 19946
4408 1 10 . 1 1 31 31 ARG CA C 31 58.365 58.365 57.382 0.983 19946
4409 1 10 . 1 1 31 31 ARG CB C 31 30.074 30.074 31.140 -1.066 19946
4410 1 10 . 1 1 31 31 ARG H H 31 7.120 7.120 8.256 -1.136 19946
4411 1 10 . 1 1 32 32 GLU N N 32 117.980 117.980 118.598 -0.618 19946
4412 1 10 . 1 1 32 32 GLU HA H 32 4.884 4.884 4.325 0.559 19946
4413 1 10 . 1 1 32 32 GLU CA C 32 55.339 55.339 57.751 -2.412 19946
4414 1 10 . 1 1 32 32 GLU CB C 32 31.698 31.698 30.635 1.063 19946
4415 1 10 . 1 1 32 32 GLU H H 32 7.506 7.506 8.311 -0.805 19946
4416 1 10 . 1 1 33 33 HIS N N 33 118.257 118.257 117.494 0.763 19946
4417 1 10 . 1 1 33 33 HIS HA H 33 4.643 4.643 4.643 -0.000 19946
4418 1 10 . 1 1 33 33 HIS CA C 33 53.766 53.766 54.806 -1.040 19946
4419 1 10 . 1 1 33 33 HIS CB C 33 29.940 29.940 30.764 -0.824 19946
4420 1 10 . 1 1 33 33 HIS H H 33 8.269 8.269 8.569 -0.300 19946
4421 1 10 . 1 1 34 34 ILE N N 34 127.809 127.809 125.316 2.493 19946
4422 1 10 . 1 1 34 34 ILE HA H 34 3.920 3.920 3.960 -0.040 19946
4423 1 10 . 1 1 34 34 ILE CA C 34 59.648 59.648 60.957 -1.309 19946
4424 1 10 . 1 1 34 34 ILE CB C 34 37.959 37.959 38.831 -0.872 19946
4425 1 10 . 1 1 34 34 ILE H H 34 9.989 9.989 8.489 1.500 19946
4426 1 10 . 1 1 35 35 PRO HA H 35 4.198 4.198 4.215 -0.017 19946
4427 1 10 . 1 1 36 36 GLU N N 36 114.414 114.414 117.065 -2.651 19946
4428 1 10 . 1 1 36 36 GLU HA H 36 4.082 4.082 4.282 -0.200 19946
4429 1 10 . 1 1 36 36 GLU CA C 36 57.861 57.861 56.678 1.183 19946
4430 1 10 . 1 1 36 36 GLU CB C 36 28.109 28.109 30.017 -1.908 19946
4431 1 10 . 1 1 36 36 GLU H H 36 8.557 8.557 7.291 1.266 19946
4432 1 10 . 1 1 37 37 ALA N N 37 122.882 122.882 123.630 -0.748 19946
4433 1 10 . 1 1 37 37 ALA HA H 37 4.439 4.439 4.580 -0.141 19946
4434 1 10 . 1 1 37 37 ALA CA C 37 52.005 52.005 51.607 0.398 19946
4435 1 10 . 1 1 37 37 ALA CB C 37 20.438 20.438 22.174 -1.736 19946
4436 1 10 . 1 1 37 37 ALA H H 37 8.096 8.096 8.099 -0.003 19946
4437 1 10 . 1 1 38 38 ASP N N 38 124.471 124.471 119.421 5.050 19946
4438 1 10 . 1 1 38 38 ASP HA H 38 4.844 4.844 4.851 -0.007 19946
4439 1 10 . 1 1 38 38 ASP CA C 38 52.614 52.614 54.158 -1.544 19946
4440 1 10 . 1 1 38 38 ASP CB C 38 44.407 44.407 44.150 0.257 19946
4441 1 10 . 1 1 38 38 ASP H H 38 9.004 9.004 9.244 -0.240 19946
4442 1 10 . 1 1 39 39 LEU N N 39 123.936 123.936 125.404 -1.468 19946
4443 1 10 . 1 1 39 39 LEU HA H 39 4.328 4.328 4.054 0.274 19946
4444 1 10 . 1 1 39 39 LEU CA C 39 54.037 54.037 56.107 -2.070 19946
4445 1 10 . 1 1 39 39 LEU CB C 39 41.220 41.220 42.227 -1.008 19946
4446 1 10 . 1 1 39 39 LEU H H 39 8.125 8.125 8.713 -0.588 19946
4447 1 10 . 1 1 40 40 ALA N N 40 131.297 131.297 128.005 3.292 19946
4448 1 10 . 1 1 40 40 ALA HA H 40 4.408 4.408 4.632 -0.224 19946
4449 1 10 . 1 1 40 40 ALA CA C 40 48.784 48.784 50.407 -1.623 19946
4450 1 10 . 1 1 40 40 ALA CB C 40 17.979 17.979 19.249 -1.270 19946
4451 1 10 . 1 1 40 40 ALA H H 40 8.654 8.654 8.100 0.554 19946
4452 1 10 . 1 1 41 41 PRO HA H 41 4.101 4.101 4.548 -0.447 19946
4453 1 10 . 1 1 41 41 PRO CA C 41 61.391 61.391 62.067 -0.676 19946
4454 1 10 . 1 1 41 41 PRO CB C 41 32.097 32.097 32.655 -0.558 19946
4455 1 10 . 1 1 42 42 LEU N N 42 125.312 125.312 120.174 5.138 19946
4456 1 10 . 1 1 42 42 LEU HA H 42 3.871 3.871 3.798 0.073 19946
4457 1 10 . 1 1 42 42 LEU CA C 42 57.861 57.861 58.724 -0.863 19946
4458 1 10 . 1 1 42 42 LEU CB C 42 40.941 40.941 41.556 -0.615 19946
4459 1 10 . 1 1 42 42 LEU H H 42 8.285 8.285 8.635 -0.350 19946
4460 1 10 . 1 1 43 43 SER N N 43 110.669 110.669 113.507 -2.838 19946
4461 1 10 . 1 1 43 43 SER HA H 43 4.106 4.106 4.048 0.058 19946
4462 1 10 . 1 1 43 43 SER CA C 43 60.497 60.497 61.460 -0.963 19946
4463 1 10 . 1 1 43 43 SER CB C 43 61.391 61.391 62.506 -1.115 19946
4464 1 10 . 1 1 43 43 SER H H 43 8.453 8.453 8.312 0.141 19946
4465 1 10 . 1 1 44 44 VAL N N 44 123.933 123.933 123.292 0.641 19946
4466 1 10 . 1 1 44 44 VAL HA H 44 3.821 3.821 3.785 0.036 19946
4467 1 10 . 1 1 44 44 VAL CA C 44 64.752 64.752 66.197 -1.445 19946
4468 1 10 . 1 1 44 44 VAL CB C 44 31.135 31.135 31.738 -0.603 19946
4469 1 10 . 1 1 44 44 VAL H H 44 7.156 7.156 7.609 -0.453 19946
4470 1 10 . 1 1 45 45 LEU N N 45 121.150 121.150 119.295 1.855 19946
4471 1 10 . 1 1 45 45 LEU HA H 45 3.767 3.767 4.023 -0.256 19946
4472 1 10 . 1 1 45 45 LEU CA C 45 56.599 56.599 57.701 -1.102 19946
4473 1 10 . 1 1 45 45 LEU CB C 45 40.890 40.890 41.267 -0.376 19946
4474 1 10 . 1 1 45 45 LEU H H 45 7.997 7.997 8.914 -0.917 19946
4475 1 10 . 1 1 46 46 GLU N N 46 116.256 116.256 118.905 -2.649 19946
4476 1 10 . 1 1 46 46 GLU HA H 46 3.678 3.678 4.246 -0.568 19946
4477 1 10 . 1 1 46 46 GLU CA C 46 58.365 58.365 58.205 0.160 19946
4478 1 10 . 1 1 46 46 GLU CB C 46 29.622 29.622 29.964 -0.342 19946
4479 1 10 . 1 1 46 46 GLU H H 46 8.501 8.501 8.182 0.319 19946
4480 1 10 . 1 1 47 47 GLN N N 47 117.261 117.261 118.132 -0.871 19946
4481 1 10 . 1 1 47 47 GLN HA H 47 4.216 4.216 4.135 0.081 19946
4482 1 10 . 1 1 47 47 GLN CA C 47 56.852 56.852 58.186 -1.334 19946
4483 1 10 . 1 1 47 47 GLN CB C 47 29.119 29.119 29.188 -0.069 19946
4484 1 10 . 1 1 47 47 GLN H H 47 7.407 7.407 8.514 -1.107 19946
4485 1 10 . 1 1 48 48 SER N N 48 111.890 111.890 112.566 -0.676 19946
4486 1 10 . 1 1 48 48 SER HA H 48 4.641 4.641 4.449 0.192 19946
4487 1 10 . 1 1 48 48 SER CA C 48 57.956 57.956 58.373 -0.417 19946
4488 1 10 . 1 1 48 48 SER CB C 48 63.912 63.912 64.806 -0.894 19946
4489 1 10 . 1 1 48 48 SER H H 48 8.566 8.566 7.995 0.571 19946
4490 1 10 . 1 1 49 49 GLY N N 49 111.545 111.545 109.197 2.348 19946
4491 1 10 . 1 1 49 49 GLY CA C 49 43.894 43.894 44.469 -0.575 19946
4492 1 10 . 1 1 49 49 GLY H H 49 7.836 7.836 7.896 -0.060 19946
4493 1 10 . 1 1 50 50 LEU N N 50 121.541 121.541 122.187 -0.646 19946
4494 1 10 . 1 1 50 50 LEU HA H 50 4.239 4.239 4.267 -0.028 19946
4495 1 10 . 1 1 50 50 LEU CA C 50 51.985 51.985 53.657 -1.672 19946
4496 1 10 . 1 1 50 50 LEU CB C 50 42.648 42.648 42.441 0.206 19946
4497 1 10 . 1 1 50 50 LEU H H 50 8.564 8.564 8.458 0.106 19946
4498 1 10 . 1 1 51 51 PRO HA H 51 4.243 4.243 4.555 -0.312 19946
4499 1 10 . 1 1 51 51 PRO CB C 51 31.639 31.639 30.283 1.356 19946
4500 1 10 . 1 1 52 52 ALA N N 52 127.008 127.008 126.423 0.585 19946
4501 1 10 . 1 1 52 52 ALA HA H 52 3.790 3.790 3.966 -0.176 19946
4502 1 10 . 1 1 52 52 ALA CA C 52 54.835 54.835 54.948 -0.113 19946
4503 1 10 . 1 1 52 52 ALA CB C 52 17.715 17.715 18.653 -0.938 19946
4504 1 10 . 1 1 52 52 ALA H H 52 8.564 8.564 8.196 0.368 19946
4505 1 10 . 1 1 53 53 LYS N N 53 114.535 114.535 115.897 -1.362 19946
4506 1 10 . 1 1 53 53 LYS HA H 53 4.106 4.106 4.118 -0.012 19946
4507 1 10 . 1 1 53 53 LYS CA C 53 56.852 56.852 58.159 -1.307 19946
4508 1 10 . 1 1 53 53 LYS CB C 53 31.386 31.386 32.054 -0.669 19946
4509 1 10 . 1 1 53 53 LYS H H 53 8.364 8.364 8.349 0.015 19946
4510 1 10 . 1 1 54 54 LEU N N 54 118.515 118.515 117.406 1.109 19946
4511 1 10 . 1 1 54 54 LEU HA H 54 4.247 4.247 4.685 -0.438 19946
