data_17865
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 17865
_Entry.PDB_ID 2LHT
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 17865
_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 ASP N N 27 121.041 121.041 122.843 -1.802 17865
2 1 1 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.762 -0.124 17865
3 1 1 . 1 1 2 2 ASP C C 27 175.878 175.878 176.151 -0.273 17865
4 1 1 . 1 1 2 2 ASP CA C 27 54.382 54.382 54.525 -0.143 17865
5 1 1 . 1 1 2 2 ASP CB C 27 41.729 41.729 41.540 0.189 17865
6 1 1 . 1 1 2 2 ASP H H 27 8.639 8.639 8.304 0.335 17865
7 1 1 . 1 1 3 3 VAL N N 28 119.901 119.901 120.968 -1.067 17865
8 1 1 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.023 0.010 17865
9 1 1 . 1 1 3 3 VAL C C 28 175.521 175.521 174.786 0.735 17865
10 1 1 . 1 1 3 3 VAL CA C 28 62.216 62.216 62.110 0.106 17865
11 1 1 . 1 1 3 3 VAL CB C 28 33.003 33.003 31.983 1.020 17865
12 1 1 . 1 1 3 3 VAL H H 28 8.113 8.113 7.310 0.803 17865
13 1 1 . 1 1 4 4 PHE N N 29 123.707 123.707 126.264 -2.557 17865
14 1 1 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.658 -0.002 17865
15 1 1 . 1 1 4 4 PHE C C 29 174.874 174.874 175.255 -0.381 17865
16 1 1 . 1 1 4 4 PHE CA C 29 57.159 57.159 57.142 0.016 17865
17 1 1 . 1 1 4 4 PHE CB C 29 39.795 39.795 40.921 -1.126 17865
18 1 1 . 1 1 4 4 PHE H H 29 8.255 8.255 8.490 -0.235 17865
19 1 1 . 1 1 5 5 ASP N N 30 124.203 124.203 126.517 -2.314 17865
20 1 1 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.722 0.116 17865
21 1 1 . 1 1 5 5 ASP CA C 30 52.385 52.385 53.629 -1.244 17865
22 1 1 . 1 1 5 5 ASP CB C 30 40.801 40.801 41.648 -0.847 17865
23 1 1 . 1 1 5 5 ASP H H 30 8.226 8.226 8.537 -0.311 17865
24 1 1 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.661 -0.124 17865
25 1 1 . 1 1 6 6 PRO CA C 31 61.664 61.664 61.752 -0.088 17865
26 1 1 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.324 -0.498 17865
27 1 1 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.436 -0.010 17865
28 1 1 . 1 1 7 7 PRO C C 32 177.226 177.226 176.062 1.164 17865
29 1 1 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.614 -0.445 17865
30 1 1 . 1 1 7 7 PRO CB C 32 31.948 31.948 31.400 0.548 17865
31 1 1 . 1 1 8 8 THR N N 33 114.158 114.158 119.719 -5.561 17865
32 1 1 . 1 1 8 8 THR HA H 33 4.195 4.195 4.271 -0.076 17865
33 1 1 . 1 1 8 8 THR C C 33 174.468 174.468 173.692 0.776 17865
34 1 1 . 1 1 8 8 THR CA C 33 62.110 62.110 62.326 -0.216 17865
35 1 1 . 1 1 8 8 THR CB C 33 69.975 69.975 68.955 1.020 17865
36 1 1 . 1 1 8 8 THR H H 33 8.096 8.096 8.249 -0.153 17865
37 1 1 . 1 1 9 9 GLN N N 34 122.411 122.411 120.654 1.757 17865
38 1 1 . 1 1 9 9 GLN HA H 34 4.263 4.263 3.981 0.282 17865
39 1 1 . 1 1 9 9 GLN C C 34 175.445 175.445 174.952 0.493 17865
40 1 1 . 1 1 9 9 GLN CA C 34 55.763 55.763 55.623 0.140 17865
41 1 1 . 1 1 9 9 GLN CB C 34 29.691 29.691 27.585 2.106 17865
42 1 1 . 1 1 9 9 GLN H H 34 8.278 8.278 7.681 0.597 17865
43 1 1 . 1 1 10 10 TYR N N 35 121.048 121.048 122.280 -1.232 17865
44 1 1 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.535 -0.015 17865
45 1 1 . 1 1 10 10 TYR C C 35 176.314 176.314 175.205 1.109 17865
46 1 1 . 1 1 10 10 TYR CA C 35 57.972 57.972 57.137 0.835 17865
47 1 1 . 1 1 10 10 TYR CB C 35 38.936 38.936 39.958 -1.022 17865
48 1 1 . 1 1 10 10 TYR H H 35 8.227 8.227 7.566 0.661 17865
49 1 1 . 1 1 11 11 GLY N N 36 109.711 109.711 106.786 2.925 17865
50 1 1 . 1 1 11 11 GLY C C 36 174.128 174.128 173.472 0.656 17865
51 1 1 . 1 1 11 11 GLY CA C 36 45.212 45.212 45.607 -0.395 17865
52 1 1 . 1 1 11 11 GLY H H 36 8.247 8.247 8.207 0.040 17865
53 1 1 . 1 1 12 12 TYR N N 37 120.302 120.302 115.318 4.984 17865
54 1 1 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.891 -0.409 17865
55 1 1 . 1 1 12 12 TYR C C 37 175.864 175.864 174.018 1.846 17865
56 1 1 . 1 1 12 12 TYR CA C 37 58.541 58.541 55.167 3.374 17865
57 1 1 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.258 -0.543 17865
58 1 1 . 1 1 12 12 TYR H H 37 8.101 8.101 7.080 1.021 17865
59 1 1 . 1 1 13 13 ASP N N 38 121.883 121.883 120.607 1.276 17865
60 1 1 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.224 0.262 17865
61 1 1 . 1 1 13 13 ASP C C 38 176.538 176.538 176.569 -0.031 17865
62 1 1 . 1 1 13 13 ASP CA C 38 54.223 54.223 54.682 -0.459 17865
63 1 1 . 1 1 13 13 ASP CB C 38 40.988 40.988 41.847 -0.859 17865
64 1 1 . 1 1 13 13 ASP H H 38 8.266 8.266 7.775 0.491 17865
65 1 1 . 1 1 14 14 GLY N N 39 107.705 107.705 111.362 -3.657 17865
66 1 1 . 1 1 14 14 GLY C C 39 173.822 173.822 173.303 0.519 17865
67 1 1 . 1 1 14 14 GLY CA C 39 45.404 45.404 44.855 0.549 17865
68 1 1 . 1 1 14 14 GLY H H 39 7.647 7.647 7.535 0.112 17865
69 1 1 . 1 1 15 15 LYS N N 40 121.621 121.621 121.341 0.280 17865
70 1 1 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.873 -0.298 17865
71 1 1 . 1 1 15 15 LYS CA C 40 54.100 54.100 52.955 1.145 17865
72 1 1 . 1 1 15 15 LYS CB C 40 32.510 32.510 34.744 -2.234 17865
73 1 1 . 1 1 15 15 LYS H H 40 7.908 7.908 7.385 0.523 17865
74 1 1 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.550 -0.198 17865
75 1 1 . 1 1 16 16 PRO C C 41 176.806 176.806 175.948 0.858 17865
76 1 1 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.064 0.694 17865
77 1 1 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.742 -0.428 17865
78 1 1 . 1 1 17 17 LEU N N 42 123.488 123.488 120.751 2.737 17865
79 1 1 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.243 -0.194 17865
80 1 1 . 1 1 17 17 LEU C C 42 174.973 174.973 176.099 -1.126 17865
81 1 1 . 1 1 17 17 LEU CA C 42 55.436 55.436 56.064 -0.628 17865
82 1 1 . 1 1 17 17 LEU CB C 42 42.093 42.093 40.221 1.872 17865
83 1 1 . 1 1 17 17 LEU H H 42 8.499 8.499 8.042 0.457 17865
84 1 1 . 1 1 18 18 ASP N N 43 123.354 123.354 125.305 -1.951 17865
85 1 1 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.779 -0.281 17865
86 1 1 . 1 1 18 18 ASP C C 43 175.947 175.947 176.169 -0.222 17865
87 1 1 . 1 1 18 18 ASP CA C 43 52.858 52.858 52.338 0.520 17865
88 1 1 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.006 -1.785 17865
89 1 1 . 1 1 18 18 ASP H H 43 7.789 7.789 7.972 -0.183 17865
90 1 1 . 1 1 19 19 ALA N N 44 120.147 120.147 119.900 0.247 17865
91 1 1 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.177 -0.191 17865
92 1 1 . 1 1 19 19 ALA C C 44 179.476 179.476 179.266 0.210 17865
93 1 1 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.821 0.342 17865
94 1 1 . 1 1 19 19 ALA CB C 44 18.387 18.387 19.020 -0.634 17865
95 1 1 . 1 1 19 19 ALA H H 44 8.561 8.561 8.574 -0.013 17865
96 1 1 . 1 1 20 20 SER N N 45 115.037 115.037 114.764 0.273 17865
97 1 1 . 1 1 20 20 SER HA H 45 4.151 4.151 4.159 -0.008 17865
98 1 1 . 1 1 20 20 SER C C 45 177.191 177.191 176.166 1.025 17865
99 1 1 . 1 1 20 20 SER CA C 45 61.629 61.629 61.796 -0.167 17865
100 1 1 . 1 1 20 20 SER CB C 45 62.804 62.804 63.136 -0.332 17865
101 1 1 . 1 1 20 20 SER H H 45 8.466 8.466 8.737 -0.271 17865
102 1 1 . 1 1 21 21 PHE N N 46 125.030 125.030 121.623 3.407 17865
103 1 1 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.289 -0.058 17865
104 1 1 . 1 1 21 21 PHE C C 46 176.850 176.850 176.734 0.116 17865
105 1 1 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.921 -0.115 17865
106 1 1 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.432 0.449 17865
107 1 1 . 1 1 21 21 PHE H H 46 8.034 8.034 7.762 0.272 17865
108 1 1 . 1 1 22 22 CYS N N 47 113.943 113.943 116.925 -2.982 17865
109 1 1 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.246 0.005 17865
110 1 1 . 1 1 22 22 CYS C C 47 176.449 176.449 176.813 -0.364 17865
111 1 1 . 1 1 22 22 CYS CA C 47 53.600 53.600 59.332 -5.732 17865
112 1 1 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.867 10.524 17865
113 1 1 . 1 1 22 22 CYS H H 47 7.691 7.691 7.762 -0.071 17865
114 1 1 . 1 1 23 23 ARG N N 48 119.958 119.958 120.944 -0.986 17865
115 1 1 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.064 0.016 17865
116 1 1 . 1 1 23 23 ARG C C 48 177.904 177.904 178.085 -0.181 17865
117 1 1 . 1 1 23 23 ARG CA C 48 58.907 58.907 57.954 0.953 17865
118 1 1 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.210 0.961 17865
119 1 1 . 1 1 23 23 ARG H H 48 7.628 7.628 7.974 -0.346 17865
120 1 1 . 1 1 24 24 THR N N 49 106.445 106.445 113.155 -6.710 17865
121 1 1 . 1 1 24 24 THR HA H 49 4.385 4.385 4.218 0.167 17865
122 1 1 . 1 1 24 24 THR C C 49 174.758 174.758 174.581 0.177 17865
123 1 1 . 1 1 24 24 THR CA C 49 61.573 61.573 62.786 -1.213 17865
124 1 1 . 1 1 24 24 THR CB C 49 68.794 68.794 68.448 0.345 17865
125 1 1 . 1 1 24 24 THR H H 49 7.307 7.307 7.505 -0.198 17865
126 1 1 . 1 1 25 25 ALA N N 50 122.242 122.242 121.813 0.429 17865
127 1 1 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.344 0.060 17865
128 1 1 . 1 1 25 25 ALA C C 50 178.554 178.554 177.826 0.728 17865
129 1 1 . 1 1 25 25 ALA CA C 50 52.381 52.381 52.633 -0.252 17865
130 1 1 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.854 -1.459 17865
131 1 1 . 1 1 25 25 ALA H H 50 7.401 7.401 7.436 -0.035 17865
132 1 1 . 1 1 26 26 GLY N N 51 110.604 110.604 107.477 3.127 17865
133 1 1 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.778 0.244 17865
134 1 1 . 1 1 26 26 GLY H H 51 8.285 8.285 7.789 0.496 17865
135 1 1 . 1 1 27 27 SER HA H 52 4.382 4.382 4.230 0.152 17865
136 1 1 . 1 1 27 27 SER C C 52 175.774 175.774 176.489 -0.715 17865
137 1 1 . 1 1 27 27 SER CA C 52 60.803 60.803 60.719 0.084 17865
138 1 1 . 1 1 27 27 SER CB C 52 62.827 62.827 63.405 -0.578 17865
139 1 1 . 1 1 28 28 ARG N N 53 119.682 119.682 120.435 -0.753 17865
140 1 1 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.907 -0.027 17865
141 1 1 . 1 1 28 28 ARG C C 53 175.796 175.796 177.243 -1.447 17865
142 1 1 . 1 1 28 28 ARG CA C 53 55.738 55.738 56.823 -1.085 17865
143 1 1 . 1 1 28 28 ARG CB C 53 30.237 30.237 30.274 -0.037 17865
144 1 1 . 1 1 28 28 ARG H H 53 7.894 7.894 7.925 -0.031 17865
145 1 1 . 1 1 29 29 GLU N N 54 122.318 122.318 121.234 1.084 17865
146 1 1 . 1 1 29 29 GLU HA H 54 3.595 3.595 4.095 -0.500 17865
147 1 1 . 1 1 29 29 GLU C C 54 177.523 177.523 177.747 -0.224 17865
148 1 1 . 1 1 29 29 GLU CA C 54 61.223 61.223 59.489 1.734 17865
149 1 1 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.453 -0.516 17865
150 1 1 . 1 1 29 29 GLU H H 54 7.730 7.730 7.622 0.108 17865
151 1 1 . 1 1 30 30 LYS N N 55 118.377 118.377 117.946 0.431 17865
152 1 1 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.065 -0.237 17865
153 1 1 . 1 1 30 30 LYS C C 55 179.205 179.205 178.958 0.247 17865
154 1 1 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.201 1.226 17865
155 1 1 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.368 -0.767 17865
156 1 1 . 1 1 30 30 LYS H H 55 8.659 8.659 7.479 1.180 17865
157 1 1 . 1 1 31 31 ASP N N 56 121.614 121.614 120.391 1.223 17865
158 1 1 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.547 -0.236 17865
159 1 1 . 1 1 31 31 ASP C C 56 177.393 177.393 178.134 -0.741 17865
160 1 1 . 1 1 31 31 ASP CA C 56 57.316 57.316 57.931 -0.614 17865
161 1 1 . 1 1 31 31 ASP CB C 56 40.423 40.423 40.954 -0.531 17865
162 1 1 . 1 1 31 31 ASP H H 56 7.646 7.646 8.013 -0.367 17865
163 1 1 . 1 1 32 32 CYS N N 57 120.345 120.345 119.671 0.674 17865
164 1 1 . 1 1 32 32 CYS HA H 57 3.601 3.601 4.153 -0.552 17865
165 1 1 . 1 1 32 32 CYS C C 57 175.772 175.772 176.598 -0.826 17865
166 1 1 . 1 1 32 32 CYS CA C 57 60.197 60.197 60.511 -0.314 17865
167 1 1 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.500 8.466 17865
168 1 1 . 1 1 32 32 CYS H H 57 8.042 8.042 8.054 -0.012 17865
169 1 1 . 1 1 33 33 ARG N N 58 120.293 120.293 119.792 0.501 17865
170 1 1 . 1 1 33 33 ARG HA H 58 3.676 3.676 4.014 -0.338 17865
171 1 1 . 1 1 33 33 ARG C C 58 179.633 179.633 178.163 1.470 17865
172 1 1 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.156 1.230 17865
173 1 1 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.340 0.501 17865
174 1 1 . 1 1 33 33 ARG H H 58 8.531 8.531 7.929 0.602 17865
175 1 1 . 1 1 34 34 LYS N N 59 121.166 121.166 119.396 1.770 17865
176 1 1 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.279 -0.243 17865
177 1 1 . 1 1 34 34 LYS C C 59 179.220 179.220 178.268 0.952 17865
178 1 1 . 1 1 34 34 LYS CA C 59 59.530 59.530 57.984 1.546 17865
179 1 1 . 1 1 34 34 LYS CB C 59 32.110 32.110 32.374 -0.264 17865