4512 1 10 . 1 1 54 54 LEU CA C 54 53.338 53.338 53.942 -0.604 19946
4513 1 10 . 1 1 54 54 LEU CB C 54 40.890 40.890 41.685 -0.795 19946
4514 1 10 . 1 1 54 54 LEU H H 54 7.745 7.745 8.077 -0.332 19946
4515 1 10 . 1 1 55 55 ARG N N 55 117.612 117.612 119.877 -2.265 19946
4516 1 10 . 1 1 55 55 ARG HA H 55 3.927 3.927 4.578 -0.651 19946
4517 1 10 . 1 1 55 55 ARG CA C 55 56.832 56.832 54.848 1.984 19946
4518 1 10 . 1 1 55 55 ARG CB C 55 28.610 28.610 33.287 -4.677 19946
4519 1 10 . 1 1 55 55 ARG H H 55 6.938 6.938 7.389 -0.451 19946
4520 1 10 . 1 1 56 56 HIS N N 56 123.269 123.269 118.047 5.222 19946
4521 1 10 . 1 1 56 56 HIS HA H 56 4.614 4.614 4.807 -0.193 19946
4522 1 10 . 1 1 56 56 HIS CA C 56 54.835 54.835 55.571 -0.736 19946
4523 1 10 . 1 1 56 56 HIS CB C 56 32.648 32.648 33.134 -0.486 19946
4524 1 10 . 1 1 56 56 HIS H H 56 7.237 7.237 8.462 -1.225 19946
4525 1 10 . 1 1 57 57 GLU N N 57 120.895 120.895 119.508 1.387 19946
4526 1 10 . 1 1 57 57 GLU HA H 57 3.976 3.976 4.136 -0.160 19946
4527 1 10 . 1 1 57 57 GLU CA C 57 58.871 58.871 58.511 0.360 19946
4528 1 10 . 1 1 57 57 GLU CB C 57 29.158 29.158 30.216 -1.058 19946
4529 1 10 . 1 1 57 57 GLU H H 57 7.625 7.625 8.887 -1.262 19946
4530 1 10 . 1 1 58 58 GLN N N 58 118.485 118.485 109.987 8.498 19946
4531 1 10 . 1 1 58 58 GLN HA H 58 5.425 5.425 5.136 0.289 19946
4532 1 10 . 1 1 58 58 GLN CA C 58 54.910 54.910 54.689 0.221 19946
4533 1 10 . 1 1 58 58 GLN CB C 58 32.285 32.285 32.397 -0.112 19946
4534 1 10 . 1 1 58 58 GLN H H 58 8.335 8.335 7.526 0.809 19946
4535 1 10 . 1 1 59 59 ILE N N 59 123.505 123.505 120.794 2.711 19946
4536 1 10 . 1 1 59 59 ILE HA H 59 4.492 4.492 5.207 -0.715 19946
4537 1 10 . 1 1 59 59 ILE CA C 59 58.869 58.869 58.592 0.277 19946
4538 1 10 . 1 1 59 59 ILE CB C 59 42.332 42.332 42.368 -0.036 19946
4539 1 10 . 1 1 59 59 ILE H H 59 8.704 8.704 8.530 0.174 19946
4540 1 10 . 1 1 60 60 ILE N N 60 126.464 126.464 122.957 3.507 19946
4541 1 10 . 1 1 60 60 ILE HA H 60 4.954 4.954 4.395 0.559 19946
4542 1 10 . 1 1 60 60 ILE CA C 60 57.357 57.357 60.049 -2.692 19946
4543 1 10 . 1 1 60 60 ILE CB C 60 39.131 39.131 40.042 -0.911 19946
4544 1 10 . 1 1 60 60 ILE H H 60 9.006 9.006 8.131 0.875 19946
4545 1 10 . 1 1 61 61 PHE N N 61 124.441 124.441 122.967 1.474 19946
4546 1 10 . 1 1 61 61 PHE HA H 61 5.795 5.795 5.163 0.632 19946
4547 1 10 . 1 1 61 61 PHE CA C 61 56.131 56.131 55.638 0.493 19946
4548 1 10 . 1 1 61 61 PHE CB C 61 42.879 42.879 41.099 1.780 19946
4549 1 10 . 1 1 61 61 PHE H H 61 8.938 8.938 7.461 1.477 19946
4550 1 10 . 1 1 62 62 HIS N N 62 117.494 117.494 118.097 -0.603 19946
4551 1 10 . 1 1 62 62 HIS HA H 62 5.928 5.928 5.046 0.882 19946
4552 1 10 . 1 1 62 62 HIS CA C 62 53.322 53.322 56.062 -2.740 19946
4553 1 10 . 1 1 62 62 HIS CB C 62 35.673 35.673 33.614 2.059 19946
4554 1 10 . 1 1 62 62 HIS H H 62 9.230 9.230 8.617 0.613 19946
4555 1 10 . 1 1 63 63 CYS N N 63 120.220 120.220 122.531 -2.311 19946
4556 1 10 . 1 1 63 63 CYS HA H 63 5.033 5.033 4.297 0.736 19946
4557 1 10 . 1 1 63 63 CYS CA C 63 56.131 56.131 58.960 -2.829 19946
4558 1 10 . 1 1 63 63 CYS CB C 63 28.109 28.109 29.710 -1.601 19946
4559 1 10 . 1 1 63 63 CYS H H 63 8.131 8.131 8.516 -0.385 19946
4560 1 10 . 1 1 65 65 ALA N N 65 119.272 119.272 120.148 -0.876 19946
4561 1 10 . 1 1 65 65 ALA HA H 65 5.063 5.063 4.616 0.447 19946
4562 1 10 . 1 1 65 65 ALA CA C 65 49.793 49.793 51.546 -1.753 19946
4563 1 10 . 1 1 65 65 ALA CB C 65 19.775 19.775 18.276 1.499 19946
4564 1 10 . 1 1 65 65 ALA H H 65 8.967 8.967 8.118 0.849 19946
4565 1 10 . 1 1 66 66 GLY N N 66 113.296 113.296 109.093 4.203 19946
4566 1 10 . 1 1 66 66 GLY CA C 66 44.934 44.934 45.374 -0.440 19946
4567 1 10 . 1 1 66 66 GLY H H 66 8.778 8.778 7.969 0.809 19946
4568 1 10 . 1 1 67 67 LYS N N 67 121.300 121.300 117.295 4.005 19946
4569 1 10 . 1 1 67 67 LYS HA H 67 4.211 4.211 4.680 -0.469 19946
4570 1 10 . 1 1 67 67 LYS H H 67 8.111 8.111 8.072 0.039 19946
4571 1 10 . 1 1 68 68 ARG N N 68 126.092 126.092 120.793 5.299 19946
4572 1 10 . 1 1 68 68 ARG H H 68 9.067 9.067 8.747 0.320 19946
4573 1 10 . 1 1 69 69 THR N N 69 117.153 117.153 115.645 1.508 19946
4574 1 10 . 1 1 69 69 THR HA H 69 3.576 3.576 4.338 -0.762 19946
4575 1 10 . 1 1 69 69 THR CA C 69 65.397 65.397 62.872 2.525 19946
4576 1 10 . 1 1 69 69 THR CB C 69 66.938 66.938 69.135 -2.197 19946
4577 1 10 . 1 1 69 69 THR H H 69 10.233 10.233 8.037 2.196 19946
4578 1 10 . 1 1 70 70 SER N N 70 113.686 113.686 116.032 -2.346 19946
4579 1 10 . 1 1 70 70 SER HA H 70 4.091 4.091 4.424 -0.333 19946
4580 1 10 . 1 1 70 70 SER CA C 70 61.391 61.391 59.711 1.681 19946
4581 1 10 . 1 1 70 70 SER CB C 70 65.425 65.425 62.950 2.475 19946
4582 1 10 . 1 1 70 70 SER H H 70 7.322 7.322 8.345 -1.023 19946
4583 1 10 . 1 1 71 71 ASN N N 71 118.257 118.257 119.267 -1.010 19946
4584 1 10 . 1 1 71 71 ASN HA H 71 4.177 4.177 4.536 -0.359 19946
4585 1 10 . 1 1 71 71 ASN CA C 71 54.736 54.736 55.289 -0.553 19946
4586 1 10 . 1 1 71 71 ASN CB C 71 38.391 38.391 38.618 -0.227 19946
4587 1 10 . 1 1 71 71 ASN H H 71 7.863 7.863 8.660 -0.797 19946
4588 1 10 . 1 1 72 72 ASN N N 72 115.529 115.529 115.265 0.264 19946
4589 1 10 . 1 1 72 72 ASN HA H 72 5.127 5.127 4.910 0.217 19946
4590 1 10 . 1 1 72 72 ASN CA C 72 52.173 52.173 53.200 -1.027 19946
4591 1 10 . 1 1 72 72 ASN CB C 72 39.165 39.165 39.184 -0.018 19946
4592 1 10 . 1 1 72 72 ASN H H 72 7.238 7.238 7.751 -0.513 19946
4593 1 10 . 1 1 73 73 ALA N N 73 125.388 125.388 122.815 2.573 19946
4594 1 10 . 1 1 73 73 ALA HA H 73 3.639 3.639 4.304 -0.665 19946
4595 1 10 . 1 1 73 73 ALA CA C 73 56.133 56.133 54.115 2.018 19946
4596 1 10 . 1 1 73 73 ALA CB C 73 18.528 18.528 19.345 -0.817 19946
4597 1 10 . 1 1 73 73 ALA H H 73 7.081 7.081 7.391 -0.310 19946
4598 1 10 . 1 1 74 74 ASP N N 74 115.501 115.501 120.308 -4.807 19946
4599 1 10 . 1 1 74 74 ASP HA H 74 4.135 4.135 4.387 -0.252 19946
4600 1 10 . 1 1 74 74 ASP CA C 74 55.891 55.891 57.396 -1.505 19946
4601 1 10 . 1 1 74 74 ASP CB C 74 38.699 38.699 40.593 -1.894 19946
4602 1 10 . 1 1 74 74 ASP H H 74 8.346 8.346 8.593 -0.247 19946
4603 1 10 . 1 1 75 75 LYS N N 75 122.469 122.469 119.150 3.319 19946
4604 1 10 . 1 1 75 75 LYS HA H 75 4.024 4.024 4.070 -0.046 19946
4605 1 10 . 1 1 75 75 LYS CA C 75 57.861 57.861 58.883 -1.022 19946
4606 1 10 . 1 1 75 75 LYS CB C 75 31.660 31.660 32.090 -0.430 19946
4607 1 10 . 1 1 75 75 LYS H H 75 7.583 7.583 8.296 -0.713 19946
4608 1 10 . 1 1 76 76 LEU N N 76 119.196 119.196 119.339 -0.143 19946
4609 1 10 . 1 1 76 76 LEU HA H 76 3.570 3.570 4.042 -0.472 19946
4610 1 10 . 1 1 76 76 LEU CA C 76 56.852 56.852 57.724 -0.872 19946
4611 1 10 . 1 1 76 76 LEU CB C 76 39.245 39.245 41.783 -2.538 19946
4612 1 10 . 1 1 76 76 LEU H H 76 8.069 8.069 7.596 0.473 19946
4613 1 10 . 1 1 77 77 ALA N N 77 120.302 120.302 119.916 0.386 19946
4614 1 10 . 1 1 77 77 ALA HA H 77 3.985 3.985 3.970 0.015 19946
4615 1 10 . 1 1 77 77 ALA CA C 77 53.794 53.794 54.443 -0.649 19946