180 1 1 . 1 1 34 34 LYS H H 59 7.633 7.633 7.667 -0.034 17865
181 1 1 . 1 1 35 35 ASP N N 60 122.166 122.166 120.609 1.557 17865
182 1 1 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.440 -0.009 17865
183 1 1 . 1 1 35 35 ASP C C 60 179.709 179.709 178.536 1.173 17865
184 1 1 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.560 0.142 17865
185 1 1 . 1 1 35 35 ASP CB C 60 40.672 40.672 41.056 -0.384 17865
186 1 1 . 1 1 35 35 ASP H H 60 8.221 8.221 7.963 0.258 17865
187 1 1 . 1 1 36 36 VAL N N 61 121.312 121.312 118.779 2.533 17865
188 1 1 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.678 -0.277 17865
189 1 1 . 1 1 36 36 VAL C C 61 178.339 178.339 176.917 1.422 17865
190 1 1 . 1 1 36 36 VAL CA C 61 67.133 67.133 66.116 1.017 17865
191 1 1 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.747 -0.090 17865
192 1 1 . 1 1 36 36 VAL H H 61 8.916 8.916 8.337 0.579 17865
193 1 1 . 1 1 37 37 GLN N N 62 119.166 119.166 118.536 0.630 17865
194 1 1 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.145 -0.203 17865
195 1 1 . 1 1 37 37 GLN C C 62 177.293 177.293 177.837 -0.544 17865
196 1 1 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.985 0.295 17865
197 1 1 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.683 -0.312 17865
198 1 1 . 1 1 37 37 GLN H H 62 7.697 7.697 7.480 0.217 17865
199 1 1 . 1 1 38 38 ALA N N 63 118.964 118.964 122.511 -3.547 17865
200 1 1 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.214 0.028 17865
201 1 1 . 1 1 38 38 ALA C C 63 177.221 177.221 177.483 -0.262 17865
202 1 1 . 1 1 38 38 ALA CA C 63 53.137 53.137 53.483 -0.345 17865
203 1 1 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.402 -0.505 17865
204 1 1 . 1 1 38 38 ALA H H 63 7.508 7.508 7.663 -0.155 17865
205 1 1 . 1 1 39 39 CYS N N 64 119.081 119.081 118.559 0.522 17865
206 1 1 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.581 0.372 17865
207 1 1 . 1 1 39 39 CYS C C 64 172.052 172.052 174.858 -2.806 17865
208 1 1 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.953 -7.073 17865
209 1 1 . 1 1 39 39 CYS CB C 64 34.328 34.328 25.458 8.870 17865
210 1 1 . 1 1 39 39 CYS H H 64 7.354 7.354 8.052 -0.698 17865
211 1 1 . 1 1 40 40 ASP N N 65 124.167 124.167 128.038 -3.871 17865
212 1 1 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.495 -0.170 17865
213 1 1 . 1 1 40 40 ASP C C 65 176.496 176.496 177.323 -0.827 17865
214 1 1 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.701 0.023 17865
215 1 1 . 1 1 40 40 ASP CB C 65 41.313 41.313 42.071 -0.758 17865
216 1 1 . 1 1 40 40 ASP H H 65 8.142 8.142 8.566 -0.424 17865
217 1 1 . 1 1 41 41 LYS N N 66 118.844 118.844 119.270 -0.426 17865
218 1 1 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.044 0.480 17865
219 1 1 . 1 1 41 41 LYS C C 66 175.586 175.586 177.967 -2.381 17865
220 1 1 . 1 1 41 41 LYS CA C 66 55.275 55.275 58.538 -3.264 17865
221 1 1 . 1 1 41 41 LYS CB C 66 32.598 32.598 32.139 0.459 17865
222 1 1 . 1 1 41 41 LYS H H 66 7.858 7.858 8.612 -0.754 17865
223 1 1 . 1 1 42 42 LYS N N 67 126.081 126.081 114.327 11.754 17865
224 1 1 . 1 1 42 42 LYS HA H 67 3.915 3.915 3.629 0.286 17865
225 1 1 . 1 1 42 42 LYS C C 67 174.665 174.665 175.948 -1.283 17865
226 1 1 . 1 1 42 42 LYS CA C 67 57.827 57.827 58.830 -1.003 17865
227 1 1 . 1 1 42 42 LYS CB C 67 34.059 34.059 31.083 2.976 17865
228 1 1 . 1 1 42 42 LYS H H 67 8.790 8.790 8.382 0.408 17865
229 1 1 . 1 1 43 43 TYR N N 68 114.138 114.138 117.006 -2.868 17865
230 1 1 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.881 0.378 17865
231 1 1 . 1 1 43 43 TYR C C 68 175.767 175.767 176.269 -0.502 17865
232 1 1 . 1 1 43 43 TYR CA C 68 55.880 55.880 57.519 -1.639 17865
233 1 1 . 1 1 43 43 TYR CB C 68 42.363 42.363 40.511 1.852 17865
234 1 1 . 1 1 43 43 TYR H H 68 7.294 7.294 8.110 -0.816 17865
235 1 1 . 1 1 44 44 ASP N N 69 121.807 121.807 121.670 0.137 17865
236 1 1 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.561 0.079 17865
237 1 1 . 1 1 44 44 ASP C C 69 177.812 177.812 177.693 0.119 17865
238 1 1 . 1 1 44 44 ASP CA C 69 52.110 52.110 54.822 -2.712 17865
239 1 1 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.226 -1.786 17865
240 1 1 . 1 1 44 44 ASP H H 69 8.995 8.995 8.754 0.241 17865
241 1 1 . 1 1 45 45 ASP N N 70 116.686 116.686 122.330 -5.644 17865
242 1 1 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.403 0.021 17865
243 1 1 . 1 1 45 45 ASP C C 70 177.054 177.054 177.375 -0.321 17865
244 1 1 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.396 -0.015 17865
245 1 1 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.953 -0.705 17865
246 1 1 . 1 1 45 45 ASP H H 70 8.369 8.369 8.734 -0.365 17865
247 1 1 . 1 1 46 46 GLN N N 71 117.949 117.949 116.463 1.486 17865
248 1 1 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.330 0.126 17865
249 1 1 . 1 1 46 46 GLN C C 71 176.273 176.273 176.930 -0.657 17865
250 1 1 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.447 -0.080 17865
251 1 1 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.257 0.073 17865
252 1 1 . 1 1 46 46 GLN H H 71 8.274 8.274 8.670 -0.396 17865
253 1 1 . 1 1 47 47 GLY N N 72 108.369 108.369 106.819 1.550 17865
254 1 1 . 1 1 47 47 GLY C C 72 174.145 174.145 174.152 -0.007 17865
255 1 1 . 1 1 47 47 GLY CA C 72 45.823 45.823 44.846 0.977 17865
256 1 1 . 1 1 47 47 GLY H H 72 8.174 8.174 8.122 0.052 17865
257 1 1 . 1 1 48 48 ARG N N 73 121.554 121.554 119.730 1.824 17865
258 1 1 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.489 -0.004 17865
259 1 1 . 1 1 48 48 ARG C C 73 176.855 176.855 175.885 0.970 17865
260 1 1 . 1 1 48 48 ARG CA C 73 55.289 55.289 54.241 1.048 17865
261 1 1 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.083 -0.525 17865
262 1 1 . 1 1 48 48 ARG H H 73 8.462 8.462 8.081 0.381 17865
263 1 1 . 1 1 49 49 GLU N N 74 122.784 122.784 120.638 2.146 17865
264 1 1 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.294 0.189 17865
265 1 1 . 1 1 49 49 GLU C C 74 178.098 178.098 176.903 1.195 17865
266 1 1 . 1 1 49 49 GLU CA C 74 57.184 57.184 57.491 -0.307 17865
267 1 1 . 1 1 49 49 GLU CB C 74 30.777 30.777 30.130 0.647 17865
268 1 1 . 1 1 49 49 GLU H H 74 8.703 8.703 8.647 0.056 17865
269 1 1 . 1 1 50 50 THR N N 75 114.563 114.563 115.716 -1.153 17865
270 1 1 . 1 1 50 50 THR HA H 75 4.212 4.212 4.521 -0.309 17865
271 1 1 . 1 1 50 50 THR C C 75 175.170 175.170 175.715 -0.545 17865
272 1 1 . 1 1 50 50 THR CA C 75 60.589 60.589 60.085 0.504 17865
273 1 1 . 1 1 50 50 THR CB C 75 70.952 70.952 70.605 0.348 17865
274 1 1 . 1 1 50 50 THR H H 75 7.717 7.717 7.912 -0.195 17865
275 1 1 . 1 1 51 51 ALA N N 76 122.097 122.097 122.677 -0.580 17865
276 1 1 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.039 -0.001 17865
277 1 1 . 1 1 51 51 ALA C C 76 181.906 181.906 178.863 3.043 17865
278 1 1 . 1 1 51 51 ALA CA C 76 55.654 55.654 54.901 0.753 17865
279 1 1 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.390 -0.397 17865
280 1 1 . 1 1 51 51 ALA H H 76 8.734 8.734 8.705 0.029 17865
281 1 1 . 1 1 52 52 CYS N N 77 115.347 115.347 117.260 -1.913 17865
282 1 1 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.319 0.161 17865
283 1 1 . 1 1 52 52 CYS C C 77 176.299 176.299 176.798 -0.499 17865
284 1 1 . 1 1 52 52 CYS CA C 77 57.701 57.701 60.032 -2.331 17865
285 1 1 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.872 9.758 17865
286 1 1 . 1 1 52 52 CYS H H 77 9.073 9.073 7.975 1.098 17865
287 1 1 . 1 1 53 53 ALA N N 78 128.517 128.517 122.864 5.653 17865
288 1 1 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.902 -0.047 17865
289 1 1 . 1 1 53 53 ALA C C 78 178.736 178.736 179.089 -0.353 17865
290 1 1 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.082 0.551 17865
291 1 1 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.978 1.213 17865
292 1 1 . 1 1 53 53 ALA H H 78 7.174 7.174 8.086 -0.912 17865
293 1 1 . 1 1 54 54 LYS N N 79 118.706 118.706 119.498 -0.792 17865
294 1 1 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.202 -0.399 17865
295 1 1 . 1 1 54 54 LYS C C 79 179.611 179.611 179.097 0.514 17865
296 1 1 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.937 0.788 17865
297 1 1 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.545 0.108 17865
298 1 1 . 1 1 54 54 LYS H H 79 8.313 8.313 7.861 0.452 17865
299 1 1 . 1 1 55 55 GLY N N 80 104.822 104.822 107.304 -2.482 17865
300 1 1 . 1 1 55 55 GLY C C 80 176.504 176.504 176.079 0.425 17865
301 1 1 . 1 1 55 55 GLY CA C 80 46.839 46.839 46.899 -0.060 17865
302 1 1 . 1 1 55 55 GLY H H 80 8.175 8.175 7.722 0.453 17865
303 1 1 . 1 1 56 56 ILE N N 81 123.697 123.697 123.180 0.517 17865
304 1 1 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.801 -0.006 17865
305 1 1 . 1 1 56 56 ILE C C 81 177.334 177.334 177.503 -0.169 17865
306 1 1 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.814 0.467 17865
307 1 1 . 1 1 56 56 ILE CB C 81 38.335 38.335 38.143 0.192 17865
308 1 1 . 1 1 56 56 ILE H H 81 7.590 7.590 7.399 0.191 17865
309 1 1 . 1 1 57 57 ARG N N 82 118.161 118.161 119.045 -0.884 17865
310 1 1 . 1 1 57 57 ARG HA H 82 3.935 3.935 4.119 -0.184 17865
311 1 1 . 1 1 57 57 ARG C C 82 178.662 178.662 178.189 0.473 17865
312 1 1 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.466 0.236 17865
313 1 1 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.442 0.457 17865
314 1 1 . 1 1 57 57 ARG H H 82 7.569 7.569 7.828 -0.259 17865
315 1 1 . 1 1 58 58 GLU N N 83 115.085 115.085 117.325 -2.240 17865
316 1 1 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.141 -0.110 17865
317 1 1 . 1 1 58 58 GLU C C 83 178.224 178.224 178.163 0.061 17865
318 1 1 . 1 1 58 58 GLU CA C 83 58.304 58.304 58.002 0.302 17865
319 1 1 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.331 0.700 17865
320 1 1 . 1 1 58 58 GLU H H 83 7.786 7.786 7.689 0.097 17865
321 1 1 . 1 1 59 59 LYS N N 84 119.183 119.183 119.075 0.108 17865
322 1 1 . 1 1 59 59 LYS HA H 84 3.830 3.830 4.029 -0.199 17865
323 1 1 . 1 1 59 59 LYS C C 84 177.933 177.933 178.315 -0.382 17865
324 1 1 . 1 1 59 59 LYS CA C 84 59.043 59.043 58.551 0.492 17865
325 1 1 . 1 1 59 59 LYS CB C 84 33.650 33.650 33.007 0.643 17865
326 1 1 . 1 1 59 59 LYS H H 84 7.968 7.968 7.545 0.423 17865
327 1 1 . 1 1 60 60 TYR N N 85 113.663 113.663 114.877 -1.214 17865
328 1 1 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.508 0.195 17865
329 1 1 . 1 1 60 60 TYR C C 85 174.729 174.729 175.484 -0.755 17865
330 1 1 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.310 0.892 17865
331 1 1 . 1 1 60 60 TYR CB C 85 37.902 37.902 36.788 1.114 17865
332 1 1 . 1 1 60 60 TYR H H 85 7.562 7.562 7.736 -0.174 17865
333 1 1 . 1 1 61 61 LYS N N 86 121.862 121.862 122.909 -1.047 17865
334 1 1 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.440 0.072 17865
335 1 1 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.496 -0.554 17865
336 1 1 . 1 1 61 61 LYS CB C 86 32.102 32.102 33.056 -0.954 17865
337 1 1 . 1 1 61 61 LYS H H 86 7.222 7.222 7.676 -0.454 17865
338 1 1 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.484 -0.161 17865
339 1 1 . 1 1 62 62 PRO C C 87 176.576 176.576 175.857 0.719 17865
340 1 1 . 1 1 62 62 PRO CA C 87 63.020 63.020 61.806 1.214 17865
341 1 1 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.785 -0.545 17865
342 1 1 . 1 1 63 63 ALA N N 88 125.029 125.029 123.615 1.414 17865
343 1 1 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.338 -0.084 17865
344 1 1 . 1 1 63 63 ALA C C 88 177.301 177.301 176.527 0.774 17865
345 1 1 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.072 0.209 17865
346 1 1 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.579 1.623 17865
347 1 1 . 1 1 63 63 ALA H H 88 8.329 8.329 8.245 0.084 17865
348 1 1 . 1 1 64 64 VAL N N 89 121.843 121.843 119.793 2.050 17865
349 1 1 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.519 -0.575 17865
350 1 1 . 1 1 64 64 VAL C C 89 174.791 174.791 174.457 0.334 17865
351 1 1 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.946 1.035 17865
352 1 1 . 1 1 64 64 VAL CB C 89 33.485 33.485 35.073 -1.588 17865
353 1 1 . 1 1 64 64 VAL H H 89 8.075 8.075 7.825 0.250 17865
354 1 1 . 1 1 65 65 VAL N N 90 125.399 125.399 118.095 7.304 17865
355 1 1 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.542 -0.404 17865