4616 1 10 . 1 1 77 77 ALA CB C 77 17.353 17.353 18.518 -1.165 19946
4617 1 10 . 1 1 77 77 ALA H H 77 8.063 8.063 8.472 -0.409 19946
4618 1 10 . 1 1 78 78 ALA N N 78 119.602 119.602 118.214 1.388 19946
4619 1 10 . 1 1 78 78 ALA HA H 78 4.138 4.138 4.289 -0.151 19946
4620 1 10 . 1 1 78 78 ALA CA C 78 54.049 54.049 53.042 1.007 19946
4621 1 10 . 1 1 78 78 ALA CB C 78 17.520 17.520 19.695 -2.175 19946
4622 1 10 . 1 1 78 78 ALA H H 78 7.274 7.274 7.484 -0.210 19946
4623 1 10 . 1 1 79 79 ILE N N 79 118.809 118.809 119.816 -1.007 19946
4624 1 10 . 1 1 79 79 ILE HA H 79 3.798 3.798 3.789 0.009 19946
4625 1 10 . 1 1 79 79 ILE CA C 79 63.354 63.354 63.621 -0.267 19946
4626 1 10 . 1 1 79 79 ILE CB C 79 38.422 38.422 38.401 0.021 19946
4627 1 10 . 1 1 79 79 ILE H H 79 8.170 8.170 8.325 -0.155 19946
4628 1 10 . 1 1 80 80 ALA N N 80 118.736 118.736 118.639 0.097 19946
4629 1 10 . 1 1 80 80 ALA HA H 80 4.412 4.412 4.628 -0.216 19946
4630 1 10 . 1 1 80 80 ALA CA C 80 50.801 50.801 50.447 0.354 19946
4631 1 10 . 1 1 80 80 ALA CB C 80 19.537 19.537 18.852 0.685 19946
4632 1 10 . 1 1 80 80 ALA H H 80 7.857 7.857 7.523 0.334 19946
4633 1 10 . 1 1 81 81 ALA N N 81 124.485 124.485 122.715 1.770 19946
4634 1 10 . 1 1 81 81 ALA HA H 81 4.353 4.353 5.117 -0.764 19946
4635 1 10 . 1 1 81 81 ALA CA C 81 51.305 51.305 49.161 2.144 19946
4636 1 10 . 1 1 81 81 ALA CB C 81 16.511 16.511 18.815 -2.304 19946
4637 1 10 . 1 1 81 81 ALA H H 81 7.191 7.191 7.560 -0.369 19946
4638 1 10 . 1 1 82 82 PRO CA C 82 62.903 62.903 62.933 -0.030 19946
4639 1 10 . 1 1 83 83 ALA N N 83 128.367 128.367 122.124 6.243 19946
4640 1 10 . 1 1 83 83 ALA HA H 83 4.058 4.058 4.054 0.004 19946
4641 1 10 . 1 1 83 83 ALA CA C 83 52.314 52.314 52.515 -0.201 19946
4642 1 10 . 1 1 83 83 ALA CB C 83 19.001 19.001 19.390 -0.389 19946
4643 1 10 . 1 1 83 83 ALA H H 83 8.472 8.472 7.652 0.820 19946
4644 1 10 . 1 1 84 84 GLU N N 84 122.108 122.108 122.581 -0.473 19946
4645 1 10 . 1 1 84 84 GLU HA H 84 4.164 4.164 4.175 -0.011 19946
4646 1 10 . 1 1 84 84 GLU CA C 84 55.937 55.937 56.480 -0.543 19946
4647 1 10 . 1 1 84 84 GLU CB C 84 30.213 30.213 29.670 0.543 19946
4648 1 10 . 1 1 84 84 GLU H H 84 8.106 8.106 8.526 -0.420 19946
4649 1 10 . 1 1 85 85 ILE N N 85 122.808 122.808 122.667 0.141 19946
4650 1 10 . 1 1 85 85 ILE HA H 85 5.211 5.211 4.628 0.583 19946
4651 1 10 . 1 1 85 85 ILE CA C 85 58.365 58.365 59.173 -0.808 19946
4652 1 10 . 1 1 85 85 ILE CB C 85 39.707 39.707 40.642 -0.935 19946
4653 1 10 . 1 1 85 85 ILE H H 85 7.850 7.850 7.889 -0.039 19946
4654 1 10 . 1 1 86 86 PHE N N 86 122.937 122.937 117.544 5.393 19946
4655 1 10 . 1 1 86 86 PHE HA H 86 5.388 5.388 4.706 0.682 19946
4656 1 10 . 1 1 86 86 PHE CA C 86 54.509 54.509 56.762 -2.253 19946
4657 1 10 . 1 1 86 86 PHE CB C 86 42.878 42.878 42.750 0.128 19946
4658 1 10 . 1 1 86 86 PHE H H 86 9.004 9.004 7.618 1.386 19946
4659 1 10 . 1 1 87 87 LEU N N 87 120.712 120.712 118.463 2.249 19946
4660 1 10 . 1 1 87 87 LEU HA H 87 5.295 5.295 4.932 0.363 19946
4661 1 10 . 1 1 87 87 LEU CA C 87 51.810 51.810 53.435 -1.625 19946
4662 1 10 . 1 1 87 87 LEU CB C 87 42.059 42.059 45.353 -3.295 19946
4663 1 10 . 1 1 87 87 LEU H H 87 8.785 8.785 8.942 -0.157 19946
4664 1 10 . 1 1 88 88 LEU N N 88 124.779 124.779 122.547 2.232 19946
4665 1 10 . 1 1 88 88 LEU HA H 88 4.434 4.434 4.921 -0.487 19946
4666 1 10 . 1 1 88 88 LEU CA C 88 54.331 54.331 53.318 1.013 19946
4667 1 10 . 1 1 88 88 LEU CB C 88 42.648 42.648 44.351 -1.703 19946
4668 1 10 . 1 1 88 88 LEU H H 88 8.243 8.243 8.144 0.099 19946
4669 1 10 . 1 1 89 89 GLU N N 89 112.478 112.478 127.184 -14.706 19946
4670 1 10 . 1 1 89 89 GLU HA H 89 3.881 3.881 3.932 -0.051 19946
4671 1 10 . 1 1 89 89 GLU H H 89 9.343 9.343 7.997 1.346 19946
4672 1 10 . 1 1 90 90 ASP N N 90 120.709 120.709 121.203 -0.494 19946
4673 1 10 . 1 1 90 90 ASP HA H 90 4.168 4.168 4.165 0.003 19946
4674 1 10 . 1 1 90 90 ASP H H 90 9.062 9.062 7.932 1.130 19946
4675 1 10 . 1 1 91 91 GLY N N 91 105.049 105.049 109.032 -3.983 19946
4676 1 10 . 1 1 91 91 GLY CA C 91 46.263 46.263 46.171 0.092 19946
4677 1 10 . 1 1 91 91 GLY H H 91 7.848 7.848 8.701 -0.853 19946
4678 1 10 . 1 1 92 92 ILE N N 92 122.127 122.127 122.830 -0.703 19946
4679 1 10 . 1 1 92 92 ILE HA H 92 3.811 3.811 3.832 -0.021 19946
4680 1 10 . 1 1 92 92 ILE CA C 92 62.656 62.656 64.009 -1.353 19946
4681 1 10 . 1 1 92 92 ILE CB C 92 37.243 37.243 37.811 -0.568 19946
4682 1 10 . 1 1 92 92 ILE H H 92 8.077 8.077 7.724 0.353 19946
4683 1 10 . 1 1 93 93 ASP N N 93 127.038 127.038 118.219 8.819 19946
4684 1 10 . 1 1 93 93 ASP HA H 93 4.452 4.452 4.290 0.162 19946
4685 1 10 . 1 1 93 93 ASP CA C 93 57.357 57.357 56.926 0.431 19946
4686 1 10 . 1 1 93 93 ASP CB C 93 38.194 38.194 40.313 -2.119 19946
4687 1 10 . 1 1 93 93 ASP H H 93 9.094 9.094 8.422 0.672 19946
4688 1 10 . 1 1 94 94 GLY N N 94 111.411 111.411 107.019 4.392 19946
4689 1 10 . 1 1 94 94 GLY CA C 94 44.750 44.750 46.438 -1.688 19946
4690 1 10 . 1 1 94 94 GLY H H 94 8.047 8.047 8.291 -0.244 19946
4691 1 10 . 1 1 95 95 TRP N N 95 127.574 127.574 123.977 3.597 19946
4692 1 10 . 1 1 95 95 TRP HA H 95 3.738 3.738 4.284 -0.546 19946
4693 1 10 . 1 1 95 95 TRP CA C 95 60.852 60.852 58.365 2.487 19946
4694 1 10 . 1 1 95 95 TRP CB C 95 28.613 28.613 29.356 -0.743 19946
4695 1 10 . 1 1 95 95 TRP H H 95 7.918 7.918 8.020 -0.102 19946
4696 1 10 . 1 1 96 96 LYS N N 96 117.374 117.374 119.145 -1.771 19946
4697 1 10 . 1 1 96 96 LYS HA H 96 4.079 4.079 4.142 -0.063 19946
4698 1 10 . 1 1 96 96 LYS CA C 96 59.091 59.091 56.709 2.382 19946
4699 1 10 . 1 1 96 96 LYS H H 96 8.625 8.625 8.278 0.347 19946
4700 1 10 . 1 1 97 97 LYS N N 97 123.490 123.490 120.838 2.652 19946
4701 1 10 . 1 1 97 97 LYS HA H 97 4.021 4.021 4.082 -0.061 19946
4702 1 10 . 1 1 97 97 LYS CB C 97 31.542 31.542 32.406 -0.864 19946
4703 1 10 . 1 1 97 97 LYS H H 97 8.233 8.233 8.339 -0.106 19946
4704 1 10 . 1 1 98 98 ALA N N 98 120.321 120.321 118.818 1.503 19946
4705 1 10 . 1 1 98 98 ALA HA H 98 4.248 4.248 4.548 -0.300 19946
4706 1 10 . 1 1 98 98 ALA CA C 98 51.305 51.305 51.028 0.277 19946
4707 1 10 . 1 1 98 98 ALA CB C 98 17.744 17.744 18.824 -1.080 19946
4708 1 10 . 1 1 98 98 ALA H H 98 7.480 7.480 7.090 0.390 19946
4709 1 10 . 1 1 99 99 GLY N N 99 106.984 106.984 109.125 -2.141 19946
4710 1 10 . 1 1 99 99 GLY CA C 99 44.246 44.246 46.075 -1.829 19946
4711 1 10 . 1 1 99 99 GLY H H 99 7.867 7.867 8.096 -0.229 19946
4712 1 10 . 1 1 100 100 LEU N N 100 122.993 122.993 120.600 2.393 19946
4713 1 10 . 1 1 100 100 LEU HA H 100 4.277 4.277 4.376 -0.099 19946
4714 1 10 . 1 1 100 100 LEU CA C 100 52.314 52.314 50.750 1.564 19946
4715 1 10 . 1 1 100 100 LEU CB C 100 36.786 36.786 41.500 -4.714 19946
4716 1 10 . 1 1 100 100 LEU H H 100 6.958 6.958 7.043 -0.085 19946
4717 1 10 . 1 1 101 101 PRO HA H 101 4.492 4.492 4.543 -0.051 19946
4718 1 10 . 1 1 101 101 PRO CB C 101 32.097 32.097 32.027 0.070 19946
4719 1 10 . 1 1 102 102 VAL N N 102 111.514 111.514 116.964 -5.450 19946
4720 1 10 . 1 1 102 102 VAL HA H 102 4.367 4.367 4.353 0.014 19946
4721 1 10 . 1 1 102 102 VAL CA C 102 58.869 58.869 61.523 -2.655 19946
4722 1 10 . 1 1 102 102 VAL CB C 102 35.351 35.351 32.429 2.922 19946
4723 1 10 . 1 1 102 102 VAL H H 102 7.988 7.988 8.356 -0.368 19946
4724 1 10 . 1 1 103 103 ALA N N 103 126.676 126.676 123.061 3.615 19946
4725 1 10 . 1 1 103 103 ALA HA H 103 4.524 4.524 4.320 0.204 19946
4726 1 10 . 1 1 103 103 ALA CA C 103 49.793 49.793 52.335 -2.542 19946
4727 1 10 . 1 1 103 103 ALA CB C 103 18.600 18.600 16.811 1.790 19946
4728 1 10 . 1 1 103 103 ALA H H 103 8.919 8.919 8.304 0.615 19946
4729 1 10 . 1 1 104 104 VAL N N 104 121.148 121.148 121.204 -0.056 19946
4730 1 10 . 1 1 104 104 VAL HA H 104 4.475 4.475 4.275 0.200 19946
4731 1 10 . 1 1 104 104 VAL CA C 104 59.374 59.374 61.647 -2.273 19946
4732 1 10 . 1 1 104 104 VAL CB C 104 33.884 33.884 33.514 0.370 19946
4733 1 10 . 1 1 104 104 VAL H H 104 8.241 8.241 7.643 0.598 19946
4734 1 10 . 1 1 105 105 ASN N N 105 123.816 123.816 118.959 4.857 19946
4735 1 10 . 1 1 105 105 ASN HA H 105 4.674 4.674 4.567 0.107 19946
4736 1 10 . 1 1 105 105 ASN CA C 105 53.200 53.200 53.510 -0.310 19946
4737 1 10 . 1 1 105 105 ASN CB C 105 37.959 37.959 38.521 -0.562 19946
4738 1 10 . 1 1 105 105 ASN H H 105 8.150 8.150 8.312 -0.162 19946
4739 1 10 . 1 1 106 106 LYS N N 106 123.804 123.804 119.707 4.097 19946
4740 1 10 . 1 1 106 106 LYS H H 106 8.340 8.340 8.510 -0.170 19946
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 98 3.495 -0.611 3.459 19946
2 1 1 "Average Difference" HA 107 0.382 0.081 0.375 19946
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19946
4 1 1 "Average Difference" CA 94 1.412 0.295 1.389 19946
5 1 1 "Average Difference" CB 89 1.617 0.647 1.490 19946
6 1 1 "Average Difference" HN 98 0.664 -0.037 0.667 19946
7 1 2 "Average Difference" N 98 3.916 -1.012 3.802 19946
8 1 2 "Average Difference" HA 107 0.400 0.056 0.398 19946
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19946
10 1 2 "Average Difference" CA 94 1.420 0.400 1.370 19946
11 1 2 "Average Difference" CB 89 1.627 0.773 1.439 19946
12 1 2 "Average Difference" HN 98 0.719 -0.057 0.720 19946
13 1 3 "Average Difference" N 98 3.939 -1.160 3.784 19946
14 1 3 "Average Difference" HA 107 0.400 0.075 0.395 19946
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19946
16 1 3 "Average Difference" CA 94 1.325 0.246 1.309 19946
17 1 3 "Average Difference" CB 89 1.688 0.807 1.491 19946
18 1 3 "Average Difference" HN 98 0.688 -0.070 0.688 19946
19 1 4 "Average Difference" N 98 3.577 -1.025 3.445 19946
20 1 4 "Average Difference" HA 107 0.387 0.042 0.387 19946
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19946
22 1 4 "Average Difference" CA 94 1.442 0.430 1.384 19946
23 1 4 "Average Difference" CB 89 1.731 0.671 1.605 19946
24 1 4 "Average Difference" HN 98 0.662 -0.075 0.661 19946
25 1 5 "Average Difference" N 98 3.905 -0.811 3.839 19946
26 1 5 "Average Difference" HA 107 0.372 0.053 0.370 19946
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19946
28 1 5 "Average Difference" CA 94 1.312 0.395 1.257 19946
29 1 5 "Average Difference" CB 89 1.545 0.766 1.349 19946
30 1 5 "Average Difference" HN 98 0.738 -0.048 0.740 19946
31 1 6 "Average Difference" N 98 3.616 -0.830 3.538 19946
32 1 6 "Average Difference" HA 107 0.364 0.054 0.362 19946
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19946
34 1 6 "Average Difference" CA 94 1.445 0.462 1.377 19946
35 1 6 "Average Difference" CB 89 1.573 0.700 1.417 19946
36 1 6 "Average Difference" HN 98 0.677 -0.076 0.676 19946
37 1 7 "Average Difference" N 98 3.562 -1.000 3.436 19946
38 1 7 "Average Difference" HA 107 0.359 0.052 0.357 19946
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19946
40 1 7 "Average Difference" CA 94 1.354 0.386 1.305 19946
41 1 7 "Average Difference" CB 89 1.685 0.786 1.499 19946
42 1 7 "Average Difference" HN 98 0.667 -0.028 0.670 19946
43 1 8 "Average Difference" N 98 3.727 -0.733 3.673 19946
44 1 8 "Average Difference" HA 107 0.366 0.045 0.365 19946
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19946
46 1 8 "Average Difference" CA 94 1.353 0.484 1.270 19946
47 1 8 "Average Difference" CB 89 1.646 0.818 1.436 19946
48 1 8 "Average Difference" HN 98 0.711 -0.009 0.715 19946
49 1 9 "Average Difference" N 98 3.751 -0.770 3.690 19946
50 1 9 "Average Difference" HA 107 0.406 0.053 0.404 19946
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19946
52 1 9 "Average Difference" CA 94 1.391 0.296 1.366 19946
53 1 9 "Average Difference" CB 89 1.704 0.625 1.594 19946
54 1 9 "Average Difference" HN 98 0.630 -0.059 0.630 19946
55 1 10 "Average Difference" N 98 3.458 -0.785 3.385 19946
56 1 10 "Average Difference" HA 107 0.383 0.050 0.382 19946
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19946
58 1 10 "Average Difference" CA 94 1.388 0.371 1.344 19946
59 1 10 "Average Difference" CB 89 1.638 0.772 1.453 19946
60 1 10 "Average Difference" HN 98 0.652 -0.052 0.653 19946
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 19946
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 LEU N N 2 120.763 120.763 121.978 -1.215 19946
2 1 . 1 1 2 2 LEU HA H 2 4.384 4.384 4.438 -0.055 19946
3 1 . 1 1 2 2 LEU CA C 2 53.827 53.827 55.204 -1.377 19946
4 1 . 1 1 2 2 LEU CB C 2 42.229 42.229 41.009 1.220 19946
5 1 . 1 1 2 2 LEU H H 2 7.888 7.888 8.447 -0.559 19946
6 1 . 1 1 3 3 THR N N 3 118.330 118.330 119.264 -0.934 19946
7 1 . 1 1 3 3 THR HA H 3 4.469 4.469 4.636 -0.167 19946
8 1 . 1 1 3 3 THR CA C 3 61.391 61.391 60.879 0.512 19946
9 1 . 1 1 3 3 THR CB C 3 69.496 69.496 71.008 -1.512 19946
10 1 . 1 1 3 3 THR H H 3 7.905 7.905 7.981 -0.076 19946
11 1 . 1 1 4 4 THR N N 4 122.024 122.024 116.527 5.498 19946
12 1 . 1 1 4 4 THR HA H 4 5.171 5.171 5.203 -0.032 19946
13 1 . 1 1 4 4 THR CA C 4 61.595 61.595 60.986 0.609 19946
14 1 . 1 1 4 4 THR CB C 4 69.027 69.027 70.292 -1.265 19946
15 1 . 1 1 4 4 THR H H 4 8.504 8.504 8.369 0.135 19946
16 1 . 1 1 5 5 ILE N N 5 122.667 122.667 121.432 1.235 19946
17 1 . 1 1 5 5 ILE HA H 5 4.973 4.973 4.590 0.383 19946
18 1 . 1 1 5 5 ILE CA C 5 57.971 57.971 59.425 -1.454 19946
19 1 . 1 1 5 5 ILE CB C 5 41.458 41.458 41.059 0.399 19946
20 1 . 1 1 5 5 ILE H H 5 8.903 8.903 8.290 0.613 19946
21 1 . 1 1 6 6 SER N N 6 123.156 123.156 115.652 7.504 19946
22 1 . 1 1 6 6 SER HA H 6 4.785 4.785 4.868 -0.083 19946
23 1 . 1 1 6 6 SER H H 6 9.138 9.138 8.406 0.732 19946
24 1 . 1 1 7 7 PRO HA H 7 4.004 4.004 4.594 -0.590 19946
25 1 . 1 1 7 7 PRO CA C 7 65.510 65.510 63.928 1.582 19946
26 1 . 1 1 7 7 PRO CB C 7 30.924 30.924 31.429 -0.505 19946
27 1 . 1 1 8 8 HIS N N 8 114.319 114.319 117.486 -3.167 19946
28 1 . 1 1 8 8 HIS HA H 8 3.989 3.989 4.482 -0.493 19946
29 1 . 1 1 8 8 HIS CA C 8 60.050 60.050 58.487 1.563 19946
30 1 . 1 1 8 8 HIS CB C 8 28.613 28.613 30.718 -2.105 19946
31 1 . 1 1 8 8 HIS H H 8 8.127 8.127 8.507 -0.380 19946