356 1 1 . 1 1 65 65 VAL C C 90 174.340 174.340 174.385 -0.045 17865
357 1 1 . 1 1 65 65 VAL CA C 90 61.162 61.162 61.933 -0.771 17865
358 1 1 . 1 1 65 65 VAL CB C 90 33.866 33.866 31.706 2.160 17865
359 1 1 . 1 1 65 65 VAL H H 90 8.229 8.229 8.151 0.078 17865
360 1 1 . 1 1 66 66 TYR N N 91 124.848 124.848 127.032 -2.184 17865
361 1 1 . 1 1 66 66 TYR HA H 91 4.771 4.771 5.115 -0.344 17865
362 1 1 . 1 1 66 66 TYR C C 91 176.658 176.658 176.628 0.030 17865
363 1 1 . 1 1 66 66 TYR CA C 91 58.084 58.084 57.305 0.779 17865
364 1 1 . 1 1 66 66 TYR CB C 91 41.535 41.535 42.247 -0.712 17865
365 1 1 . 1 1 66 66 TYR H H 91 9.145 9.145 8.541 0.604 17865
366 1 1 . 1 1 67 67 GLY N N 92 106.185 106.185 109.288 -3.103 17865
367 1 1 . 1 1 67 67 GLY C C 92 175.681 175.681 174.842 0.839 17865
368 1 1 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.461 0.514 17865
369 1 1 . 1 1 67 67 GLY H H 92 8.730 8.730 8.923 -0.193 17865
370 1 1 . 1 1 68 68 TYR N N 93 121.815 121.815 117.976 3.839 17865
371 1 1 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.354 -0.379 17865
372 1 1 . 1 1 68 68 TYR C C 93 176.035 176.035 176.582 -0.547 17865
373 1 1 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.558 1.488 17865
374 1 1 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.035 0.390 17865
375 1 1 . 1 1 68 68 TYR H H 93 8.711 8.711 8.464 0.247 17865
376 1 1 . 1 1 69 69 ASP N N 94 115.507 115.507 119.220 -3.713 17865
377 1 1 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.218 0.070 17865
378 1 1 . 1 1 69 69 ASP C C 94 177.063 177.063 177.219 -0.156 17865
379 1 1 . 1 1 69 69 ASP CA C 94 53.011 53.011 55.023 -2.012 17865
380 1 1 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.012 0.155 17865
381 1 1 . 1 1 69 69 ASP H H 94 8.010 8.010 7.642 0.368 17865
382 1 1 . 1 1 70 70 GLY N N 95 107.196 107.196 107.142 0.054 17865
383 1 1 . 1 1 70 70 GLY C C 95 173.936 173.936 173.860 0.076 17865
384 1 1 . 1 1 70 70 GLY CA C 95 45.392 45.392 45.673 -0.281 17865
385 1 1 . 1 1 70 70 GLY H H 95 7.986 7.986 7.812 0.174 17865
386 1 1 . 1 1 71 71 LYS N N 96 121.258 121.258 118.688 2.570 17865
387 1 1 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.783 0.001 17865
388 1 1 . 1 1 71 71 LYS CA C 96 54.114 54.114 52.559 1.555 17865
389 1 1 . 1 1 71 71 LYS CB C 96 31.762 31.762 33.819 -2.057 17865
390 1 1 . 1 1 71 71 LYS H H 96 7.877 7.877 7.543 0.334 17865
391 1 1 . 1 1 72 72 PRO C C 97 177.170 177.170 175.585 1.585 17865
392 1 1 . 1 1 72 72 PRO CA C 97 63.137 63.137 61.648 1.489 17865
393 1 1 . 1 1 72 72 PRO CB C 97 32.240 32.240 29.845 2.395 17865
394 1 1 . 1 1 73 73 LEU N N 98 123.503 123.503 119.274 4.229 17865
395 1 1 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.394 -0.034 17865
396 1 1 . 1 1 73 73 LEU C C 98 176.354 176.354 176.449 -0.095 17865
397 1 1 . 1 1 73 73 LEU CA C 98 53.927 53.927 54.100 -0.173 17865
398 1 1 . 1 1 73 73 LEU CB C 98 42.272 42.272 42.065 0.207 17865
399 1 1 . 1 1 73 73 LEU H H 98 8.850 8.850 7.372 1.478 17865
400 1 1 . 1 1 74 74 ASP N N 99 122.212 122.212 123.096 -0.884 17865
401 1 1 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.739 -0.142 17865
402 1 1 . 1 1 74 74 ASP C C 99 175.819 175.819 175.297 0.522 17865
403 1 1 . 1 1 74 74 ASP CA C 99 53.856 53.856 53.532 0.324 17865
404 1 1 . 1 1 74 74 ASP CB C 99 40.989 40.989 39.501 1.488 17865
405 1 1 . 1 1 74 74 ASP H H 99 8.517 8.517 8.543 -0.026 17865
406 1 1 . 1 1 75 75 LEU N N 100 125.874 125.874 117.039 8.835 17865
407 1 1 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.566 -0.200 17865
408 1 1 . 1 1 75 75 LEU C C 100 178.426 178.426 177.022 1.404 17865
409 1 1 . 1 1 75 75 LEU CA C 100 53.631 53.631 56.426 -2.795 17865
410 1 1 . 1 1 75 75 LEU CB C 100 40.676 40.676 41.522 -0.846 17865
411 1 1 . 1 1 75 75 LEU H H 100 8.281 8.281 7.528 0.753 17865
412 1 1 . 1 1 76 76 GLY N N 101 110.604 110.604 110.122 0.482 17865
413 1 1 . 1 1 76 76 GLY C C 101 176.936 176.936 175.425 1.511 17865
414 1 1 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.581 0.246 17865
415 1 1 . 1 1 76 76 GLY H H 101 8.914 8.914 8.429 0.485 17865
416 1 1 . 1 1 77 77 PHE N N 102 117.639 117.639 115.509 2.130 17865
417 1 1 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.798 -0.417 17865
418 1 1 . 1 1 77 77 PHE C C 102 177.878 177.878 175.468 2.410 17865
419 1 1 . 1 1 77 77 PHE CA C 102 59.139 59.139 57.717 1.422 17865
420 1 1 . 1 1 77 77 PHE CB C 102 36.935 36.935 38.698 -1.763 17865
421 1 1 . 1 1 77 77 PHE H H 102 7.992 7.992 7.752 0.240 17865
422 1 1 . 1 1 78 78 CYS N N 103 121.136 121.136 117.473 3.663 17865
423 1 1 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.713 -0.328 17865
424 1 1 . 1 1 78 78 CYS C C 103 172.780 172.780 175.760 -2.980 17865
425 1 1 . 1 1 78 78 CYS CA C 103 53.696 53.696 58.843 -5.147 17865
426 1 1 . 1 1 78 78 CYS CB C 103 34.237 34.237 29.410 4.827 17865
427 1 1 . 1 1 78 78 CYS H H 103 7.362 7.362 7.858 -0.496 17865
428 1 1 . 1 1 79 79 THR N N 104 114.773 114.773 117.041 -2.268 17865
429 1 1 . 1 1 79 79 THR HA H 104 3.984 3.984 4.155 -0.171 17865
430 1 1 . 1 1 79 79 THR C C 104 176.624 176.624 175.696 0.928 17865
431 1 1 . 1 1 79 79 THR CA C 104 65.180 65.180 64.961 0.219 17865
432 1 1 . 1 1 79 79 THR CB C 104 69.062 69.062 68.743 0.319 17865
433 1 1 . 1 1 79 79 THR H H 104 7.864 7.864 8.209 -0.345 17865
434 1 1 . 1 1 80 80 LEU N N 105 119.785 119.785 119.820 -0.035 17865
435 1 1 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.333 -0.002 17865
436 1 1 . 1 1 80 80 LEU C C 105 177.208 177.208 177.829 -0.621 17865
437 1 1 . 1 1 80 80 LEU CA C 105 55.453 55.453 56.072 -0.619 17865
438 1 1 . 1 1 80 80 LEU CB C 105 41.293 41.293 40.751 0.542 17865
439 1 1 . 1 1 80 80 LEU H H 105 7.238 7.238 8.071 -0.833 17865
440 1 1 . 1 1 81 81 ALA N N 106 119.309 119.309 120.829 -1.520 17865
441 1 1 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.360 0.167 17865
442 1 1 . 1 1 81 81 ALA C C 106 178.769 178.769 178.824 -0.055 17865
443 1 1 . 1 1 81 81 ALA CA C 106 52.049 52.049 53.288 -1.239 17865
444 1 1 . 1 1 81 81 ALA CB C 106 18.820 18.820 20.125 -1.305 17865
445 1 1 . 1 1 81 81 ALA H H 106 7.432 7.432 7.729 -0.297 17865
446 1 1 . 1 1 82 82 GLY N N 107 109.793 109.793 106.434 3.359 17865
447 1 1 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.367 1.752 17865
448 1 1 . 1 1 82 82 GLY H H 107 7.918 7.918 7.783 0.135 17865
449 1 1 . 1 1 83 83 ILE HA H 108 4.266 4.266 4.066 0.200 17865
450 1 1 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.004 0.259 17865
451 1 1 . 1 1 83 83 ILE CB C 108 38.261 38.261 38.027 0.234 17865
452 1 1 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.149 0.606 17865
453 1 1 . 1 1 84 84 ARG C C 109 181.344 181.344 178.086 3.258 17865
454 1 1 . 1 1 84 84 ARG CA C 109 55.939 55.939 56.430 -0.491 17865
455 1 1 . 1 1 84 84 ARG CB C 109 30.283 30.283 28.270 2.013 17865
456 1 1 . 1 1 85 85 GLU N N 110 122.944 122.944 120.959 1.985 17865
457 1 1 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.185 -0.568 17865
458 1 1 . 1 1 85 85 GLU C C 110 177.797 177.797 178.617 -0.820 17865
459 1 1 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.656 1.072 17865
460 1 1 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.279 -0.408 17865
461 1 1 . 1 1 85 85 GLU H H 110 8.003 8.003 7.391 0.612 17865
462 1 1 . 1 1 86 86 VAL N N 111 117.101 117.101 118.395 -1.294 17865
463 1 1 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.695 -0.184 17865
464 1 1 . 1 1 86 86 VAL C C 111 177.710 177.710 177.856 -0.146 17865
465 1 1 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.458 -0.028 17865
466 1 1 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.474 -0.261 17865
467 1 1 . 1 1 86 86 VAL H H 111 8.106 8.106 7.631 0.475 17865
468 1 1 . 1 1 87 87 ASP N N 112 122.242 122.242 120.510 1.732 17865
469 1 1 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.492 -0.188 17865
470 1 1 . 1 1 87 87 ASP C C 112 176.912 176.912 178.293 -1.381 17865
471 1 1 . 1 1 87 87 ASP CA C 112 57.417 57.417 58.139 -0.722 17865
472 1 1 . 1 1 87 87 ASP CB C 112 40.476 40.476 40.879 -0.403 17865
473 1 1 . 1 1 87 87 ASP H H 112 7.401 7.401 7.429 -0.028 17865
474 1 1 . 1 1 88 88 CYS N N 113 120.819 120.819 117.091 3.728 17865
475 1 1 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.213 -0.904 17865
476 1 1 . 1 1 88 88 CYS C C 113 175.270 175.270 176.898 -1.628 17865
477 1 1 . 1 1 88 88 CYS CA C 113 59.759 59.759 60.826 -1.067 17865
478 1 1 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.102 7.734 17865
479 1 1 . 1 1 88 88 CYS H H 113 7.785 7.785 8.061 -0.276 17865
480 1 1 . 1 1 89 89 ARG N N 114 118.654 118.654 121.220 -2.566 17865
481 1 1 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.056 -0.415 17865
482 1 1 . 1 1 89 89 ARG C C 114 179.018 179.018 177.808 1.210 17865
483 1 1 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.131 1.062 17865
484 1 1 . 1 1 89 89 ARG CB C 114 29.713 29.713 29.995 -0.282 17865
485 1 1 . 1 1 89 89 ARG H H 114 8.142 8.142 7.873 0.269 17865
486 1 1 . 1 1 90 90 LYS N N 115 120.964 120.964 117.822 3.142 17865
487 1 1 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.173 -0.143 17865
488 1 1 . 1 1 90 90 LYS C C 115 180.092 180.092 178.993 1.099 17865
489 1 1 . 1 1 90 90 LYS CA C 115 59.568 59.568 59.115 0.453 17865
490 1 1 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.470 -0.249 17865
491 1 1 . 1 1 90 90 LYS H H 115 7.936 7.936 7.630 0.306 17865
492 1 1 . 1 1 91 91 ASP N N 116 121.690 121.690 119.432 2.258 17865
493 1 1 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.559 -0.046 17865
494 1 1 . 1 1 91 91 ASP C C 116 179.419 179.419 178.287 1.132 17865
495 1 1 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.226 1.011 17865
496 1 1 . 1 1 91 91 ASP CB C 116 40.648 40.648 40.713 -0.065 17865
497 1 1 . 1 1 91 91 ASP H H 116 8.558 8.558 7.697 0.861 17865
498 1 1 . 1 1 92 92 ALA N N 117 122.784 122.784 122.845 -0.061 17865
499 1 1 . 1 1 92 92 ALA HA H 117 4.023 4.023 3.983 0.040 17865
500 1 1 . 1 1 92 92 ALA C C 117 178.789 178.789 177.915 0.874 17865
501 1 1 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.015 0.036 17865
502 1 1 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.600 0.575 17865
503 1 1 . 1 1 92 92 ALA H H 117 8.703 8.703 7.968 0.735 17865
504 1 1 . 1 1 93 93 GLN N N 118 115.510 115.510 114.798 0.712 17865
505 1 1 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.194 -0.250 17865
506 1 1 . 1 1 93 93 GLN C C 118 178.745 178.745 177.953 0.792 17865
507 1 1 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.838 0.644 17865
508 1 1 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.262 0.135 17865
509 1 1 . 1 1 93 93 GLN H H 118 7.664 7.664 8.113 -0.449 17865
510 1 1 . 1 1 94 94 THR N N 119 110.110 110.110 116.535 -6.425 17865
511 1 1 . 1 1 94 94 THR HA H 119 4.237 4.237 4.255 -0.018 17865
512 1 1 . 1 1 94 94 THR C C 119 175.861 175.861 175.586 0.275 17865
513 1 1 . 1 1 94 94 THR CA C 119 64.604 64.604 64.766 -0.162 17865
514 1 1 . 1 1 94 94 THR CB C 119 69.716 69.716 69.009 0.707 17865
515 1 1 . 1 1 94 94 THR H H 119 7.726 7.726 8.038 -0.312 17865
516 1 1 . 1 1 95 95 CYS N N 120 118.523 118.523 121.098 -2.575 17865
517 1 1 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.509 0.224 17865
518 1 1 . 1 1 95 95 CYS C C 120 175.165 175.165 175.022 0.143 17865
519 1 1 . 1 1 95 95 CYS CA C 120 52.973 52.973 58.081 -5.108 17865
520 1 1 . 1 1 95 95 CYS CB C 120 36.731 36.731 25.216 11.515 17865
521 1 1 . 1 1 95 95 CYS H H 120 7.756 7.756 8.382 -0.626 17865
522 1 1 . 1 1 96 96 ASP N N 121 119.081 119.081 123.355 -4.274 17865
523 1 1 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.466 0.212 17865
524 1 1 . 1 1 96 96 ASP CA C 121 56.224 56.224 56.100 0.124 17865
525 1 1 . 1 1 96 96 ASP CB C 121 42.731 42.731 40.902 1.829 17865
526 1 1 . 1 1 96 96 ASP H H 121 7.354 7.354 8.232 -0.878 17865
527 1 1 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.472 -0.897 17865
528 1 1 . 1 1 97 97 LYS C C 122 175.510 175.510 178.242 -2.732 17865
529 1 1 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.531 0.308 17865
530 1 1 . 1 1 97 97 LYS CB C 122 30.750 30.750 33.862 -3.112 17865
531 1 1 . 1 1 98 98 LYS N N 123 119.980 119.980 119.603 0.377 17865
532 1 1 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.416 -0.122 17865