32 1 . 1 1 9 9 ASP N N 9 121.300 121.300 119.271 2.029 19946
33 1 . 1 1 9 9 ASP HA H 9 4.301 4.301 4.614 -0.313 19946
34 1 . 1 1 9 9 ASP CA C 9 56.455 56.455 55.959 0.496 19946
35 1 . 1 1 9 9 ASP CB C 9 38.699 38.699 41.284 -2.585 19946
36 1 . 1 1 9 9 ASP H H 9 7.639 7.639 8.193 -0.554 19946
37 1 . 1 1 10 10 ALA N N 10 123.991 123.991 122.689 1.302 19946
38 1 . 1 1 10 10 ALA HA H 10 3.719 3.719 4.109 -0.390 19946
39 1 . 1 1 10 10 ALA CA C 10 54.331 54.331 54.859 -0.528 19946
40 1 . 1 1 10 10 ALA CB C 10 17.549 17.549 18.463 -0.914 19946
41 1 . 1 1 10 10 ALA H H 10 8.820 8.820 7.945 0.875 19946
42 1 . 1 1 11 11 GLN N N 11 118.128 118.128 116.549 1.579 19946
43 1 . 1 1 11 11 GLN HA H 11 3.933 3.933 4.176 -0.243 19946
44 1 . 1 1 11 11 GLN CA C 11 59.389 59.389 57.800 1.589 19946
45 1 . 1 1 11 11 GLN CB C 11 27.948 27.948 28.477 -0.530 19946
46 1 . 1 1 11 11 GLN H H 11 8.353 8.353 8.340 0.013 19946
47 1 . 1 1 12 12 GLU N N 12 119.307 119.307 120.066 -0.759 19946
48 1 . 1 1 12 12 GLU HA H 12 4.023 4.023 4.269 -0.246 19946
49 1 . 1 1 12 12 GLU CA C 12 58.476 58.476 58.245 0.231 19946
50 1 . 1 1 12 12 GLU CB C 12 28.532 28.532 30.087 -1.555 19946
51 1 . 1 1 12 12 GLU H H 12 7.197 7.197 7.968 -0.771 19946
52 1 . 1 1 13 13 LEU N N 13 120.635 120.635 118.581 2.054 19946
53 1 . 1 1 13 13 LEU HA H 13 3.821 3.821 4.143 -0.322 19946
54 1 . 1 1 13 13 LEU CA C 13 57.065 57.065 57.796 -0.731 19946
55 1 . 1 1 13 13 LEU CB C 13 40.890 40.890 41.789 -0.899 19946
56 1 . 1 1 13 13 LEU H H 13 7.554 7.554 7.427 0.127 19946
57 1 . 1 1 14 14 ILE N N 14 123.021 123.021 119.384 3.637 19946
58 1 . 1 1 14 14 ILE HA H 14 3.827 3.827 3.885 -0.058 19946
59 1 . 1 1 14 14 ILE CA C 14 64.053 64.053 64.685 -0.632 19946
60 1 . 1 1 14 14 ILE CB C 14 38.115 38.115 37.663 0.452 19946
61 1 . 1 1 14 14 ILE H H 14 8.710 8.710 7.895 0.815 19946
62 1 . 1 1 15 15 ALA N N 15 124.504 124.504 119.789 4.715 19946
63 1 . 1 1 15 15 ALA HA H 15 4.115 4.115 4.196 -0.081 19946
64 1 . 1 1 15 15 ALA CA C 15 54.257 54.257 53.734 0.523 19946
65 1 . 1 1 15 15 ALA CB C 15 17.040 17.040 18.458 -1.418 19946
66 1 . 1 1 15 15 ALA H H 15 7.758 7.758 7.829 -0.071 19946
67 1 . 1 1 16 16 ARG N N 16 115.990 115.990 116.928 -0.938 19946
68 1 . 1 1 16 16 ARG HA H 16 4.348 4.348 4.365 -0.017 19946
69 1 . 1 1 16 16 ARG CA C 16 55.416 55.416 56.647 -1.231 19946
70 1 . 1 1 16 16 ARG CB C 16 29.762 29.762 31.135 -1.373 19946
71 1 . 1 1 16 16 ARG H H 16 7.252 7.252 7.852 -0.600 19946
72 1 . 1 1 17 17 GLY N N 17 107.981 107.981 105.751 2.230 19946
73 1 . 1 1 17 17 GLY CA C 17 44.854 44.854 44.795 0.059 19946
74 1 . 1 1 17 17 GLY H H 17 7.748 7.748 7.530 0.218 19946
75 1 . 1 1 18 18 ALA N N 18 123.914 123.914 124.350 -0.436 19946
76 1 . 1 1 18 18 ALA HA H 18 4.221 4.221 4.334 -0.113 19946
77 1 . 1 1 18 18 ALA CA C 18 52.270 52.270 52.525 -0.255 19946
78 1 . 1 1 18 18 ALA CB C 18 18.638 18.638 19.827 -1.189 19946
79 1 . 1 1 18 18 ALA H H 18 7.940 7.940 7.861 0.079 19946
80 1 . 1 1 19 19 LYS N N 19 119.436 119.436 121.882 -2.446 19946
81 1 . 1 1 19 19 LYS HA H 19 4.301 4.301 4.409 -0.108 19946
82 1 . 1 1 19 19 LYS CA C 19 53.105 53.105 55.473 -2.368 19946
83 1 . 1 1 19 19 LYS CB C 19 32.856 32.856 35.020 -2.164 19946
84 1 . 1 1 19 19 LYS H H 19 7.565 7.565 8.292 -0.727 19946
85 1 . 1 1 20 20 LEU N N 20 127.401 127.401 122.727 4.674 19946
86 1 . 1 1 20 20 LEU HA H 20 5.042 5.042 4.747 0.295 19946
87 1 . 1 1 20 20 LEU CA C 20 52.314 52.314 53.884 -1.570 19946
88 1 . 1 1 20 20 LEU CB C 20 43.234 43.234 44.743 -1.509 19946
89 1 . 1 1 20 20 LEU H H 20 8.727 8.727 8.289 0.438 19946
90 1 . 1 1 21 21 ILE N N 21 128.186 128.186 124.730 3.456 19946
91 1 . 1 1 21 21 ILE HA H 21 4.547 4.547 4.398 0.149 19946
92 1 . 1 1 21 21 ILE CA C 21 59.589 59.589 59.653 -0.064 19946
93 1 . 1 1 21 21 ILE CB C 21 38.545 38.545 41.291 -2.746 19946
94 1 . 1 1 21 21 ILE H H 21 9.366 9.366 7.958 1.408 19946
95 1 . 1 1 22 22 ASP N N 22 129.968 129.968 125.374 4.594 19946
96 1 . 1 1 22 22 ASP HA H 22 3.803 3.803 4.974 -1.171 19946
97 1 . 1 1 22 22 ASP CA C 22 51.435 51.435 52.972 -1.537 19946
98 1 . 1 1 22 22 ASP CB C 22 42.062 42.062 42.709 -0.647 19946
99 1 . 1 1 22 22 ASP H H 22 8.583 8.583 8.050 0.533 19946
100 1 . 1 1 23 23 ILE N N 23 116.266 116.266 118.756 -2.490 19946
101 1 . 1 1 23 23 ILE HA H 23 5.229 5.229 4.367 0.862 19946
102 1 . 1 1 23 23 ILE CA C 23 59.374 59.374 60.071 -0.697 19946
103 1 . 1 1 23 23 ILE CB C 23 37.327 37.327 36.719 0.608 19946
104 1 . 1 1 23 23 ILE H H 23 7.836 7.836 7.854 -0.018 19946
105 1 . 1 1 24 24 ARG N N 24 125.001 125.001 120.352 4.649 19946
106 1 . 1 1 24 24 ARG HA H 24 4.116 4.116 4.465 -0.349 19946
107 1 . 1 1 24 24 ARG CA C 24 55.943 55.943 54.567 1.376 19946
108 1 . 1 1 24 24 ARG CB C 24 30.135 30.135 31.658 -1.523 19946
109 1 . 1 1 24 24 ARG H H 24 8.195 8.195 7.356 0.839 19946
110 1 . 1 1 25 25 ASP N N 25 112.839 112.839 119.643 -6.804 19946
111 1 . 1 1 25 25 ASP HA H 25 4.545 4.545 4.586 -0.041 19946
112 1 . 1 1 25 25 ASP CA C 25 53.870 53.870 54.546 -0.676 19946
113 1 . 1 1 25 25 ASP CB C 25 41.327 41.327 41.540 -0.213 19946
114 1 . 1 1 25 25 ASP H H 25 7.660 7.660 8.418 -0.758 19946
115 1 . 1 1 26 26 ALA N N 26 122.145 122.145 122.396 -0.251 19946
116 1 . 1 1 26 26 ALA HA H 26 3.897 3.897 4.297 -0.400 19946
117 1 . 1 1 26 26 ALA CA C 26 54.958 54.958 54.008 0.950 19946
118 1 . 1 1 26 26 ALA CB C 26 17.520 17.520 19.834 -2.314 19946
119 1 . 1 1 26 26 ALA H H 26 8.766 8.766 8.317 0.449 19946
120 1 . 1 1 27 27 ASP N N 27 115.380 115.380 118.373 -2.993 19946
121 1 . 1 1 27 27 ASP HA H 27 4.299 4.299 4.416 -0.117 19946
122 1 . 1 1 27 27 ASP CA C 27 56.451 56.451 56.510 -0.059 19946
123 1 . 1 1 27 27 ASP CB C 27 39.156 39.156 40.384 -1.228 19946
124 1 . 1 1 27 27 ASP H H 27 8.686 8.686 8.486 0.200 19946
125 1 . 1 1 28 28 GLU N N 28 120.081 120.081 118.017 2.064 19946
126 1 . 1 1 28 28 GLU HA H 28 4.086 4.086 4.126 -0.040 19946
127 1 . 1 1 28 28 GLU CA C 28 58.389 58.389 58.482 -0.093 19946
128 1 . 1 1 28 28 GLU CB C 28 28.728 28.728 29.549 -0.821 19946
129 1 . 1 1 28 28 GLU H H 28 7.397 7.397 8.604 -1.207 19946
130 1 . 1 1 29 29 TYR N N 29 121.205 121.205 118.840 2.365 19946
131 1 . 1 1 29 29 TYR HA H 29 4.083 4.083 4.645 -0.562 19946
132 1 . 1 1 29 29 TYR CA C 29 60.378 60.378 58.147 2.231 19946
133 1 . 1 1 29 29 TYR CB C 29 38.699 38.699 39.178 -0.479 19946
134 1 . 1 1 29 29 TYR H H 29 7.506 7.506 7.888 -0.382 19946
135 1 . 1 1 30 30 LEU N N 30 118.828 118.828 120.675 -1.847 19946
136 1 . 1 1 30 30 LEU HA H 30 3.850 3.850 3.922 -0.072 19946
137 1 . 1 1 30 30 LEU CA C 30 56.348 56.348 56.950 -0.602 19946
138 1 . 1 1 30 30 LEU CB C 30 41.220 41.220 41.729 -0.509 19946
139 1 . 1 1 30 30 LEU H H 30 8.211 8.211 7.851 0.360 19946
140 1 . 1 1 31 31 ARG N N 31 118.220 118.220 117.636 0.584 19946
141 1 . 1 1 31 31 ARG HA H 31 4.101 4.101 4.196 -0.095 19946
142 1 . 1 1 31 31 ARG CA C 31 58.365 58.365 57.531 0.834 19946
143 1 . 1 1 31 31 ARG CB C 31 30.074 30.074 31.092 -1.018 19946
144 1 . 1 1 31 31 ARG H H 31 7.120 7.120 8.042 -0.922 19946
145 1 . 1 1 32 32 GLU N N 32 117.980 117.980 117.671 0.309 19946
146 1 . 1 1 32 32 GLU HA H 32 4.884 4.884 4.446 0.438 19946
147 1 . 1 1 32 32 GLU CA C 32 55.339 55.339 56.464 -1.125 19946
148 1 . 1 1 32 32 GLU CB C 32 31.698 31.698 30.986 0.712 19946
149 1 . 1 1 32 32 GLU H H 32 7.506 7.506 8.208 -0.702 19946
150 1 . 1 1 33 33 HIS N N 33 118.257 118.257 118.091 0.166 19946
151 1 . 1 1 33 33 HIS HA H 33 4.643 4.643 4.744 -0.101 19946
152 1 . 1 1 33 33 HIS CA C 33 53.766 53.766 54.889 -1.124 19946
153 1 . 1 1 33 33 HIS CB C 33 29.940 29.940 31.657 -1.716 19946
154 1 . 1 1 33 33 HIS H H 33 8.269 8.269 8.425 -0.156 19946
155 1 . 1 1 34 34 ILE N N 34 127.809 127.809 120.410 7.399 19946
156 1 . 1 1 34 34 ILE HA H 34 3.920 3.920 4.118 -0.197 19946
157 1 . 1 1 34 34 ILE CA C 34 59.648 59.648 59.958 -0.310 19946
158 1 . 1 1 34 34 ILE CB C 34 37.959 37.959 40.396 -2.436 19946
159 1 . 1 1 34 34 ILE H H 34 9.989 9.989 8.237 1.752 19946
160 1 . 1 1 35 35 PRO HA H 35 4.198 4.198 4.254 -0.056 19946
161 1 . 1 1 36 36 GLU N N 36 114.414 114.414 120.308 -5.894 19946
162 1 . 1 1 36 36 GLU HA H 36 4.082 4.082 3.979 0.103 19946
163 1 . 1 1 36 36 GLU CA C 36 57.861 57.861 56.859 1.002 19946
164 1 . 1 1 36 36 GLU CB C 36 28.109 28.109 29.404 -1.296 19946
165 1 . 1 1 36 36 GLU H H 36 8.557 8.557 8.071 0.486 19946
166 1 . 1 1 37 37 ALA N N 37 122.882 122.882 124.307 -1.425 19946
167 1 . 1 1 37 37 ALA HA H 37 4.439 4.439 4.697 -0.258 19946
168 1 . 1 1 37 37 ALA CA C 37 52.005 52.005 51.547 0.458 19946
169 1 . 1 1 37 37 ALA CB C 37 20.438 20.438 21.518 -1.080 19946
170 1 . 1 1 37 37 ALA H H 37 8.096 8.096 8.090 0.006 19946
171 1 . 1 1 38 38 ASP N N 38 124.471 124.471 118.408 6.063 19946
172 1 . 1 1 38 38 ASP HA H 38 4.844 4.844 4.830 0.014 19946
173 1 . 1 1 38 38 ASP CA C 38 52.614 52.614 53.910 -1.296 19946
174 1 . 1 1 38 38 ASP CB C 38 44.407 44.407 43.611 0.795 19946
175 1 . 1 1 38 38 ASP H H 38 9.004 9.004 8.491 0.513 19946
176 1 . 1 1 39 39 LEU N N 39 123.936 123.936 123.966 -0.030 19946
177 1 . 1 1 39 39 LEU HA H 39 4.328 4.328 4.166 0.163 19946
178 1 . 1 1 39 39 LEU CA C 39 54.037 54.037 55.944 -1.907 19946
179 1 . 1 1 39 39 LEU CB C 39 41.220 41.220 41.839 -0.619 19946
180 1 . 1 1 39 39 LEU H H 39 8.125 8.125 8.414 -0.289 19946
181 1 . 1 1 40 40 ALA N N 40 131.297 131.297 127.153 4.144 19946
182 1 . 1 1 40 40 ALA HA H 40 4.408 4.408 4.534 -0.127 19946
183 1 . 1 1 40 40 ALA CA C 40 48.784 48.784 50.675 -1.891 19946
184 1 . 1 1 40 40 ALA CB C 40 17.979 17.979 19.499 -1.520 19946
185 1 . 1 1 40 40 ALA H H 40 8.654 8.654 8.336 0.318 19946
186 1 . 1 1 41 41 PRO HA H 41 4.101 4.101 4.634 -0.533 19946
187 1 . 1 1 41 41 PRO CA C 41 61.391 61.391 62.247 -0.856 19946
188 1 . 1 1 41 41 PRO CB C 41 32.097 32.097 32.637 -0.540 19946
189 1 . 1 1 42 42 LEU N N 42 125.312 125.312 120.403 4.909 19946
190 1 . 1 1 42 42 LEU HA H 42 3.871 3.871 3.861 0.010 19946
191 1 . 1 1 42 42 LEU CA C 42 57.861 57.861 58.653 -0.792 19946
192 1 . 1 1 42 42 LEU CB C 42 40.941 40.941 41.174 -0.233 19946
193 1 . 1 1 42 42 LEU H H 42 8.285 8.285 8.504 -0.219 19946
194 1 . 1 1 43 43 SER N N 43 110.669 110.669 114.247 -3.578 19946
195 1 . 1 1 43 43 SER HA H 43 4.106 4.106 4.098 0.008 19946
196 1 . 1 1 43 43 SER CA C 43 60.497 60.497 61.940 -1.443 19946
197 1 . 1 1 43 43 SER CB C 43 61.391 61.391 62.594 -1.203 19946
198 1 . 1 1 43 43 SER H H 43 8.453 8.453 8.224 0.229 19946
199 1 . 1 1 44 44 VAL N N 44 123.933 123.933 122.113 1.820 19946
200 1 . 1 1 44 44 VAL HA H 44 3.821 3.821 3.772 0.049 19946
201 1 . 1 1 44 44 VAL CA C 44 64.752 64.752 66.189 -1.436 19946
202 1 . 1 1 44 44 VAL CB C 44 31.135 31.135 31.681 -0.546 19946
203 1 . 1 1 44 44 VAL H H 44 7.156 7.156 7.912 -0.756 19946
204 1 . 1 1 45 45 LEU N N 45 121.150 121.150 119.431 1.719 19946
205 1 . 1 1 45 45 LEU HA H 45 3.767 3.767 4.040 -0.273 19946
206 1 . 1 1 45 45 LEU CA C 45 56.599 56.599 57.856 -1.257 19946
207 1 . 1 1 45 45 LEU CB C 45 40.890 40.890 41.325 -0.435 19946
208 1 . 1 1 45 45 LEU H H 45 7.997 7.997 8.912 -0.914 19946
209 1 . 1 1 46 46 GLU N N 46 116.256 116.256 118.739 -2.483 19946
210 1 . 1 1 46 46 GLU HA H 46 3.678 3.678 4.219 -0.541 19946
211 1 . 1 1 46 46 GLU CA C 46 58.365 58.365 58.372 -0.007 19946
212 1 . 1 1 46 46 GLU CB C 46 29.622 29.622 29.952 -0.330 19946
213 1 . 1 1 46 46 GLU H H 46 8.501 8.501 8.181 0.320 19946
214 1 . 1 1 47 47 GLN N N 47 117.261 117.261 117.688 -0.427 19946
215 1 . 1 1 47 47 GLN HA H 47 4.216 4.216 4.179 0.037 19946
216 1 . 1 1 47 47 GLN CA C 47 56.852 56.852 58.084 -1.232 19946
217 1 . 1 1 47 47 GLN CB C 47 29.119 29.119 29.345 -0.227 19946
218 1 . 1 1 47 47 GLN H H 47 7.407 7.407 8.274 -0.867 19946
219 1 . 1 1 48 48 SER N N 48 111.890 111.890 112.491 -0.601 19946
220 1 . 1 1 48 48 SER HA H 48 4.641 4.641 4.500 0.141 19946
221 1 . 1 1 48 48 SER CA C 48 57.956 57.956 58.487 -0.531 19946
222 1 . 1 1 48 48 SER CB C 48 63.912 63.912 64.955 -1.043 19946
223 1 . 1 1 48 48 SER H H 48 8.566 8.566 8.314 0.252 19946
224 1 . 1 1 49 49 GLY N N 49 111.545 111.545 109.607 1.938 19946
225 1 . 1 1 49 49 GLY CA C 49 43.894 43.894 44.578 -0.684 19946
226 1 . 1 1 49 49 GLY H H 49 7.836 7.836 7.710 0.126 19946
227 1 . 1 1 50 50 LEU N N 50 121.541 121.541 123.378 -1.837 19946
228 1 . 1 1 50 50 LEU HA H 50 4.239 4.239 4.308 -0.069 19946
229 1 . 1 1 50 50 LEU CA C 50 51.985 51.985 54.360 -2.375 19946
230 1 . 1 1 50 50 LEU CB C 50 42.648 42.648 41.822 0.826 19946
231 1 . 1 1 50 50 LEU H H 50 8.564 8.564 8.391 0.173 19946
232 1 . 1 1 51 51 PRO HA H 51 4.243 4.243 4.558 -0.315 19946
233 1 . 1 1 51 51 PRO CB C 51 31.639 31.639 32.110 -0.471 19946
234 1 . 1 1 52 52 ALA N N 52 127.008 127.008 126.770 0.238 19946
235 1 . 1 1 52 52 ALA HA H 52 3.790 3.790 4.102 -0.312 19946
236 1 . 1 1 52 52 ALA CA C 52 54.835 54.835 54.755 0.080 19946
237 1 . 1 1 52 52 ALA CB C 52 17.715 17.715 18.605 -0.890 19946
238 1 . 1 1 52 52 ALA H H 52 8.564 8.564 8.578 -0.014 19946
239 1 . 1 1 53 53 LYS N N 53 114.535 114.535 116.049 -1.514 19946
240 1 . 1 1 53 53 LYS HA H 53 4.106 4.106 4.130 -0.024 19946
241 1 . 1 1 53 53 LYS CA C 53 56.852 56.852 58.127 -1.274 19946
242 1 . 1 1 53 53 LYS CB C 53 31.386 31.386 31.901 -0.515 19946
243 1 . 1 1 53 53 LYS H H 53 8.364 8.364 8.449 -0.085 19946
244 1 . 1 1 54 54 LEU N N 54 118.515 118.515 117.485 1.030 19946
245 1 . 1 1 54 54 LEU HA H 54 4.247 4.247 4.530 -0.283 19946
246 1 . 1 1 54 54 LEU CA C 54 53.338 53.338 53.715 -0.377 19946
247 1 . 1 1 54 54 LEU CB C 54 40.890 40.890 42.035 -1.145 19946
248 1 . 1 1 54 54 LEU H H 54 7.745 7.745 7.455 0.290 19946
249 1 . 1 1 55 55 ARG N N 55 117.612 117.612 121.044 -3.432 19946
250 1 . 1 1 55 55 ARG HA H 55 3.927 3.927 4.578 -0.651 19946
251 1 . 1 1 55 55 ARG CA C 55 56.832 56.832 55.488 1.344 19946
252 1 . 1 1 55 55 ARG CB C 55 28.610 28.610 32.233 -3.623 19946
253 1 . 1 1 55 55 ARG H H 55 6.938 6.938 7.924 -0.986 19946
254 1 . 1 1 56 56 HIS N N 56 123.269 123.269 122.212 1.057 19946