533 1 1 . 1 1 98 98 LYS C C 123 176.968 176.968 177.696 -0.728 17865
534 1 1 . 1 1 98 98 LYS CA C 123 55.904 55.904 57.773 -1.869 17865
535 1 1 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.190 0.042 17865
536 1 1 . 1 1 98 98 LYS H H 123 7.799 7.799 8.278 -0.479 17865
537 1 1 . 1 1 99 99 TYR N N 124 122.378 122.378 121.046 1.332 17865
538 1 1 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.312 -0.417 17865
539 1 1 . 1 1 99 99 TYR C C 124 177.126 177.126 177.757 -0.631 17865
540 1 1 . 1 1 99 99 TYR CA C 124 60.211 60.211 60.033 0.178 17865
541 1 1 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.406 -0.135 17865
542 1 1 . 1 1 99 99 TYR H H 124 8.536 8.536 8.249 0.287 17865
543 1 1 . 1 1 100 100 GLU N N 125 118.610 118.610 116.986 1.624 17865
544 1 1 . 1 1 100 100 GLU HA H 125 4.268 4.268 3.951 0.317 17865
545 1 1 . 1 1 100 100 GLU C C 125 177.387 177.387 178.062 -0.675 17865
546 1 1 . 1 1 100 100 GLU CA C 125 55.759 55.759 56.732 -0.973 17865
547 1 1 . 1 1 100 100 GLU CB C 125 27.321 27.321 28.604 -1.283 17865
548 1 1 . 1 1 100 100 GLU H H 125 8.385 8.385 8.740 -0.355 17865
549 1 1 . 1 1 101 101 SER N N 126 115.949 115.949 116.388 -0.439 17865
550 1 1 . 1 1 101 101 SER HA H 126 3.959 3.959 4.070 -0.111 17865
551 1 1 . 1 1 101 101 SER C C 126 176.047 176.047 176.031 0.016 17865
552 1 1 . 1 1 101 101 SER CA C 126 62.439 62.439 61.866 0.573 17865
553 1 1 . 1 1 101 101 SER CB C 126 63.299 63.299 62.981 0.318 17865
554 1 1 . 1 1 101 101 SER H H 126 7.823 7.823 7.780 0.043 17865
555 1 1 . 1 1 102 102 ASP N N 127 120.920 120.920 120.859 0.061 17865
556 1 1 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.362 0.045 17865
557 1 1 . 1 1 102 102 ASP C C 127 178.234 178.234 177.967 0.267 17865
558 1 1 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.388 0.023 17865
559 1 1 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.855 -1.139 17865
560 1 1 . 1 1 102 102 ASP H H 127 8.683 8.683 8.075 0.608 17865
561 1 1 . 1 1 103 103 LYS N N 128 121.753 121.753 118.447 3.306 17865
562 1 1 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.122 -0.118 17865
563 1 1 . 1 1 103 103 LYS C C 128 179.395 179.395 178.781 0.614 17865
564 1 1 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.082 1.389 17865
565 1 1 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.714 0.687 17865
566 1 1 . 1 1 103 103 LYS H H 128 7.771 7.771 8.094 -0.323 17865
567 1 1 . 1 1 104 104 CYS N N 129 120.109 120.109 119.833 0.276 17865
568 1 1 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.219 -0.025 17865
569 1 1 . 1 1 104 104 CYS C C 129 176.779 176.779 176.596 0.183 17865
570 1 1 . 1 1 104 104 CYS CA C 129 59.790 59.790 61.409 -1.619 17865
571 1 1 . 1 1 104 104 CYS CB C 129 36.879 36.879 25.952 10.927 17865
572 1 1 . 1 1 104 104 CYS H H 129 7.973 7.973 8.387 -0.414 17865
573 1 1 . 1 1 105 105 LEU N N 130 121.804 121.804 121.753 0.051 17865
574 1 1 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.898 0.192 17865
575 1 1 . 1 1 105 105 LEU C C 130 179.373 179.373 178.721 0.652 17865
576 1 1 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.001 -0.633 17865
577 1 1 . 1 1 105 105 LEU CB C 130 42.098 42.098 42.017 0.081 17865
578 1 1 . 1 1 105 105 LEU H H 130 8.666 8.666 8.182 0.484 17865
579 1 1 . 1 1 106 106 ASN N N 131 118.535 118.535 116.344 2.191 17865
580 1 1 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.414 -0.176 17865
581 1 1 . 1 1 106 106 ASN C C 131 177.830 177.830 177.223 0.607 17865
582 1 1 . 1 1 106 106 ASN CA C 131 56.256 56.256 56.476 -0.220 17865
583 1 1 . 1 1 106 106 ASN CB C 131 37.817 37.817 38.500 -0.683 17865
584 1 1 . 1 1 106 106 ASN H H 131 8.438 8.438 8.007 0.431 17865
585 1 1 . 1 1 107 107 ALA N N 132 121.485 121.485 120.671 0.814 17865
586 1 1 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.239 -0.020 17865
587 1 1 . 1 1 107 107 ALA C C 132 180.726 180.726 178.337 2.389 17865
588 1 1 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.081 0.882 17865
589 1 1 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.918 -1.097 17865
590 1 1 . 1 1 107 107 ALA H H 132 7.541 7.541 7.489 0.052 17865
591 1 1 . 1 1 108 108 ILE N N 133 120.979 120.979 116.857 4.122 17865
592 1 1 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.944 -0.013 17865
593 1 1 . 1 1 108 108 ILE C C 133 178.114 178.114 177.568 0.546 17865
594 1 1 . 1 1 108 108 ILE CA C 133 63.353 63.353 61.833 1.520 17865
595 1 1 . 1 1 108 108 ILE CB C 133 36.454 36.454 37.564 -1.110 17865
596 1 1 . 1 1 108 108 ILE H H 133 7.551 7.551 7.399 0.152 17865
597 1 1 . 1 1 109 109 LYS N N 134 121.415 121.415 119.622 1.793 17865
598 1 1 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.165 -0.577 17865
599 1 1 . 1 1 109 109 LYS C C 134 179.561 179.561 179.210 0.351 17865
600 1 1 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.816 0.291 17865
601 1 1 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.216 -0.055 17865
602 1 1 . 1 1 109 109 LYS H H 134 8.414 8.414 7.647 0.767 17865
603 1 1 . 1 1 110 110 GLU N N 135 116.099 116.099 117.609 -1.510 17865
604 1 1 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.219 -0.290 17865
605 1 1 . 1 1 110 110 GLU C C 135 178.239 178.239 178.669 -0.430 17865
606 1 1 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.423 0.223 17865
607 1 1 . 1 1 110 110 GLU CB C 135 29.638 29.638 28.938 0.700 17865
608 1 1 . 1 1 110 110 GLU H H 135 7.473 7.473 8.097 -0.624 17865
609 1 1 . 1 1 111 111 LYS N N 136 119.805 119.805 119.691 0.114 17865
610 1 1 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.011 -0.105 17865
611 1 1 . 1 1 111 111 LYS C C 136 177.600 177.600 176.466 1.134 17865
612 1 1 . 1 1 111 111 LYS CA C 136 58.749 58.749 57.590 1.159 17865
613 1 1 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.327 0.911 17865
614 1 1 . 1 1 111 111 LYS H H 136 7.540 7.540 7.591 -0.051 17865
615 1 1 . 1 1 112 112 TYR N N 137 114.768 114.768 115.056 -0.288 17865
616 1 1 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.629 -0.106 17865
617 1 1 . 1 1 112 112 TYR C C 137 174.690 174.690 174.699 -0.009 17865
618 1 1 . 1 1 112 112 TYR CA C 137 58.359 58.359 56.406 1.953 17865
619 1 1 . 1 1 112 112 TYR CB C 137 38.328 38.328 37.632 0.696 17865
620 1 1 . 1 1 112 112 TYR H H 137 7.488 7.488 7.415 0.073 17865
621 1 1 . 1 1 113 113 LYS N N 138 123.694 123.694 124.528 -0.834 17865
622 1 1 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.339 0.162 17865
623 1 1 . 1 1 113 113 LYS CA C 138 55.282 55.282 55.242 0.040 17865
624 1 1 . 1 1 113 113 LYS CB C 138 32.124 32.124 33.039 -0.915 17865
625 1 1 . 1 1 113 113 LYS H H 138 7.217 7.217 7.183 0.034 17865
626 1 1 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.512 -0.060 17865
627 1 1 . 1 1 114 114 PRO C C 139 176.974 176.974 176.469 0.505 17865
628 1 1 . 1 1 114 114 PRO CA C 139 63.189 63.189 62.724 0.465 17865
629 1 1 . 1 1 114 114 PRO CB C 139 32.251 32.251 30.911 1.340 17865
630 1 1 . 1 1 115 115 VAL N N 140 121.098 121.098 119.370 1.728 17865
631 1 1 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.247 -0.145 17865
632 1 1 . 1 1 115 115 VAL C C 140 176.207 176.207 176.337 -0.130 17865
633 1 1 . 1 1 115 115 VAL CA C 140 62.356 62.356 62.143 0.213 17865
634 1 1 . 1 1 115 115 VAL CB C 140 33.256 33.256 31.409 1.847 17865
635 1 1 . 1 1 115 115 VAL H H 140 8.272 8.272 7.854 0.418 17865
636 1 1 . 1 1 116 116 VAL N N 141 124.167 124.167 120.557 3.610 17865
637 1 1 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.267 -0.145 17865
638 1 1 . 1 1 116 116 VAL C C 141 175.415 175.415 175.991 -0.576 17865
639 1 1 . 1 1 116 116 VAL CA C 141 61.731 61.731 61.856 -0.125 17865
640 1 1 . 1 1 116 116 VAL CB C 141 33.145 33.145 33.056 0.089 17865
641 1 1 . 1 1 116 116 VAL H H 141 8.142 8.142 7.523 0.619 17865
642 1 1 . 1 1 117 117 ASP N N 142 126.737 126.737 125.182 1.555 17865
643 1 1 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.810 0.002 17865
644 1 1 . 1 1 117 117 ASP CA C 142 52.217 52.217 52.350 -0.133 17865
645 1 1 . 1 1 117 117 ASP CB C 142 41.368 41.368 40.534 0.834 17865
646 1 1 . 1 1 117 117 ASP H H 142 8.419 8.419 8.323 0.096 17865
647 1 1 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.426 -0.015 17865
648 1 1 . 1 1 118 118 PRO C C 143 176.662 176.662 176.222 0.440 17865
649 1 1 . 1 1 118 118 PRO CA C 143 63.247 63.247 62.618 0.629 17865
650 1 1 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.428 -0.118 17865
651 1 1 . 1 1 119 119 ASN N N 144 119.287 119.287 118.808 0.479 17865
652 1 1 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.772 0.175 17865
653 1 1 . 1 1 119 119 ASN CA C 144 51.633 51.633 52.326 -0.693 17865
654 1 1 . 1 1 119 119 ASN CB C 144 38.859 38.859 37.950 0.909 17865
655 1 1 . 1 1 119 119 ASN H H 144 8.432 8.432 8.328 0.104 17865
656 1 1 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.658 0.022 17865
657 1 1 . 1 1 120 120 PRO CA C 145 61.640 61.640 62.447 -0.807 17865
658 1 1 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.424 -0.506 17865
659 1 1 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.486 -0.109 17865
660 1 1 . 1 1 121 121 PRO C C 146 175.876 175.876 175.620 0.256 17865
661 1 1 . 1 1 121 121 PRO CA C 146 63.174 63.174 62.947 0.227 17865
662 1 1 . 1 1 121 121 PRO CB C 146 31.939 31.939 31.224 0.715 17865
663 1 2 . 1 1 2 2 ASP N N 27 121.041 121.041 119.305 1.736 17865
664 1 2 . 1 1 2 2 ASP HA H 27 4.638 4.638 5.041 -0.403 17865
665 1 2 . 1 1 2 2 ASP C C 27 175.878 175.878 176.201 -0.323 17865
666 1 2 . 1 1 2 2 ASP CA C 27 54.382 54.382 55.483 -1.101 17865
667 1 2 . 1 1 2 2 ASP CB C 27 41.729 41.729 41.607 0.122 17865
668 1 2 . 1 1 2 2 ASP H H 27 8.639 8.639 8.845 -0.206 17865
669 1 2 . 1 1 3 3 VAL N N 28 119.901 119.901 118.934 0.967 17865
670 1 2 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.260 -0.227 17865
671 1 2 . 1 1 3 3 VAL C C 28 175.521 175.521 174.055 1.466 17865
672 1 2 . 1 1 3 3 VAL CA C 28 62.216 62.216 61.492 0.724 17865
673 1 2 . 1 1 3 3 VAL CB C 28 33.003 33.003 32.924 0.079 17865
674 1 2 . 1 1 3 3 VAL H H 28 8.113 8.113 8.190 -0.077 17865
675 1 2 . 1 1 4 4 PHE N N 29 123.707 123.707 124.107 -0.400 17865
676 1 2 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.883 -0.227 17865
677 1 2 . 1 1 4 4 PHE C C 29 174.874 174.874 173.974 0.900 17865
678 1 2 . 1 1 4 4 PHE CA C 29 57.159 57.159 56.968 0.191 17865
679 1 2 . 1 1 4 4 PHE CB C 29 39.795 39.795 40.236 -0.441 17865
680 1 2 . 1 1 4 4 PHE H H 29 8.255 8.255 7.832 0.423 17865
681 1 2 . 1 1 5 5 ASP N N 30 124.203 124.203 124.215 -0.012 17865
682 1 2 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.751 0.087 17865
683 1 2 . 1 1 5 5 ASP CA C 30 52.385 52.385 53.352 -0.967 17865
684 1 2 . 1 1 5 5 ASP CB C 30 40.801 40.801 41.414 -0.613 17865
685 1 2 . 1 1 5 5 ASP H H 30 8.226 8.226 8.560 -0.334 17865
686 1 2 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.634 -0.097 17865
687 1 2 . 1 1 6 6 PRO CA C 31 61.664 61.664 61.831 -0.167 17865
688 1 2 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.253 -0.427 17865
689 1 2 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.326 0.100 17865
690 1 2 . 1 1 7 7 PRO C C 32 177.226 177.226 176.316 0.910 17865
691 1 2 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.123 0.046 17865
692 1 2 . 1 1 7 7 PRO CB C 32 31.948 31.948 31.653 0.295 17865
693 1 2 . 1 1 8 8 THR N N 33 114.158 114.158 119.550 -5.392 17865
694 1 2 . 1 1 8 8 THR HA H 33 4.195 4.195 4.040 0.155 17865
695 1 2 . 1 1 8 8 THR C C 33 174.468 174.468 174.278 0.190 17865
696 1 2 . 1 1 8 8 THR CA C 33 62.110 62.110 62.474 -0.363 17865
697 1 2 . 1 1 8 8 THR CB C 33 69.975 69.975 68.916 1.058 17865
698 1 2 . 1 1 8 8 THR H H 33 8.096 8.096 8.188 -0.092 17865
699 1 2 . 1 1 9 9 GLN N N 34 122.411 122.411 125.739 -3.328 17865
700 1 2 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.027 0.236 17865
701 1 2 . 1 1 9 9 GLN C C 34 175.445 175.445 175.170 0.275 17865
702 1 2 . 1 1 9 9 GLN CA C 34 55.763 55.763 55.834 -0.071 17865
703 1 2 . 1 1 9 9 GLN CB C 34 29.691 29.691 27.555 2.136 17865
704 1 2 . 1 1 9 9 GLN H H 34 8.278 8.278 8.404 -0.126 17865
705 1 2 . 1 1 10 10 TYR N N 35 121.048 121.048 123.377 -2.329 17865
706 1 2 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.168 0.352 17865
707 1 2 . 1 1 10 10 TYR C C 35 176.314 176.314 175.916 0.398 17865