255 1 . 1 1 56 56 HIS HA H 56 4.614 4.614 4.740 -0.126 19946
256 1 . 1 1 56 56 HIS CA C 56 54.835 54.835 55.564 -0.729 19946
257 1 . 1 1 56 56 HIS CB C 56 32.648 32.648 31.988 0.660 19946
258 1 . 1 1 56 56 HIS H H 56 7.237 7.237 8.510 -1.273 19946
259 1 . 1 1 57 57 GLU N N 57 120.895 120.895 118.809 2.086 19946
260 1 . 1 1 57 57 GLU HA H 57 3.976 3.976 4.325 -0.349 19946
261 1 . 1 1 57 57 GLU CA C 57 58.871 58.871 57.749 1.122 19946
262 1 . 1 1 57 57 GLU CB C 57 29.158 29.158 30.870 -1.712 19946
263 1 . 1 1 57 57 GLU H H 57 7.625 7.625 8.588 -0.963 19946
264 1 . 1 1 58 58 GLN N N 58 118.485 118.485 115.579 2.906 19946
265 1 . 1 1 58 58 GLN HA H 58 5.425 5.425 5.027 0.399 19946
266 1 . 1 1 58 58 GLN CA C 58 54.910 54.910 54.637 0.273 19946
267 1 . 1 1 58 58 GLN CB C 58 32.285 32.285 30.802 1.482 19946
268 1 . 1 1 58 58 GLN H H 58 8.335 8.335 7.966 0.369 19946
269 1 . 1 1 59 59 ILE N N 59 123.505 123.505 119.771 3.734 19946
270 1 . 1 1 59 59 ILE HA H 59 4.492 4.492 4.874 -0.382 19946
271 1 . 1 1 59 59 ILE CA C 59 58.869 58.869 59.434 -0.565 19946
272 1 . 1 1 59 59 ILE CB C 59 42.332 42.332 41.062 1.270 19946
273 1 . 1 1 59 59 ILE H H 59 8.704 8.704 8.539 0.165 19946
274 1 . 1 1 60 60 ILE N N 60 126.464 126.464 119.992 6.472 19946
275 1 . 1 1 60 60 ILE HA H 60 4.954 4.954 4.675 0.279 19946
276 1 . 1 1 60 60 ILE CA C 60 57.357 57.357 59.452 -2.095 19946
277 1 . 1 1 60 60 ILE CB C 60 39.131 39.131 41.508 -2.377 19946
278 1 . 1 1 60 60 ILE H H 60 9.006 9.006 8.066 0.940 19946
279 1 . 1 1 61 61 PHE N N 61 124.441 124.441 122.417 2.024 19946
280 1 . 1 1 61 61 PHE HA H 61 5.795 5.795 5.111 0.684 19946
281 1 . 1 1 61 61 PHE CA C 61 56.131 56.131 56.683 -0.552 19946
282 1 . 1 1 61 61 PHE CB C 61 42.879 42.879 42.473 0.406 19946
283 1 . 1 1 61 61 PHE H H 61 8.938 8.938 8.307 0.631 19946
284 1 . 1 1 62 62 HIS N N 62 117.494 117.494 119.543 -2.049 19946
285 1 . 1 1 62 62 HIS HA H 62 5.928 5.928 5.012 0.916 19946
286 1 . 1 1 62 62 HIS CA C 62 53.322 53.322 55.628 -2.306 19946
287 1 . 1 1 62 62 HIS CB C 62 35.673 35.673 33.405 2.268 19946
288 1 . 1 1 62 62 HIS H H 62 9.230 9.230 8.306 0.924 19946
289 1 . 1 1 63 63 CYS N N 63 120.220 120.220 121.114 -0.894 19946
290 1 . 1 1 63 63 CYS HA H 63 5.033 5.033 4.450 0.583 19946
291 1 . 1 1 63 63 CYS CA C 63 56.131 56.131 59.347 -3.216 19946
292 1 . 1 1 63 63 CYS CB C 63 28.109 28.109 29.682 -1.573 19946
293 1 . 1 1 63 63 CYS H H 63 8.131 8.131 8.842 -0.711 19946
294 1 . 1 1 65 65 ALA N N 65 119.272 119.272 121.314 -2.042 19946
295 1 . 1 1 65 65 ALA HA H 65 5.063 5.063 4.570 0.493 19946
296 1 . 1 1 65 65 ALA CA C 65 49.793 49.793 51.842 -2.049 19946
297 1 . 1 1 65 65 ALA CB C 65 19.775 19.775 18.963 0.812 19946
298 1 . 1 1 65 65 ALA H H 65 8.967 8.967 7.954 1.013 19946
299 1 . 1 1 66 66 GLY N N 66 113.296 113.296 108.913 4.383 19946
300 1 . 1 1 66 66 GLY CA C 66 44.934 44.934 45.676 -0.743 19946
301 1 . 1 1 66 66 GLY H H 66 8.778 8.778 8.031 0.747 19946
302 1 . 1 1 67 67 LYS N N 67 121.300 121.300 120.682 0.618 19946
303 1 . 1 1 67 67 LYS HA H 67 4.211 4.211 4.188 0.023 19946
304 1 . 1 1 67 67 LYS H H 67 8.111 8.111 8.339 -0.228 19946
305 1 . 1 1 68 68 ARG N N 68 126.092 126.092 120.190 5.902 19946
306 1 . 1 1 68 68 ARG H H 68 9.067 9.067 8.425 0.642 19946
307 1 . 1 1 69 69 THR N N 69 117.153 117.153 113.645 3.508 19946
308 1 . 1 1 69 69 THR HA H 69 3.576 3.576 4.345 -0.769 19946
309 1 . 1 1 69 69 THR CA C 69 65.397 65.397 63.225 2.172 19946
310 1 . 1 1 69 69 THR CB C 69 66.938 66.938 69.202 -2.264 19946
311 1 . 1 1 69 69 THR H H 69 10.233 10.233 8.179 2.054 19946
312 1 . 1 1 70 70 SER N N 70 113.686 113.686 116.873 -3.187 19946
313 1 . 1 1 70 70 SER HA H 70 4.091 4.091 4.236 -0.145 19946
314 1 . 1 1 70 70 SER CA C 70 61.391 61.391 60.587 0.804 19946
315 1 . 1 1 70 70 SER CB C 70 65.425 65.425 62.814 2.611 19946
316 1 . 1 1 70 70 SER H H 70 7.322 7.322 8.342 -1.020 19946
317 1 . 1 1 71 71 ASN N N 71 118.257 118.257 118.897 -0.640 19946
318 1 . 1 1 71 71 ASN HA H 71 4.177 4.177 4.528 -0.351 19946
319 1 . 1 1 71 71 ASN CA C 71 54.736 54.736 55.283 -0.547 19946
320 1 . 1 1 71 71 ASN CB C 71 38.391 38.391 38.526 -0.135 19946
321 1 . 1 1 71 71 ASN H H 71 7.863 7.863 8.400 -0.537 19946
322 1 . 1 1 72 72 ASN N N 72 115.529 115.529 115.110 0.419 19946
323 1 . 1 1 72 72 ASN HA H 72 5.127 5.127 4.859 0.268 19946
324 1 . 1 1 72 72 ASN CA C 72 52.173 52.173 52.845 -0.672 19946
325 1 . 1 1 72 72 ASN CB C 72 39.165 39.165 38.481 0.684 19946
326 1 . 1 1 72 72 ASN H H 72 7.238 7.238 8.061 -0.823 19946
327 1 . 1 1 73 73 ALA N N 73 125.388 125.388 122.831 2.558 19946
328 1 . 1 1 73 73 ALA HA H 73 3.639 3.639 4.124 -0.485 19946
329 1 . 1 1 73 73 ALA CA C 73 56.133 56.133 54.359 1.774 19946
330 1 . 1 1 73 73 ALA CB C 73 18.528 18.528 19.240 -0.712 19946
331 1 . 1 1 73 73 ALA H H 73 7.081 7.081 7.630 -0.549 19946
332 1 . 1 1 74 74 ASP N N 74 115.501 115.501 119.216 -3.715 19946
333 1 . 1 1 74 74 ASP HA H 74 4.135 4.135 4.338 -0.203 19946
334 1 . 1 1 74 74 ASP CA C 74 55.891 55.891 57.332 -1.441 19946
335 1 . 1 1 74 74 ASP CB C 74 38.699 38.699 40.495 -1.796 19946
336 1 . 1 1 74 74 ASP H H 74 8.346 8.346 8.466 -0.120 19946
337 1 . 1 1 75 75 LYS N N 75 122.469 122.469 119.424 3.045 19946
338 1 . 1 1 75 75 LYS HA H 75 4.024 4.024 4.053 -0.029 19946
339 1 . 1 1 75 75 LYS CA C 75 57.861 57.861 58.884 -1.023 19946
340 1 . 1 1 75 75 LYS CB C 75 31.660 31.660 32.111 -0.451 19946
341 1 . 1 1 75 75 LYS H H 75 7.583 7.583 8.120 -0.537 19946
342 1 . 1 1 76 76 LEU N N 76 119.196 119.196 119.432 -0.236 19946
343 1 . 1 1 76 76 LEU HA H 76 3.570 3.570 3.887 -0.317 19946
344 1 . 1 1 76 76 LEU CA C 76 56.852 56.852 57.490 -0.638 19946
345 1 . 1 1 76 76 LEU CB C 76 39.245 39.245 41.525 -2.280 19946
346 1 . 1 1 76 76 LEU H H 76 8.069 8.069 7.559 0.510 19946
347 1 . 1 1 77 77 ALA N N 77 120.302 120.302 120.495 -0.193 19946
348 1 . 1 1 77 77 ALA HA H 77 3.985 3.985 3.951 0.034 19946
349 1 . 1 1 77 77 ALA CA C 77 53.794 53.794 54.101 -0.307 19946
350 1 . 1 1 77 77 ALA CB C 77 17.353 17.353 18.333 -0.980 19946
351 1 . 1 1 77 77 ALA H H 77 8.063 8.063 7.959 0.104 19946
352 1 . 1 1 78 78 ALA N N 78 119.602 119.602 118.818 0.784 19946
353 1 . 1 1 78 78 ALA HA H 78 4.138 4.138 4.266 -0.128 19946
354 1 . 1 1 78 78 ALA CA C 78 54.049 54.049 53.246 0.803 19946
355 1 . 1 1 78 78 ALA CB C 78 17.520 17.520 19.170 -1.650 19946
356 1 . 1 1 78 78 ALA H H 78 7.274 7.274 7.513 -0.239 19946
357 1 . 1 1 79 79 ILE N N 79 118.809 118.809 119.219 -0.410 19946
358 1 . 1 1 79 79 ILE HA H 79 3.798 3.798 3.832 -0.034 19946
359 1 . 1 1 79 79 ILE CA C 79 63.354 63.354 63.482 -0.128 19946
360 1 . 1 1 79 79 ILE CB C 79 38.422 38.422 38.859 -0.437 19946
361 1 . 1 1 79 79 ILE H H 79 8.170 8.170 7.880 0.290 19946
362 1 . 1 1 80 80 ALA N N 80 118.736 118.736 119.133 -0.397 19946
363 1 . 1 1 80 80 ALA HA H 80 4.412 4.412 4.572 -0.160 19946
364 1 . 1 1 80 80 ALA CA C 80 50.801 50.801 50.518 0.283 19946
365 1 . 1 1 80 80 ALA CB C 80 19.537 19.537 18.507 1.030 19946
366 1 . 1 1 80 80 ALA H H 80 7.857 7.857 7.576 0.281 19946
367 1 . 1 1 81 81 ALA N N 81 124.485 124.485 122.830 1.655 19946
368 1 . 1 1 81 81 ALA HA H 81 4.353 4.353 5.032 -0.679 19946
369 1 . 1 1 81 81 ALA CA C 81 51.305 51.305 49.454 1.851 19946
370 1 . 1 1 81 81 ALA CB C 81 16.511 16.511 18.956 -2.445 19946
371 1 . 1 1 81 81 ALA H H 81 7.191 7.191 7.344 -0.153 19946
372 1 . 1 1 82 82 PRO CA C 82 62.903 62.903 63.009 -0.106 19946
373 1 . 1 1 83 83 ALA N N 83 128.367 128.367 123.281 5.086 19946
374 1 . 1 1 83 83 ALA HA H 83 4.058 4.058 4.201 -0.143 19946
375 1 . 1 1 83 83 ALA CA C 83 52.314 52.314 52.516 -0.202 19946
376 1 . 1 1 83 83 ALA CB C 83 19.001 19.001 20.202 -1.201 19946
377 1 . 1 1 83 83 ALA H H 83 8.472 8.472 7.768 0.704 19946
378 1 . 1 1 84 84 GLU N N 84 122.108 122.108 121.593 0.515 19946
379 1 . 1 1 84 84 GLU HA H 84 4.164 4.164 4.477 -0.313 19946
380 1 . 1 1 84 84 GLU CA C 84 55.937 55.937 56.265 -0.328 19946
381 1 . 1 1 84 84 GLU CB C 84 30.213 30.213 30.502 -0.289 19946
382 1 . 1 1 84 84 GLU H H 84 8.106 8.106 8.201 -0.095 19946
383 1 . 1 1 85 85 ILE N N 85 122.808 122.808 121.353 1.455 19946
384 1 . 1 1 85 85 ILE HA H 85 5.211 5.211 4.817 0.393 19946
385 1 . 1 1 85 85 ILE CA C 85 58.365 58.365 58.992 -0.626 19946
386 1 . 1 1 85 85 ILE CB C 85 39.707 39.707 40.108 -0.401 19946
387 1 . 1 1 85 85 ILE H H 85 7.850 7.850 8.015 -0.166 19946
388 1 . 1 1 86 86 PHE N N 86 122.937 122.937 119.841 3.096 19946
389 1 . 1 1 86 86 PHE HA H 86 5.388 5.388 4.898 0.490 19946
390 1 . 1 1 86 86 PHE CA C 86 54.509 54.509 56.590 -2.081 19946
391 1 . 1 1 86 86 PHE CB C 86 42.878 42.878 42.871 0.007 19946
392 1 . 1 1 86 86 PHE H H 86 9.004 9.004 8.028 0.976 19946
393 1 . 1 1 87 87 LEU N N 87 120.712 120.712 118.586 2.126 19946
394 1 . 1 1 87 87 LEU HA H 87 5.295 5.295 5.002 0.293 19946
395 1 . 1 1 87 87 LEU CA C 87 51.810 51.810 53.559 -1.749 19946
396 1 . 1 1 87 87 LEU CB C 87 42.059 42.059 44.656 -2.598 19946
397 1 . 1 1 87 87 LEU H H 87 8.785 8.785 8.869 -0.084 19946
398 1 . 1 1 88 88 LEU N N 88 124.779 124.779 121.876 2.903 19946
399 1 . 1 1 88 88 LEU HA H 88 4.434 4.434 4.643 -0.209 19946
400 1 . 1 1 88 88 LEU CA C 88 54.331 54.331 53.703 0.628 19946
401 1 . 1 1 88 88 LEU CB C 88 42.648 42.648 43.103 -0.455 19946
402 1 . 1 1 88 88 LEU H H 88 8.243 8.243 8.270 -0.027 19946
403 1 . 1 1 89 89 GLU N N 89 112.478 112.478 124.755 -12.277 19946
404 1 . 1 1 89 89 GLU HA H 89 3.881 3.881 4.041 -0.160 19946
405 1 . 1 1 89 89 GLU H H 89 9.343 9.343 8.268 1.075 19946
406 1 . 1 1 90 90 ASP N N 90 120.709 120.709 120.335 0.374 19946
407 1 . 1 1 90 90 ASP HA H 90 4.168 4.168 4.550 -0.382 19946
408 1 . 1 1 90 90 ASP H H 90 9.062 9.062 8.303 0.759 19946
409 1 . 1 1 91 91 GLY N N 91 105.049 105.049 110.277 -5.228 19946
410 1 . 1 1 91 91 GLY CA C 91 46.263 46.263 45.673 0.590 19946
411 1 . 1 1 91 91 GLY H H 91 7.848 7.848 8.378 -0.530 19946
412 1 . 1 1 92 92 ILE N N 92 122.127 122.127 122.126 0.001 19946
413 1 . 1 1 92 92 ILE HA H 92 3.811 3.811 3.918 -0.107 19946
414 1 . 1 1 92 92 ILE CA C 92 62.656 62.656 63.560 -0.904 19946
415 1 . 1 1 92 92 ILE CB C 92 37.243 37.243 37.797 -0.554 19946
416 1 . 1 1 92 92 ILE H H 92 8.077 8.077 8.322 -0.245 19946
417 1 . 1 1 93 93 ASP N N 93 127.038 127.038 119.482 7.556 19946
418 1 . 1 1 93 93 ASP HA H 93 4.452 4.452 4.381 0.071 19946
419 1 . 1 1 93 93 ASP CA C 93 57.357 57.357 57.454 -0.097 19946
420 1 . 1 1 93 93 ASP CB C 93 38.194 38.194 40.081 -1.887 19946
421 1 . 1 1 93 93 ASP H H 93 9.094 9.094 8.477 0.617 19946
422 1 . 1 1 94 94 GLY N N 94 111.411 111.411 107.945 3.466 19946
423 1 . 1 1 94 94 GLY CA C 94 44.750 44.750 46.422 -1.672 19946
424 1 . 1 1 94 94 GLY H H 94 8.047 8.047 8.087 -0.040 19946
425 1 . 1 1 95 95 TRP N N 95 127.574 127.574 124.338 3.236 19946
426 1 . 1 1 95 95 TRP HA H 95 3.738 3.738 4.311 -0.573 19946
427 1 . 1 1 95 95 TRP CA C 95 60.852 60.852 59.031 1.821 19946
428 1 . 1 1 95 95 TRP CB C 95 28.613 28.613 29.696 -1.083 19946
429 1 . 1 1 95 95 TRP H H 95 7.918 7.918 8.360 -0.442 19946
430 1 . 1 1 96 96 LYS N N 96 117.374 117.374 119.114 -1.740 19946
431 1 . 1 1 96 96 LYS HA H 96 4.079 4.079 3.970 0.109 19946
432 1 . 1 1 96 96 LYS CA C 96 59.091 59.091 57.889 1.202 19946
433 1 . 1 1 96 96 LYS H H 96 8.625 8.625 8.440 0.185 19946
434 1 . 1 1 97 97 LYS N N 97 123.490 123.490 120.029 3.461 19946
435 1 . 1 1 97 97 LYS HA H 97 4.021 4.021 4.082 -0.061 19946
436 1 . 1 1 97 97 LYS CB C 97 31.542 31.542 32.376 -0.834 19946
437 1 . 1 1 97 97 LYS H H 97 8.233 8.233 8.012 0.221 19946
438 1 . 1 1 98 98 ALA N N 98 120.321 120.321 119.379 0.942 19946
439 1 . 1 1 98 98 ALA HA H 98 4.248 4.248 4.497 -0.249 19946
440 1 . 1 1 98 98 ALA CA C 98 51.305 51.305 51.199 0.106 19946
441 1 . 1 1 98 98 ALA CB C 98 17.744 17.744 18.975 -1.231 19946
442 1 . 1 1 98 98 ALA H H 98 7.480 7.480 7.397 0.083 19946
443 1 . 1 1 99 99 GLY N N 99 106.984 106.984 108.442 -1.459 19946
444 1 . 1 1 99 99 GLY CA C 99 44.246 44.246 45.829 -1.583 19946
445 1 . 1 1 99 99 GLY H H 99 7.867 7.867 8.106 -0.239 19946
446 1 . 1 1 100 100 LEU N N 100 122.993 122.993 120.271 2.722 19946
447 1 . 1 1 100 100 LEU HA H 100 4.277 4.277 4.382 -0.105 19946
448 1 . 1 1 100 100 LEU CA C 100 52.314 52.314 50.756 1.558 19946
449 1 . 1 1 100 100 LEU CB C 100 36.786 36.786 42.458 -5.672 19946
450 1 . 1 1 100 100 LEU H H 100 6.958 6.958 7.090 -0.132 19946
451 1 . 1 1 101 101 PRO HA H 101 4.492 4.492 4.555 -0.063 19946
452 1 . 1 1 101 101 PRO CB C 101 32.097 32.097 31.992 0.105 19946
453 1 . 1 1 102 102 VAL N N 102 111.514 111.514 116.114 -4.600 19946
454 1 . 1 1 102 102 VAL HA H 102 4.367 4.367 4.418 -0.051 19946
455 1 . 1 1 102 102 VAL CA C 102 58.869 58.869 60.427 -1.558 19946
456 1 . 1 1 102 102 VAL CB C 102 35.351 35.351 32.463 2.888 19946
457 1 . 1 1 102 102 VAL H H 102 7.988 7.988 8.265 -0.277 19946
458 1 . 1 1 103 103 ALA N N 103 126.676 126.676 123.005 3.671 19946
459 1 . 1 1 103 103 ALA HA H 103 4.524 4.524 4.382 0.143 19946
460 1 . 1 1 103 103 ALA CA C 103 49.793 49.793 51.767 -1.974 19946
461 1 . 1 1 103 103 ALA CB C 103 18.600 18.600 17.653 0.947 19946
462 1 . 1 1 103 103 ALA H H 103 8.919 8.919 8.229 0.690 19946
463 1 . 1 1 104 104 VAL N N 104 121.148 121.148 122.578 -1.430 19946
464 1 . 1 1 104 104 VAL HA H 104 4.475 4.475 4.344 0.131 19946
465 1 . 1 1 104 104 VAL CA C 104 59.374 59.374 60.636 -1.262 19946
466 1 . 1 1 104 104 VAL CB C 104 33.884 33.884 33.282 0.603 19946
467 1 . 1 1 104 104 VAL H H 104 8.241 8.241 7.764 0.477 19946
468 1 . 1 1 105 105 ASN N N 105 123.816 123.816 119.677 4.139 19946
469 1 . 1 1 105 105 ASN HA H 105 4.674 4.674 4.620 0.054 19946
470 1 . 1 1 105 105 ASN CA C 105 53.200 53.200 54.081 -0.882 19946
471 1 . 1 1 105 105 ASN CB C 105 37.959 37.959 38.396 -0.437 19946
472 1 . 1 1 105 105 ASN H H 105 8.150 8.150 8.465 -0.315 19946
473 1 . 1 1 106 106 LYS N N 106 123.804 123.804 121.984 1.820 19946
474 1 . 1 1 106 106 LYS H H 106 8.340 8.340 8.318 0.022 19946
stop_
save_