708 1 2 . 1 1 10 10 TYR CA C 35 57.972 57.972 59.466 -1.494 17865
709 1 2 . 1 1 10 10 TYR CB C 35 38.936 38.936 38.717 0.219 17865
710 1 2 . 1 1 10 10 TYR H H 35 8.227 8.227 7.598 0.629 17865
711 1 2 . 1 1 11 11 GLY N N 36 109.711 109.711 103.345 6.366 17865
712 1 2 . 1 1 11 11 GLY C C 36 174.128 174.128 174.179 -0.051 17865
713 1 2 . 1 1 11 11 GLY CA C 36 45.212 45.212 44.784 0.428 17865
714 1 2 . 1 1 11 11 GLY H H 36 8.247 8.247 7.558 0.689 17865
715 1 2 . 1 1 12 12 TYR N N 37 120.302 120.302 119.608 0.694 17865
716 1 2 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.819 -0.337 17865
717 1 2 . 1 1 12 12 TYR C C 37 175.864 175.864 175.897 -0.033 17865
718 1 2 . 1 1 12 12 TYR CA C 37 58.541 58.541 58.369 0.172 17865
719 1 2 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.776 -1.061 17865
720 1 2 . 1 1 12 12 TYR H H 37 8.101 8.101 7.503 0.598 17865
721 1 2 . 1 1 13 13 ASP N N 38 121.883 121.883 118.268 3.615 17865
722 1 2 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.636 -0.150 17865
723 1 2 . 1 1 13 13 ASP C C 38 176.538 176.538 177.449 -0.911 17865
724 1 2 . 1 1 13 13 ASP CA C 38 54.223 54.223 54.433 -0.210 17865
725 1 2 . 1 1 13 13 ASP CB C 38 40.988 40.988 40.916 0.072 17865
726 1 2 . 1 1 13 13 ASP H H 38 8.266 8.266 7.192 1.074 17865
727 1 2 . 1 1 14 14 GLY N N 39 107.705 107.705 106.941 0.764 17865
728 1 2 . 1 1 14 14 GLY C C 39 173.822 173.822 173.961 -0.139 17865
729 1 2 . 1 1 14 14 GLY CA C 39 45.404 45.404 45.467 -0.063 17865
730 1 2 . 1 1 14 14 GLY H H 39 7.647 7.647 8.012 -0.365 17865
731 1 2 . 1 1 15 15 LYS N N 40 121.621 121.621 118.665 2.956 17865
732 1 2 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.604 -0.029 17865
733 1 2 . 1 1 15 15 LYS CA C 40 54.100 54.100 53.025 1.075 17865
734 1 2 . 1 1 15 15 LYS CB C 40 32.510 32.510 33.326 -0.816 17865
735 1 2 . 1 1 15 15 LYS H H 40 7.908 7.908 6.895 1.013 17865
736 1 2 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.613 -0.261 17865
737 1 2 . 1 1 16 16 PRO C C 41 176.806 176.806 176.279 0.527 17865
738 1 2 . 1 1 16 16 PRO CA C 41 62.758 62.758 61.960 0.798 17865
739 1 2 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.602 -0.289 17865
740 1 2 . 1 1 17 17 LEU N N 42 123.488 123.488 120.209 3.279 17865
741 1 2 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.265 -0.216 17865
742 1 2 . 1 1 17 17 LEU C C 42 174.973 174.973 176.104 -1.131 17865
743 1 2 . 1 1 17 17 LEU CA C 42 55.436 55.436 55.568 -0.132 17865
744 1 2 . 1 1 17 17 LEU CB C 42 42.093 42.093 41.605 0.488 17865
745 1 2 . 1 1 17 17 LEU H H 42 8.499 8.499 8.567 -0.068 17865
746 1 2 . 1 1 18 18 ASP N N 43 123.354 123.354 123.045 0.309 17865
747 1 2 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.798 -0.300 17865
748 1 2 . 1 1 18 18 ASP C C 43 175.947 175.947 176.375 -0.428 17865
749 1 2 . 1 1 18 18 ASP CA C 43 52.858 52.858 52.983 -0.125 17865
750 1 2 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.791 -2.570 17865
751 1 2 . 1 1 18 18 ASP H H 43 7.789 7.789 8.204 -0.415 17865
752 1 2 . 1 1 19 19 ALA N N 44 120.147 120.147 124.822 -4.675 17865
753 1 2 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.163 -0.177 17865
754 1 2 . 1 1 19 19 ALA C C 44 179.476 179.476 179.207 0.269 17865
755 1 2 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.559 0.605 17865
756 1 2 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.741 -0.354 17865
757 1 2 . 1 1 19 19 ALA H H 44 8.561 8.561 8.742 -0.181 17865
758 1 2 . 1 1 20 20 SER N N 45 115.037 115.037 115.961 -0.924 17865
759 1 2 . 1 1 20 20 SER HA H 45 4.151 4.151 4.215 -0.064 17865
760 1 2 . 1 1 20 20 SER C C 45 177.191 177.191 176.683 0.508 17865
761 1 2 . 1 1 20 20 SER CA C 45 61.629 61.629 61.059 0.571 17865
762 1 2 . 1 1 20 20 SER CB C 45 62.804 62.804 63.050 -0.246 17865
763 1 2 . 1 1 20 20 SER H H 45 8.466 8.466 8.429 0.037 17865
764 1 2 . 1 1 21 21 PHE N N 46 125.030 125.030 123.654 1.376 17865
765 1 2 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.401 -0.170 17865
766 1 2 . 1 1 21 21 PHE C C 46 176.850 176.850 175.783 1.067 17865
767 1 2 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.620 0.186 17865
768 1 2 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.548 0.333 17865
769 1 2 . 1 1 21 21 PHE H H 46 8.034 8.034 7.944 0.090 17865
770 1 2 . 1 1 22 22 CYS N N 47 113.943 113.943 117.362 -3.419 17865
771 1 2 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.421 -0.170 17865
772 1 2 . 1 1 22 22 CYS C C 47 176.449 176.449 176.046 0.403 17865
773 1 2 . 1 1 22 22 CYS CA C 47 53.600 53.600 58.150 -4.550 17865
774 1 2 . 1 1 22 22 CYS CB C 47 36.391 36.391 26.011 10.380 17865
775 1 2 . 1 1 22 22 CYS H H 47 7.691 7.691 7.808 -0.117 17865
776 1 2 . 1 1 23 23 ARG N N 48 119.958 119.958 120.123 -0.165 17865
777 1 2 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.146 -0.066 17865
778 1 2 . 1 1 23 23 ARG C C 48 177.904 177.904 176.955 0.949 17865
779 1 2 . 1 1 23 23 ARG CA C 48 58.907 58.907 58.825 0.082 17865
780 1 2 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.854 0.317 17865
781 1 2 . 1 1 23 23 ARG H H 48 7.628 7.628 7.378 0.250 17865
782 1 2 . 1 1 24 24 THR N N 49 106.445 106.445 110.899 -4.454 17865
783 1 2 . 1 1 24 24 THR HA H 49 4.385 4.385 4.448 -0.063 17865
784 1 2 . 1 1 24 24 THR C C 49 174.758 174.758 174.589 0.169 17865
785 1 2 . 1 1 24 24 THR CA C 49 61.573 61.573 61.337 0.236 17865
786 1 2 . 1 1 24 24 THR CB C 49 68.794 68.794 68.976 -0.182 17865
787 1 2 . 1 1 24 24 THR H H 49 7.307 7.307 7.778 -0.471 17865
788 1 2 . 1 1 25 25 ALA N N 50 122.242 122.242 123.085 -0.843 17865
789 1 2 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.533 -0.129 17865
790 1 2 . 1 1 25 25 ALA C C 50 178.554 178.554 177.988 0.566 17865
791 1 2 . 1 1 25 25 ALA CA C 50 52.381 52.381 52.338 0.043 17865
792 1 2 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.578 -1.183 17865
793 1 2 . 1 1 25 25 ALA H H 50 7.401 7.401 8.100 -0.699 17865
794 1 2 . 1 1 26 26 GLY N N 51 110.604 110.604 108.732 1.872 17865
795 1 2 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.918 0.104 17865
796 1 2 . 1 1 26 26 GLY H H 51 8.285 8.285 7.931 0.354 17865
797 1 2 . 1 1 27 27 SER HA H 52 4.382 4.382 4.400 -0.018 17865
798 1 2 . 1 1 27 27 SER C C 52 175.774 175.774 175.753 0.021 17865
799 1 2 . 1 1 27 27 SER CA C 52 60.803 60.803 60.741 0.062 17865
800 1 2 . 1 1 27 27 SER CB C 52 62.827 62.827 62.922 -0.095 17865
801 1 2 . 1 1 28 28 ARG N N 53 119.682 119.682 118.575 1.107 17865
802 1 2 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.755 0.125 17865
803 1 2 . 1 1 28 28 ARG C C 53 175.796 175.796 177.244 -1.448 17865
804 1 2 . 1 1 28 28 ARG CA C 53 55.738 55.738 55.268 0.470 17865
805 1 2 . 1 1 28 28 ARG CB C 53 30.237 30.237 30.270 -0.033 17865
806 1 2 . 1 1 28 28 ARG H H 53 7.894 7.894 8.034 -0.140 17865
807 1 2 . 1 1 29 29 GLU N N 54 122.318 122.318 122.397 -0.079 17865
808 1 2 . 1 1 29 29 GLU HA H 54 3.595 3.595 4.258 -0.663 17865
809 1 2 . 1 1 29 29 GLU C C 54 177.523 177.523 178.325 -0.802 17865
810 1 2 . 1 1 29 29 GLU CA C 54 61.223 61.223 59.749 1.474 17865
811 1 2 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.624 -0.687 17865
812 1 2 . 1 1 29 29 GLU H H 54 7.730 7.730 7.959 -0.229 17865
813 1 2 . 1 1 30 30 LYS N N 55 118.377 118.377 117.718 0.659 17865
814 1 2 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.068 -0.240 17865
815 1 2 . 1 1 30 30 LYS C C 55 179.205 179.205 178.888 0.317 17865
816 1 2 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.444 0.983 17865
817 1 2 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.311 -0.710 17865
818 1 2 . 1 1 30 30 LYS H H 55 8.659 8.659 7.513 1.146 17865
819 1 2 . 1 1 31 31 ASP N N 56 121.614 121.614 119.242 2.372 17865
820 1 2 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.487 -0.176 17865
821 1 2 . 1 1 31 31 ASP C C 56 177.393 177.393 177.583 -0.190 17865
822 1 2 . 1 1 31 31 ASP CA C 56 57.316 57.316 57.272 0.044 17865
823 1 2 . 1 1 31 31 ASP CB C 56 40.423 40.423 40.831 -0.409 17865
824 1 2 . 1 1 31 31 ASP H H 56 7.646 7.646 8.352 -0.706 17865
825 1 2 . 1 1 32 32 CYS N N 57 120.345 120.345 118.641 1.704 17865
826 1 2 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.823 -0.222 17865
827 1 2 . 1 1 32 32 CYS C C 57 175.772 175.772 176.934 -1.162 17865
828 1 2 . 1 1 32 32 CYS CA C 57 60.197 60.197 60.822 -0.625 17865
829 1 2 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.740 8.226 17865
830 1 2 . 1 1 32 32 CYS H H 57 8.042 8.042 7.679 0.363 17865
831 1 2 . 1 1 33 33 ARG N N 58 120.293 120.293 120.001 0.292 17865
832 1 2 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.978 -0.302 17865
833 1 2 . 1 1 33 33 ARG C C 58 179.633 179.633 178.985 0.648 17865
834 1 2 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.568 0.819 17865
835 1 2 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.937 -0.096 17865
836 1 2 . 1 1 33 33 ARG H H 58 8.531 8.531 7.765 0.766 17865
837 1 2 . 1 1 34 34 LYS N N 59 121.166 121.166 119.334 1.832 17865
838 1 2 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.190 -0.154 17865
839 1 2 . 1 1 34 34 LYS C C 59 179.220 179.220 179.015 0.205 17865
840 1 2 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.673 0.857 17865
841 1 2 . 1 1 34 34 LYS CB C 59 32.110 32.110 32.250 -0.140 17865
842 1 2 . 1 1 34 34 LYS H H 59 7.633 7.633 7.432 0.201 17865
843 1 2 . 1 1 35 35 ASP N N 60 122.166 122.166 119.736 2.430 17865
844 1 2 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.518 -0.087 17865
845 1 2 . 1 1 35 35 ASP C C 60 179.709 179.709 178.988 0.721 17865
846 1 2 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.475 0.228 17865
847 1 2 . 1 1 35 35 ASP CB C 60 40.672 40.672 40.894 -0.222 17865
848 1 2 . 1 1 35 35 ASP H H 60 8.221 8.221 8.067 0.154 17865
849 1 2 . 1 1 36 36 VAL N N 61 121.312 121.312 117.231 4.081 17865
850 1 2 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.802 -0.401 17865
851 1 2 . 1 1 36 36 VAL C C 61 178.339 178.339 177.966 0.373 17865
852 1 2 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.609 1.524 17865
853 1 2 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.471 0.186 17865
854 1 2 . 1 1 36 36 VAL H H 61 8.916 8.916 7.783 1.133 17865
855 1 2 . 1 1 37 37 GLN N N 62 119.166 119.166 117.890 1.276 17865
856 1 2 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.113 -0.171 17865
857 1 2 . 1 1 37 37 GLN C C 62 177.293 177.293 177.262 0.031 17865
858 1 2 . 1 1 37 37 GLN CA C 62 58.280 58.280 58.202 0.078 17865
859 1 2 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.886 -0.515 17865
860 1 2 . 1 1 37 37 GLN H H 62 7.697 7.697 7.711 -0.014 17865
861 1 2 . 1 1 38 38 ALA N N 63 118.964 118.964 121.053 -2.089 17865
862 1 2 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.231 0.011 17865
863 1 2 . 1 1 38 38 ALA C C 63 177.221 177.221 177.468 -0.247 17865
864 1 2 . 1 1 38 38 ALA CA C 63 53.137 53.137 53.152 -0.015 17865
865 1 2 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.130 -0.233 17865
866 1 2 . 1 1 38 38 ALA H H 63 7.508 7.508 7.604 -0.096 17865
867 1 2 . 1 1 39 39 CYS N N 64 119.081 119.081 118.478 0.603 17865
868 1 2 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.425 0.528 17865
869 1 2 . 1 1 39 39 CYS C C 64 172.052 172.052 174.862 -2.810 17865
870 1 2 . 1 1 39 39 CYS CA C 64 51.880 51.880 59.906 -8.026 17865
871 1 2 . 1 1 39 39 CYS CB C 64 34.328 34.328 26.710 7.618 17865
872 1 2 . 1 1 39 39 CYS H H 64 7.354 7.354 7.471 -0.117 17865
873 1 2 . 1 1 40 40 ASP N N 65 124.167 124.167 127.065 -2.898 17865
874 1 2 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.526 -0.201 17865
875 1 2 . 1 1 40 40 ASP C C 65 176.496 176.496 177.309 -0.813 17865
876 1 2 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.007 0.717 17865
877 1 2 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.532 -0.219 17865
878 1 2 . 1 1 40 40 ASP H H 65 8.142 8.142 8.698 -0.556 17865
879 1 2 . 1 1 41 41 LYS N N 66 118.844 118.844 119.427 -0.583 17865
880 1 2 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.048 0.476 17865
881 1 2 . 1 1 41 41 LYS C C 66 175.586 175.586 177.842 -2.256 17865
882 1 2 . 1 1 41 41 LYS CA C 66 55.275 55.275 58.539 -3.264 17865
883 1 2 . 1 1 41 41 LYS CB C 66 32.598 32.598 32.537 0.061 17865
884 1 2 . 1 1 41 41 LYS H H 66 7.858 7.858 8.557 -0.699 17865
885 1 2 . 1 1 42 42 LYS N N 67 126.081 126.081 113.649 12.432 17865
886 1 2 . 1 1 42 42 LYS HA H 67 3.915 3.915 3.764 0.151 17865
887 1 2 . 1 1 42 42 LYS C C 67 174.665 174.665 176.104 -1.439 17865
888 1 2 . 1 1 42 42 LYS CA C 67 57.827 57.827 58.745 -0.918 17865
889 1 2 . 1 1 42 42 LYS CB C 67 34.059 34.059 31.405 2.654 17865
890 1 2 . 1 1 42 42 LYS H H 67 8.790 8.790 8.359 0.431 17865
891 1 2 . 1 1 43 43 TYR N N 68 114.138 114.138 117.665 -3.527 17865
892 1 2 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.732 0.527 17865
893 1 2 . 1 1 43 43 TYR C C 68 175.767 175.767 175.580 0.187 17865
894 1 2 . 1 1 43 43 TYR CA C 68 55.880 55.880 57.799 -1.919 17865
895 1 2 . 1 1 43 43 TYR CB C 68 42.363 42.363 41.812 0.551 17865
896 1 2 . 1 1 43 43 TYR H H 68 7.294 7.294 8.330 -1.036 17865
897 1 2 . 1 1 44 44 ASP N N 69 121.807 121.807 122.070 -0.263 17865
898 1 2 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.676 -0.036 17865
899 1 2 . 1 1 44 44 ASP C C 69 177.812 177.812 177.354 0.458 17865
900 1 2 . 1 1 44 44 ASP CA C 69 52.110 52.110 54.715 -2.605 17865
901 1 2 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.438 -1.998 17865
902 1 2 . 1 1 44 44 ASP H H 69 8.995 8.995 8.863 0.132 17865
903 1 2 . 1 1 45 45 ASP N N 70 116.686 116.686 119.431 -2.745 17865
904 1 2 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.456 -0.032 17865
905 1 2 . 1 1 45 45 ASP C C 70 177.054 177.054 177.128 -0.074 17865
906 1 2 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.537 -0.156 17865
907 1 2 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.968 -0.720 17865
908 1 2 . 1 1 45 45 ASP H H 70 8.369 8.369 8.778 -0.409 17865
909 1 2 . 1 1 46 46 GLN N N 71 117.949 117.949 118.068 -0.119 17865
910 1 2 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.322 0.134 17865
911 1 2 . 1 1 46 46 GLN C C 71 176.273 176.273 176.833 -0.560 17865
912 1 2 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.701 -0.334 17865
913 1 2 . 1 1 46 46 GLN CB C 71 29.330 29.330 28.962 0.368 17865
914 1 2 . 1 1 46 46 GLN H H 71 8.274 8.274 8.202 0.072 17865
915 1 2 . 1 1 47 47 GLY N N 72 108.369 108.369 106.631 1.738 17865
916 1 2 . 1 1 47 47 GLY C C 72 174.145 174.145 173.998 0.147 17865
917 1 2 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.023 0.800 17865
918 1 2 . 1 1 47 47 GLY H H 72 8.174 8.174 7.735 0.439 17865
919 1 2 . 1 1 48 48 ARG N N 73 121.554 121.554 120.562 0.992 17865
920 1 2 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.625 -0.140 17865
921 1 2 . 1 1 48 48 ARG C C 73 176.855 176.855 176.057 0.798 17865
922 1 2 . 1 1 48 48 ARG CA C 73 55.289 55.289 54.285 1.004 17865
923 1 2 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.413 -0.855 17865
924 1 2 . 1 1 48 48 ARG H H 73 8.462 8.462 8.042 0.420 17865
925 1 2 . 1 1 49 49 GLU N N 74 122.784 122.784 120.732 2.052 17865
926 1 2 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.230 0.253 17865
927 1 2 . 1 1 49 49 GLU C C 74 178.098 178.098 176.842 1.256 17865
928 1 2 . 1 1 49 49 GLU CA C 74 57.184 57.184 57.232 -0.048 17865
929 1 2 . 1 1 49 49 GLU CB C 74 30.777 30.777 29.675 1.102 17865
930 1 2 . 1 1 49 49 GLU H H 74 8.703 8.703 8.678 0.025 17865
931 1 2 . 1 1 50 50 THR N N 75 114.563 114.563 115.435 -0.872 17865
932 1 2 . 1 1 50 50 THR HA H 75 4.212 4.212 4.331 -0.119 17865
933 1 2 . 1 1 50 50 THR C C 75 175.170 175.170 175.614 -0.444 17865
934 1 2 . 1 1 50 50 THR CA C 75 60.589 60.589 60.874 -0.285 17865
935 1 2 . 1 1 50 50 THR CB C 75 70.952 70.952 70.441 0.511 17865
936 1 2 . 1 1 50 50 THR H H 75 7.717 7.717 7.627 0.090 17865
937 1 2 . 1 1 51 51 ALA N N 76 122.097 122.097 122.726 -0.629 17865
938 1 2 . 1 1 51 51 ALA HA H 76 4.038 4.038 3.998 0.040 17865
939 1 2 . 1 1 51 51 ALA C C 76 181.906 181.906 178.729 3.177 17865
940 1 2 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.406 0.248 17865
941 1 2 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.136 -0.143 17865
942 1 2 . 1 1 51 51 ALA H H 76 8.734 8.734 8.873 -0.139 17865
943 1 2 . 1 1 52 52 CYS N N 77 115.347 115.347 116.789 -1.442 17865
944 1 2 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.174 0.306 17865
945 1 2 . 1 1 52 52 CYS C C 77 176.299 176.299 176.778 -0.479 17865
946 1 2 . 1 1 52 52 CYS CA C 77 57.701 57.701 60.745 -3.044 17865
947 1 2 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.585 10.046 17865
948 1 2 . 1 1 52 52 CYS H H 77 9.073 9.073 8.014 1.059 17865
949 1 2 . 1 1 53 53 ALA N N 78 128.517 128.517 122.336 6.181 17865
950 1 2 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.916 -0.061 17865
951 1 2 . 1 1 53 53 ALA C C 78 178.736 178.736 179.137 -0.401 17865
952 1 2 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.063 0.570 17865
953 1 2 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.974 1.217 17865
954 1 2 . 1 1 53 53 ALA H H 78 7.174 7.174 7.971 -0.797 17865
955 1 2 . 1 1 54 54 LYS N N 79 118.706 118.706 119.566 -0.860 17865
956 1 2 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.166 -0.363 17865
957 1 2 . 1 1 54 54 LYS C C 79 179.611 179.611 178.933 0.678 17865
958 1 2 . 1 1 54 54 LYS CA C 79 59.725 59.725 57.947 1.778 17865
959 1 2 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.130 0.523 17865
960 1 2 . 1 1 54 54 LYS H H 79 8.313 8.313 7.645 0.668 17865
961 1 2 . 1 1 55 55 GLY N N 80 104.822 104.822 107.321 -2.499 17865
962 1 2 . 1 1 55 55 GLY C C 80 176.504 176.504 176.335 0.169 17865
963 1 2 . 1 1 55 55 GLY CA C 80 46.839 46.839 46.955 -0.116 17865
964 1 2 . 1 1 55 55 GLY H H 80 8.175 8.175 8.219 -0.044 17865
965 1 2 . 1 1 56 56 ILE N N 81 123.697 123.697 122.519 1.178 17865
966 1 2 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.834 -0.039 17865
967 1 2 . 1 1 56 56 ILE C C 81 177.334 177.334 177.481 -0.147 17865
968 1 2 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.953 0.328 17865
969 1 2 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.939 0.396 17865
970 1 2 . 1 1 56 56 ILE H H 81 7.590 7.590 7.578 0.012 17865
971 1 2 . 1 1 57 57 ARG N N 82 118.161 118.161 119.205 -1.044 17865
972 1 2 . 1 1 57 57 ARG HA H 82 3.935 3.935 3.958 -0.023 17865
973 1 2 . 1 1 57 57 ARG C C 82 178.662 178.662 178.726 -0.064 17865
974 1 2 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.024 0.678 17865
975 1 2 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.341 0.558 17865
976 1 2 . 1 1 57 57 ARG H H 82 7.569 7.569 7.825 -0.256 17865
977 1 2 . 1 1 58 58 GLU N N 83 115.085 115.085 115.518 -0.433 17865
978 1 2 . 1 1 58 58 GLU HA H 83 4.031 4.031 3.683 0.348 17865
979 1 2 . 1 1 58 58 GLU C C 83 178.224 178.224 178.768 -0.544 17865
980 1 2 . 1 1 58 58 GLU CA C 83 58.304 58.304 57.811 0.493 17865
981 1 2 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.031 1.000 17865
982 1 2 . 1 1 58 58 GLU H H 83 7.786 7.786 7.427 0.359 17865
983 1 2 . 1 1 59 59 LYS N N 84 119.183 119.183 120.430 -1.247 17865
984 1 2 . 1 1 59 59 LYS HA H 84 3.830 3.830 4.079 -0.249 17865
985 1 2 . 1 1 59 59 LYS C C 84 177.933 177.933 177.575 0.358 17865
986 1 2 . 1 1 59 59 LYS CA C 84 59.043 59.043 58.410 0.633 17865
987 1 2 . 1 1 59 59 LYS CB C 84 33.650 33.650 33.382 0.268 17865
988 1 2 . 1 1 59 59 LYS H H 84 7.968 7.968 7.478 0.490 17865
989 1 2 . 1 1 60 60 TYR N N 85 113.663 113.663 117.499 -3.836 17865
990 1 2 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.697 0.006 17865
991 1 2 . 1 1 60 60 TYR C C 85 174.729 174.729 174.240 0.489 17865
992 1 2 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.172 1.030 17865
993 1 2 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.796 0.106 17865
994 1 2 . 1 1 60 60 TYR H H 85 7.562 7.562 8.284 -0.722 17865
995 1 2 . 1 1 61 61 LYS N N 86 121.862 121.862 120.666 1.196 17865
996 1 2 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.477 0.035 17865
997 1 2 . 1 1 61 61 LYS CA C 86 54.942 54.942 56.158 -1.216 17865
998 1 2 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.098 0.004 17865
999 1 2 . 1 1 61 61 LYS H H 86 7.222 7.222 7.516 -0.294 17865
1000 1 2 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.481 -0.158 17865
1001 1 2 . 1 1 62 62 PRO C C 87 176.576 176.576 175.893 0.683 17865
1002 1 2 . 1 1 62 62 PRO CA C 87 63.020 63.020 63.911 -0.891 17865
1003 1 2 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.254 -0.014 17865
1004 1 2 . 1 1 63 63 ALA N N 88 125.029 125.029 121.489 3.540 17865
1005 1 2 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.641 -0.387 17865
1006 1 2 . 1 1 63 63 ALA C C 88 177.301 177.301 175.609 1.692 17865
1007 1 2 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.080 0.201 17865
1008 1 2 . 1 1 63 63 ALA CB C 88 19.202 19.202 19.163 0.039 17865
1009 1 2 . 1 1 63 63 ALA H H 88 8.329 8.329 7.968 0.361 17865
1010 1 2 . 1 1 64 64 VAL N N 89 121.843 121.843 119.282 2.561 17865
1011 1 2 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.364 -0.420 17865
1012 1 2 . 1 1 64 64 VAL C C 89 174.791 174.791 174.007 0.784 17865
1013 1 2 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.256 1.725 17865
1014 1 2 . 1 1 64 64 VAL CB C 89 33.485 33.485 33.251 0.234 17865
1015 1 2 . 1 1 64 64 VAL H H 89 8.075 8.075 7.671 0.404 17865
1016 1 2 . 1 1 65 65 VAL N N 90 125.399 125.399 119.856 5.543 17865
1017 1 2 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.411 -0.273 17865
1018 1 2 . 1 1 65 65 VAL C C 90 174.340 174.340 174.739 -0.399 17865
1019 1 2 . 1 1 65 65 VAL CA C 90 61.162 61.162 62.126 -0.964 17865
1020 1 2 . 1 1 65 65 VAL CB C 90 33.866 33.866 32.444 1.422 17865
1021 1 2 . 1 1 65 65 VAL H H 90 8.229 8.229 8.011 0.218 17865
1022 1 2 . 1 1 66 66 TYR N N 91 124.848 124.848 126.942 -2.094 17865
1023 1 2 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.813 -0.042 17865
1024 1 2 . 1 1 66 66 TYR C C 91 176.658 176.658 176.904 -0.246 17865
1025 1 2 . 1 1 66 66 TYR CA C 91 58.084 58.084 58.340 -0.256 17865
1026 1 2 . 1 1 66 66 TYR CB C 91 41.535 41.535 39.126 2.409 17865
1027 1 2 . 1 1 66 66 TYR H H 91 9.145 9.145 8.575 0.570 17865
1028 1 2 . 1 1 67 67 GLY N N 92 106.185 106.185 111.375 -5.190 17865
1029 1 2 . 1 1 67 67 GLY C C 92 175.681 175.681 174.902 0.779 17865
1030 1 2 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.612 0.363 17865
1031 1 2 . 1 1 67 67 GLY H H 92 8.730 8.730 8.903 -0.173 17865
1032 1 2 . 1 1 68 68 TYR N N 93 121.815 121.815 117.079 4.736 17865
1033 1 2 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.189 -0.214 17865
1034 1 2 . 1 1 68 68 TYR C C 93 176.035 176.035 175.698 0.337 17865
1035 1 2 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.582 1.464 17865
1036 1 2 . 1 1 68 68 TYR CB C 93 38.425 38.425 37.705 0.720 17865
1037 1 2 . 1 1 68 68 TYR H H 93 8.711 8.711 8.857 -0.146 17865
1038 1 2 . 1 1 69 69 ASP N N 94 115.507 115.507 117.125 -1.618 17865
1039 1 2 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.440 -0.152 17865
1040 1 2 . 1 1 69 69 ASP C C 94 177.063 177.063 177.406 -0.343 17865
1041 1 2 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.376 -0.365 17865
1042 1 2 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.497 -0.330 17865
1043 1 2 . 1 1 69 69 ASP H H 94 8.010 8.010 7.520 0.490 17865
1044 1 2 . 1 1 70 70 GLY N N 95 107.196 107.196 108.834 -1.638 17865
1045 1 2 . 1 1 70 70 GLY C C 95 173.936 173.936 174.028 -0.092 17865
1046 1 2 . 1 1 70 70 GLY CA C 95 45.392 45.392 44.804 0.588 17865
1047 1 2 . 1 1 70 70 GLY H H 95 7.986 7.986 7.774 0.212 17865
1048 1 2 . 1 1 71 71 LYS N N 96 121.258 121.258 122.141 -0.883 17865
1049 1 2 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.599 0.185 17865
1050 1 2 . 1 1 71 71 LYS CA C 96 54.114 54.114 53.832 0.282 17865
1051 1 2 . 1 1 71 71 LYS CB C 96 31.762 31.762 32.494 -0.732 17865
1052 1 2 . 1 1 71 71 LYS H H 96 7.877 7.877 7.496 0.381 17865
1053 1 2 . 1 1 72 72 PRO C C 97 177.170 177.170 175.457 1.713 17865
1054 1 2 . 1 1 72 72 PRO CA C 97 63.137 63.137 62.165 0.972 17865
1055 1 2 . 1 1 72 72 PRO CB C 97 32.240 32.240 29.755 2.485 17865
1056 1 2 . 1 1 73 73 LEU N N 98 123.503 123.503 119.971 3.532 17865
1057 1 2 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.792 -0.432 17865
1058 1 2 . 1 1 73 73 LEU C C 98 176.354 176.354 175.954 0.400 17865
1059 1 2 . 1 1 73 73 LEU CA C 98 53.927 53.927 53.603 0.323 17865
1060 1 2 . 1 1 73 73 LEU CB C 98 42.272 42.272 45.460 -3.188 17865
1061 1 2 . 1 1 73 73 LEU H H 98 8.850 8.850 7.383 1.467 17865
1062 1 2 . 1 1 74 74 ASP N N 99 122.212 122.212 122.996 -0.784 17865
1063 1 2 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.680 -0.083 17865
1064 1 2 . 1 1 74 74 ASP C C 99 175.819 175.819 175.340 0.479 17865
1065 1 2 . 1 1 74 74 ASP CA C 99 53.856 53.856 54.443 -0.587 17865
1066 1 2 . 1 1 74 74 ASP CB C 99 40.989 40.989 38.750 2.239 17865
1067 1 2 . 1 1 74 74 ASP H H 99 8.517 8.517 8.817 -0.300 17865
1068 1 2 . 1 1 75 75 LEU N N 100 125.874 125.874 119.320 6.554 17865
1069 1 2 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.693 -0.327 17865
1070 1 2 . 1 1 75 75 LEU C C 100 178.426 178.426 176.971 1.455 17865
1071 1 2 . 1 1 75 75 LEU CA C 100 53.631 53.631 54.747 -1.116 17865
1072 1 2 . 1 1 75 75 LEU CB C 100 40.676 40.676 44.136 -3.460 17865
1073 1 2 . 1 1 75 75 LEU H H 100 8.281 8.281 8.249 0.032 17865
1074 1 2 . 1 1 76 76 GLY N N 101 110.604 110.604 109.764 0.840 17865
1075 1 2 . 1 1 76 76 GLY C C 101 176.936 176.936 175.450 1.486 17865
1076 1 2 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.433 0.394 17865
1077 1 2 . 1 1 76 76 GLY H H 101 8.914 8.914 7.712 1.202 17865
1078 1 2 . 1 1 77 77 PHE N N 102 117.639 117.639 117.133 0.506 17865
1079 1 2 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.688 -0.307 17865
1080 1 2 . 1 1 77 77 PHE C C 102 177.878 177.878 177.377 0.501 17865
1081 1 2 . 1 1 77 77 PHE CA C 102 59.139 59.139 59.080 0.059 17865
1082 1 2 . 1 1 77 77 PHE CB C 102 36.935 36.935 39.178 -2.243 17865
1083 1 2 . 1 1 77 77 PHE H H 102 7.992 7.992 8.107 -0.115 17865
1084 1 2 . 1 1 78 78 CYS N N 103 121.136 121.136 117.454 3.682 17865
1085 1 2 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.699 -0.314 17865
1086 1 2 . 1 1 78 78 CYS C C 103 172.780 172.780 176.748 -3.968 17865
1087 1 2 . 1 1 78 78 CYS CA C 103 53.696 53.696 59.765 -6.069 17865
1088 1 2 . 1 1 78 78 CYS CB C 103 34.237 34.237 26.111 8.126 17865
1089 1 2 . 1 1 78 78 CYS H H 103 7.362 7.362 8.358 -0.996 17865
1090 1 2 . 1 1 79 79 THR N N 104 114.773 114.773 116.068 -1.295 17865
1091 1 2 . 1 1 79 79 THR HA H 104 3.984 3.984 4.125 -0.141 17865
1092 1 2 . 1 1 79 79 THR C C 104 176.624 176.624 175.272 1.352 17865
1093 1 2 . 1 1 79 79 THR CA C 104 65.180 65.180 64.758 0.422 17865
1094 1 2 . 1 1 79 79 THR CB C 104 69.062 69.062 68.082 0.980 17865
1095 1 2 . 1 1 79 79 THR H H 104 7.864 7.864 7.921 -0.057 17865
1096 1 2 . 1 1 80 80 LEU N N 105 119.785 119.785 119.353 0.432 17865
1097 1 2 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.285 0.046 17865
1098 1 2 . 1 1 80 80 LEU C C 105 177.208 177.208 176.796 0.412 17865
1099 1 2 . 1 1 80 80 LEU CA C 105 55.453 55.453 54.948 0.505 17865
1100 1 2 . 1 1 80 80 LEU CB C 105 41.293 41.293 41.522 -0.229 17865
1101 1 2 . 1 1 80 80 LEU H H 105 7.238 7.238 7.364 -0.126 17865
1102 1 2 . 1 1 81 81 ALA N N 106 119.309 119.309 120.508 -1.199 17865
1103 1 2 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.436 0.091 17865
1104 1 2 . 1 1 81 81 ALA C C 106 178.769 178.769 177.815 0.954 17865
1105 1 2 . 1 1 81 81 ALA CA C 106 52.049 52.049 53.047 -0.998 17865
1106 1 2 . 1 1 81 81 ALA CB C 106 18.820 18.820 20.469 -1.649 17865
1107 1 2 . 1 1 81 81 ALA H H 106 7.432 7.432 7.832 -0.400 17865
1108 1 2 . 1 1 82 82 GLY N N 107 109.793 109.793 106.487 3.306 17865
1109 1 2 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.071 2.048 17865
1110 1 2 . 1 1 82 82 GLY H H 107 7.918 7.918 7.637 0.281 17865
1111 1 2 . 1 1 83 83 ILE HA H 108 4.266 4.266 4.067 0.199 17865
1112 1 2 . 1 1 83 83 ILE CA C 108 63.263 63.263 62.176 1.087 17865
1113 1 2 . 1 1 83 83 ILE CB C 108 38.261 38.261 38.249 0.012 17865
1114 1 2 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.288 0.467 17865
1115 1 2 . 1 1 84 84 ARG C C 109 181.344 181.344 177.002 4.342 17865
1116 1 2 . 1 1 84 84 ARG CA C 109 55.939 55.939 57.040 -1.101 17865
1117 1 2 . 1 1 84 84 ARG CB C 109 30.283 30.283 29.160 1.123 17865
1118 1 2 . 1 1 85 85 GLU N N 110 122.944 122.944 121.057 1.887 17865
1119 1 2 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.200 -0.583 17865
1120 1 2 . 1 1 85 85 GLU C C 110 177.797 177.797 177.621 0.176 17865
1121 1 2 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.294 1.434 17865
1122 1 2 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.429 -0.558 17865
1123 1 2 . 1 1 85 85 GLU H H 110 8.003 8.003 7.588 0.415 17865
1124 1 2 . 1 1 86 86 VAL N N 111 117.101 117.101 118.186 -1.085 17865
1125 1 2 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.713 -0.202 17865
1126 1 2 . 1 1 86 86 VAL C C 111 177.710 177.710 177.955 -0.245 17865
1127 1 2 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.430 -0.000 17865
1128 1 2 . 1 1 86 86 VAL CB C 111 31.213 31.213 30.848 0.365 17865
1129 1 2 . 1 1 86 86 VAL H H 111 8.106 8.106 7.466 0.640 17865
1130 1 2 . 1 1 87 87 ASP N N 112 122.242 122.242 117.690 4.552 17865
1131 1 2 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.414 -0.110 17865
1132 1 2 . 1 1 87 87 ASP C C 112 176.912 176.912 178.126 -1.214 17865
1133 1 2 . 1 1 87 87 ASP CA C 112 57.417 57.417 56.544 0.873 17865
1134 1 2 . 1 1 87 87 ASP CB C 112 40.476 40.476 40.569 -0.093 17865
1135 1 2 . 1 1 87 87 ASP H H 112 7.401 7.401 8.268 -0.867 17865
1136 1 2 . 1 1 88 88 CYS N N 113 120.819 120.819 120.954 -0.135 17865
1137 1 2 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.141 -0.832 17865
1138 1 2 . 1 1 88 88 CYS C C 113 175.270 175.270 176.995 -1.725 17865
1139 1 2 . 1 1 88 88 CYS CA C 113 59.759 59.759 62.417 -2.658 17865
1140 1 2 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.193 7.642 17865
1141 1 2 . 1 1 88 88 CYS H H 113 7.785 7.785 7.947 -0.162 17865
1142 1 2 . 1 1 89 89 ARG N N 114 118.654 118.654 119.610 -0.956 17865
1143 1 2 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.126 -0.485 17865
1144 1 2 . 1 1 89 89 ARG C C 114 179.018 179.018 178.217 0.801 17865
1145 1 2 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.133 1.060 17865
1146 1 2 . 1 1 89 89 ARG CB C 114 29.713 29.713 29.825 -0.112 17865
1147 1 2 . 1 1 89 89 ARG H H 114 8.142 8.142 8.026 0.116 17865
1148 1 2 . 1 1 90 90 LYS N N 115 120.964 120.964 117.169 3.795 17865
1149 1 2 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.243 -0.213 17865
1150 1 2 . 1 1 90 90 LYS C C 115 180.092 180.092 178.183 1.909 17865
1151 1 2 . 1 1 90 90 LYS CA C 115 59.568 59.568 58.683 0.885 17865
1152 1 2 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.275 -0.054 17865
1153 1 2 . 1 1 90 90 LYS H H 115 7.936 7.936 7.427 0.509 17865
1154 1 2 . 1 1 91 91 ASP N N 116 121.690 121.690 119.589 2.101 17865
1155 1 2 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.532 -0.019 17865
1156 1 2 . 1 1 91 91 ASP C C 116 179.419 179.419 177.667 1.752 17865
1157 1 2 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.653 0.584 17865
1158 1 2 . 1 1 91 91 ASP CB C 116 40.648 40.648 41.529 -0.881 17865
1159 1 2 . 1 1 91 91 ASP H H 116 8.558 8.558 7.978 0.580 17865
1160 1 2 . 1 1 92 92 ALA N N 117 122.784 122.784 122.563 0.221 17865
1161 1 2 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.023 0.000 17865
1162 1 2 . 1 1 92 92 ALA C C 117 178.789 178.789 179.441 -0.652 17865
1163 1 2 . 1 1 92 92 ALA CA C 117 55.051 55.051 54.992 0.059 17865
1164 1 2 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.467 0.708 17865
1165 1 2 . 1 1 92 92 ALA H H 117 8.703 8.703 8.251 0.452 17865
1166 1 2 . 1 1 93 93 GLN N N 118 115.510 115.510 115.967 -0.457 17865
1167 1 2 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.148 -0.204 17865
1168 1 2 . 1 1 93 93 GLN C C 118 178.745 178.745 176.970 1.775 17865
1169 1 2 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.463 1.019 17865
1170 1 2 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.412 -0.015 17865
1171 1 2 . 1 1 93 93 GLN H H 118 7.664 7.664 8.488 -0.824 17865
1172 1 2 . 1 1 94 94 THR N N 119 110.110 110.110 114.725 -4.615 17865
1173 1 2 . 1 1 94 94 THR HA H 119 4.237 4.237 4.188 0.049 17865
1174 1 2 . 1 1 94 94 THR C C 119 175.861 175.861 176.130 -0.269 17865
1175 1 2 . 1 1 94 94 THR CA C 119 64.604 64.604 65.689 -1.085 17865
1176 1 2 . 1 1 94 94 THR CB C 119 69.716 69.716 68.853 0.863 17865
1177 1 2 . 1 1 94 94 THR H H 119 7.726 7.726 7.831 -0.105 17865
1178 1 2 . 1 1 95 95 CYS N N 120 118.523 118.523 120.197 -1.674 17865
1179 1 2 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.262 0.471 17865
1180 1 2 . 1 1 95 95 CYS C C 120 175.165 175.165 174.747 0.418 17865
1181 1 2 . 1 1 95 95 CYS CA C 120 52.973 52.973 59.818 -6.845 17865
1182 1 2 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.362 12.369 17865
1183 1 2 . 1 1 95 95 CYS H H 120 7.756 7.756 7.828 -0.072 17865
1184 1 2 . 1 1 96 96 ASP N N 121 119.081 119.081 122.704 -3.623 17865
1185 1 2 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.379 0.299 17865
1186 1 2 . 1 1 96 96 ASP CA C 121 56.224 56.224 56.931 -0.707 17865
1187 1 2 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.838 0.893 17865
1188 1 2 . 1 1 96 96 ASP H H 121 7.354 7.354 8.513 -1.159 17865
1189 1 2 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.311 -0.736 17865
1190 1 2 . 1 1 97 97 LYS C C 122 175.510 175.510 177.401 -1.891 17865
1191 1 2 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.172 0.667 17865
1192 1 2 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.064 -3.314 17865
1193 1 2 . 1 1 98 98 LYS N N 123 119.980 119.980 118.622 1.358 17865
1194 1 2 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.313 -0.019 17865
1195 1 2 . 1 1 98 98 LYS C C 123 176.968 176.968 178.367 -1.399 17865
1196 1 2 . 1 1 98 98 LYS CA C 123 55.904 55.904 57.366 -1.462 17865
1197 1 2 . 1 1 98 98 LYS CB C 123 33.232 33.232 32.969 0.263 17865
1198 1 2 . 1 1 98 98 LYS H H 123 7.799 7.799 7.785 0.014 17865
1199 1 2 . 1 1 99 99 TYR N N 124 122.378 122.378 120.392 1.986 17865
1200 1 2 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.210 -0.315 17865
1201 1 2 . 1 1 99 99 TYR C C 124 177.126 177.126 177.034 0.092 17865
1202 1 2 . 1 1 99 99 TYR CA C 124 60.211 60.211 60.551 -0.340 17865
1203 1 2 . 1 1 99 99 TYR CB C 124 38.271 38.271 37.538 0.733 17865
1204 1 2 . 1 1 99 99 TYR H H 124 8.536 8.536 7.569 0.967 17865
1205 1 2 . 1 1 100 100 GLU N N 125 118.610 118.610 117.010 1.600 17865
1206 1 2 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.531 -0.263 17865
1207 1 2 . 1 1 100 100 GLU C C 125 177.387 177.387 177.249 0.138 17865
1208 1 2 . 1 1 100 100 GLU CA C 125 55.759 55.759 55.823 -0.064 17865
1209 1 2 . 1 1 100 100 GLU CB C 125 27.321 27.321 29.062 -1.741 17865
1210 1 2 . 1 1 100 100 GLU H H 125 8.385 8.385 8.312 0.073 17865
1211 1 2 . 1 1 101 101 SER N N 126 115.949 115.949 116.443 -0.494 17865
1212 1 2 . 1 1 101 101 SER HA H 126 3.959 3.959 4.121 -0.162 17865
1213 1 2 . 1 1 101 101 SER C C 126 176.047 176.047 175.424 0.623 17865
1214 1 2 . 1 1 101 101 SER CA C 126 62.439 62.439 62.262 0.177 17865
1215 1 2 . 1 1 101 101 SER CB C 126 63.299 63.299 63.161 0.138 17865
1216 1 2 . 1 1 101 101 SER H H 126 7.823 7.823 7.976 -0.153 17865
1217 1 2 . 1 1 102 102 ASP N N 127 120.920 120.920 119.889 1.031 17865
1218 1 2 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.390 0.017 17865
1219 1 2 . 1 1 102 102 ASP C C 127 178.234 178.234 177.824 0.410 17865
1220 1 2 . 1 1 102 102 ASP CA C 127 57.411 57.411 56.868 0.543 17865
1221 1 2 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.054 -0.338 17865
1222 1 2 . 1 1 102 102 ASP H H 127 8.683 8.683 7.938 0.745 17865
1223 1 2 . 1 1 103 103 LYS N N 128 121.753 121.753 119.788 1.965 17865
1224 1 2 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.059 -0.055 17865
1225 1 2 . 1 1 103 103 LYS C C 128 179.395 179.395 178.744 0.651 17865
1226 1 2 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.859 0.612 17865
1227 1 2 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.778 0.623 17865
1228 1 2 . 1 1 103 103 LYS H H 128 7.771 7.771 8.368 -0.597 17865
1229 1 2 . 1 1 104 104 CYS N N 129 120.109 120.109 119.908 0.201 17865
1230 1 2 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.361 -0.167 17865
1231 1 2 . 1 1 104 104 CYS C C 129 176.779 176.779 177.015 -0.236 17865
1232 1 2 . 1 1 104 104 CYS CA C 129 59.790 59.790 61.013 -1.223 17865
1233 1 2 . 1 1 104 104 CYS CB C 129 36.879 36.879 26.272 10.607 17865
1234 1 2 . 1 1 104 104 CYS H H 129 7.973 7.973 7.812 0.161 17865
1235 1 2 . 1 1 105 105 LEU N N 130 121.804 121.804 123.248 -1.444 17865
1236 1 2 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.972 0.118 17865
1237 1 2 . 1 1 105 105 LEU C C 130 179.373 179.373 178.524 0.849 17865
1238 1 2 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.368 -1.000 17865
1239 1 2 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.597 0.501 17865
1240 1 2 . 1 1 105 105 LEU H H 130 8.666 8.666 8.390 0.276 17865
1241 1 2 . 1 1 106 106 ASN N N 131 118.535 118.535 116.435 2.100 17865
1242 1 2 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.433 -0.195 17865
1243 1 2 . 1 1 106 106 ASN C C 131 177.830 177.830 177.276 0.554 17865
1244 1 2 . 1 1 106 106 ASN CA C 131 56.256 56.256 56.013 0.243 17865
1245 1 2 . 1 1 106 106 ASN CB C 131 37.817 37.817 37.800 0.017 17865
1246 1 2 . 1 1 106 106 ASN H H 131 8.438 8.438 8.559 -0.121 17865
1247 1 2 . 1 1 107 107 ALA N N 132 121.485 121.485 123.052 -1.567 17865
1248 1 2 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.153 0.066 17865
1249 1 2 . 1 1 107 107 ALA C C 132 180.726 180.726 179.266 1.460 17865
1250 1 2 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.239 0.724 17865
1251 1 2 . 1 1 107 107 ALA CB C 132 17.821 17.821 19.017 -1.196 17865
1252 1 2 . 1 1 107 107 ALA H H 132 7.541 7.541 7.089 0.452 17865
1253 1 2 . 1 1 108 108 ILE N N 133 120.979 120.979 118.194 2.785 17865
1254 1 2 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.554 0.377 17865
1255 1 2 . 1 1 108 108 ILE C C 133 178.114 178.114 177.786 0.328 17865
1256 1 2 . 1 1 108 108 ILE CA C 133 63.353 63.353 64.148 -0.795 17865
1257 1 2 . 1 1 108 108 ILE CB C 133 36.454 36.454 37.034 -0.580 17865
1258 1 2 . 1 1 108 108 ILE H H 133 7.551 7.551 8.121 -0.570 17865
1259 1 2 . 1 1 109 109 LYS N N 134 121.415 121.415 117.859 3.556 17865
1260 1 2 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.154 -0.566 17865
1261 1 2 . 1 1 109 109 LYS C C 134 179.561 179.561 178.971 0.590 17865
1262 1 2 . 1 1 109 109 LYS CA C 134 60.108 60.108 58.962 1.146 17865
1263 1 2 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.073 0.088 17865
1264 1 2 . 1 1 109 109 LYS H H 134 8.414 8.414 7.893 0.521 17865
1265 1 2 . 1 1 110 110 GLU N N 135 116.099 116.099 119.294 -3.195 17865
1266 1 2 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.129 -0.200 17865
1267 1 2 . 1 1 110 110 GLU C C 135 178.239 178.239 178.215 0.024 17865
1268 1 2 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.650 -0.004 17865
1269 1 2 . 1 1 110 110 GLU CB C 135 29.638 29.638 28.732 0.906 17865
1270 1 2 . 1 1 110 110 GLU H H 135 7.473 7.473 7.776 -0.303 17865
1271 1 2 . 1 1 111 111 LYS N N 136 119.805 119.805 118.950 0.855 17865
1272 1 2 . 1 1 111 111 LYS HA H 136 3.906 3.906 3.971 -0.065 17865
1273 1 2 . 1 1 111 111 LYS C C 136 177.600 177.600 177.784 -0.184 17865
1274 1 2 . 1 1 111 111 LYS CA C 136 58.749 58.749 58.189 0.560 17865
1275 1 2 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.362 0.876 17865
1276 1 2 . 1 1 111 111 LYS H H 136 7.540 7.540 7.387 0.153 17865
1277 1 2 . 1 1 112 112 TYR N N 137 114.768 114.768 117.566 -2.798 17865
1278 1 2 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.631 -0.108 17865
1279 1 2 . 1 1 112 112 TYR C C 137 174.690 174.690 175.047 -0.357 17865
1280 1 2 . 1 1 112 112 TYR CA C 137 58.359 58.359 55.443 2.916 17865
1281 1 2 . 1 1 112 112 TYR CB C 137 38.328 38.328 37.730 0.598 17865
1282 1 2 . 1 1 112 112 TYR H H 137 7.488 7.488 7.419 0.069 17865
1283 1 2 . 1 1 113 113 LYS N N 138 123.694 123.694 122.298 1.396 17865
1284 1 2 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.646 -0.145 17865
1285 1 2 . 1 1 113 113 LYS CA C 138 55.282 55.282 53.395 1.887 17865
1286 1 2 . 1 1 113 113 LYS CB C 138 32.124 32.124 31.852 0.272 17865
1287 1 2 . 1 1 113 113 LYS H H 138 7.217 7.217 7.886 -0.669 17865
1288 1 2 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.605 -0.153 17865
1289 1 2 . 1 1 114 114 PRO C C 139 176.974 176.974 176.028 0.946 17865
1290 1 2 . 1 1 114 114 PRO CA C 139 63.189 63.189 63.038 0.151 17865
1291 1 2 . 1 1 114 114 PRO CB C 139 32.251 32.251 30.312 1.938 17865
1292 1 2 . 1 1 115 115 VAL N N 140 121.098 121.098 118.424 2.674 17865
1293 1 2 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.253 -0.151 17865
1294 1 2 . 1 1 115 115 VAL C C 140 176.207 176.207 175.548 0.659 17865
1295 1 2 . 1 1 115 115 VAL CA C 140 62.356 62.356 62.035 0.321 17865
1296 1 2 . 1 1 115 115 VAL CB C 140 33.256 33.256 32.960 0.296 17865
1297 1 2 . 1 1 115 115 VAL H H 140 8.272 8.272 7.911 0.361 17865
1298 1 2 . 1 1 116 116 VAL N N 141 124.167 124.167 121.721 2.446 17865
1299 1 2 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.221 -0.099 17865
1300 1 2 . 1 1 116 116 VAL C C 141 175.415 175.415 175.929 -0.514 17865
1301 1 2 . 1 1 116 116 VAL CA C 141 61.731 61.731 61.332 0.399 17865
1302 1 2 . 1 1 116 116 VAL CB C 141 33.145 33.145 32.738 0.407 17865
1303 1 2 . 1 1 116 116 VAL H H 141 8.142 8.142 7.635 0.507 17865
1304 1 2 . 1 1 117 117 ASP N N 142 126.737 126.737 126.409 0.328 17865
1305 1 2 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.734 0.078 17865
1306 1 2 . 1 1 117 117 ASP CA C 142 52.217 52.217 53.628 -1.411 17865
1307 1 2 . 1 1 117 117 ASP CB C 142 41.368 41.368 40.788 0.580 17865
1308 1 2 . 1 1 117 117 ASP H H 142 8.419 8.419 8.490 -0.071 17865
1309 1 2 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.450 -0.039 17865
1310 1 2 . 1 1 118 118 PRO C C 143 176.662 176.662 175.724 0.938 17865
1311 1 2 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.874 -0.627 17865
1312 1 2 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.305 0.005 17865
1313 1 2 . 1 1 119 119 ASN N N 144 119.287 119.287 116.118 3.169 17865
1314 1 2 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.909 0.038 17865
1315 1 2 . 1 1 119 119 ASN CA C 144 51.633 51.633 50.937 0.696 17865
1316 1 2 . 1 1 119 119 ASN CB C 144 38.859 38.859 39.312 -0.453 17865
1317 1 2 . 1 1 119 119 ASN H H 144 8.432 8.432 8.114 0.318 17865
1318 1 2 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.641 0.039 17865
1319 1 2 . 1 1 120 120 PRO CA C 145 61.640 61.640 61.916 -0.276 17865
1320 1 2 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.379 -0.461 17865
1321 1 2 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.332 0.045 17865
1322 1 2 . 1 1 121 121 PRO C C 146 175.876 175.876 176.686 -0.810 17865
1323 1 2 . 1 1 121 121 PRO CA C 146 63.174 63.174 63.354 -0.180 17865
1324 1 2 . 1 1 121 121 PRO CB C 146 31.939 31.939 31.395 0.544 17865
1325 1 3 . 1 1 2 2 ASP N N 27 121.041 121.041 117.777 3.264 17865
1326 1 3 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.433 0.205 17865
1327 1 3 . 1 1 2 2 ASP C C 27 175.878 175.878 175.447 0.431 17865
1328 1 3 . 1 1 2 2 ASP CA C 27 54.382 54.382 55.613 -1.231 17865
1329 1 3 . 1 1 2 2 ASP CB C 27 41.729 41.729 40.654 1.075 17865
1330 1 3 . 1 1 2 2 ASP H H 27 8.639 8.639 8.488 0.151 17865
1331 1 3 . 1 1 3 3 VAL N N 28 119.901 119.901 119.489 0.412 17865
1332 1 3 . 1 1 3 3 VAL HA H 28 4.033 4.033 3.969 0.064 17865
1333 1 3 . 1 1 3 3 VAL C C 28 175.521 175.521 174.924 0.597 17865
1334 1 3 . 1 1 3 3 VAL CA C 28 62.216 62.216 63.047 -0.831 17865
1335 1 3 . 1 1 3 3 VAL CB C 28 33.003 33.003 30.730 2.273 17865
1336 1 3 . 1 1 3 3 VAL H H 28 8.113 8.113 7.533 0.580 17865
1337 1 3 . 1 1 4 4 PHE N N 29 123.707 123.707 126.649 -2.942 17865
1338 1 3 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.753 -0.097 17865
1339 1 3 . 1 1 4 4 PHE C C 29 174.874 174.874 175.276 -0.402 17865
1340 1 3 . 1 1 4 4 PHE CA C 29 57.159 57.159 57.293 -0.134 17865
1341 1 3 . 1 1 4 4 PHE CB C 29 39.795 39.795 41.426 -1.631 17865
1342 1 3 . 1 1 4 4 PHE H H 29 8.255 8.255 8.275 -0.020 17865
1343 1 3 . 1 1 5 5 ASP N N 30 124.203 124.203 125.265 -1.062 17865
1344 1 3 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.885 -0.047 17865
1345 1 3 . 1 1 5 5 ASP CA C 30 52.385 52.385 51.920 0.464 17865
1346 1 3 . 1 1 5 5 ASP CB C 30 40.801 40.801 41.613 -0.812 17865
1347 1 3 . 1 1 5 5 ASP H H 30 8.226 8.226 8.498 -0.272 17865
1348 1 3 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.452 0.085 17865
1349 1 3 . 1 1 6 6 PRO CA C 31 61.664 61.664 61.901 -0.237 17865
1350 1 3 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.291 -0.465 17865
1351 1 3 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.417 0.009 17865
1352 1 3 . 1 1 7 7 PRO C C 32 177.226 177.226 177.211 0.015 17865
1353 1 3 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.125 0.044 17865
1354 1 3 . 1 1 7 7 PRO CB C 32 31.948 31.948 31.283 0.665 17865
1355 1 3 . 1 1 8 8 THR N N 33 114.158 114.158 115.500 -1.342 17865
1356 1 3 . 1 1 8 8 THR HA H 33 4.195 4.195 4.195 -0.000 17865
1357 1 3 . 1 1 8 8 THR C C 33 174.468 174.468 173.309 1.159 17865
1358 1 3 . 1 1 8 8 THR CA C 33 62.110 62.110 60.573 1.537 17865
1359 1 3 . 1 1 8 8 THR CB C 33 69.975 69.975 69.226 0.749 17865
1360 1 3 . 1 1 8 8 THR H H 33 8.096 8.096 8.519 -0.423 17865
1361 1 3 . 1 1 9 9 GLN N N 34 122.411 122.411 121.697 0.714 17865
1362 1 3 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.010 0.253 17865
1363 1 3 . 1 1 9 9 GLN C C 34 175.445 175.445 174.627 0.818 17865
1364 1 3 . 1 1 9 9 GLN CA C 34 55.763 55.763 54.907 0.856 17865
1365 1 3 . 1 1 9 9 GLN CB C 34 29.691 29.691 27.177 2.514 17865
1366 1 3 . 1 1 9 9 GLN H H 34 8.278 8.278 7.702 0.577 17865
1367 1 3 . 1 1 10 10 TYR N N 35 121.048 121.048 120.749 0.299 17865
1368 1 3 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.353 0.167 17865
1369 1 3 . 1 1 10 10 TYR C C 35 176.314 176.314 176.163 0.151 17865
1370 1 3 . 1 1 10 10 TYR CA C 35 57.972 57.972 56.604 1.368 17865
1371 1 3 . 1 1 10 10 TYR CB C 35 38.936 38.936 39.234 -0.298 17865
1372 1 3 . 1 1 10 10 TYR H H 35 8.227 8.227 7.197 1.030 17865
1373 1 3 . 1 1 11 11 GLY N N 36 109.711 109.711 108.634 1.077 17865
1374 1 3 . 1 1 11 11 GLY C C 36 174.128 174.128 174.365 -0.237 17865
1375 1 3 . 1 1 11 11 GLY CA C 36 45.212 45.212 46.386 -1.175 17865
1376 1 3 . 1 1 11 11 GLY H H 36 8.247 8.247 8.784 -0.537 17865
1377 1 3 . 1 1 12 12 TYR N N 37 120.302 120.302 117.783 2.519 17865
1378 1 3 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.874 -0.392 17865
1379 1 3 . 1 1 12 12 TYR C C 37 175.864 175.864 174.991 0.873 17865
1380 1 3 . 1 1 12 12 TYR CA C 37 58.541 58.541 57.177 1.364 17865
1381 1 3 . 1 1 12 12 TYR CB C 37 38.715 38.715 40.170 -1.455 17865
1382 1 3 . 1 1 12 12 TYR H H 37 8.101 8.101 7.330 0.771 17865
1383 1 3 . 1 1 13 13 ASP N N 38 121.883 121.883 120.855 1.028 17865
1384 1 3 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.606 -0.120 17865
1385 1 3 . 1 1 13 13 ASP C C 38 176.538 176.538 175.537 1.001 17865
1386 1 3 . 1 1 13 13 ASP CA C 38 54.223 54.223 53.972 0.251 17865
1387 1 3 . 1 1 13 13 ASP CB C 38 40.988 40.988 43.033 -2.045 17865
1388 1 3 . 1 1 13 13 ASP H H 38 8.266 8.266 6.641 1.625 17865
1389 1 3 . 1 1 14 14 GLY N N 39 107.705 107.705 112.133 -4.428 17865
1390 1 3 . 1 1 14 14 GLY C C 39 173.822 173.822 173.371 0.451 17865
1391 1 3 . 1 1 14 14 GLY CA C 39 45.404 45.404 45.677 -0.273 17865
1392 1 3 . 1 1 14 14 GLY H H 39 7.647 7.647 7.868 -0.221 17865
1393 1 3 . 1 1 15 15 LYS N N 40 121.621 121.621 121.646 -0.025 17865
1394 1 3 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.770 -0.195 17865
1395 1 3 . 1 1 15 15 LYS CA C 40 54.100 54.100 53.209 0.891 17865
1396 1 3 . 1 1 15 15 LYS CB C 40 32.510 32.510 34.440 -1.930 17865
1397 1 3 . 1 1 15 15 LYS H H 40 7.908 7.908 7.412 0.496 17865
1398 1 3 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.551 -0.199 17865
1399 1 3 . 1 1 16 16 PRO C C 41 176.806 176.806 176.149 0.657 17865
1400 1 3 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.582 0.176 17865
1401 1 3 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.411 -0.097 17865
1402 1 3 . 1 1 17 17 LEU N N 42 123.488 123.488 120.421 3.067 17865
1403 1 3 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.322 -0.273 17865
1404 1 3 . 1 1 17 17 LEU C C 42 174.973 174.973 176.654 -1.681 17865
1405 1 3 . 1 1 17 17 LEU CA C 42 55.436 55.436 55.953 -0.517 17865
1406 1 3 . 1 1 17 17 LEU CB C 42 42.093 42.093 42.230 -0.138 17865
1407 1 3 . 1 1 17 17 LEU H H 42 8.499 8.499 8.604 -0.105 17865
1408 1 3 . 1 1 18 18 ASP N N 43 123.354 123.354 124.982 -1.628 17865
1409 1 3 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.739 -0.241 17865
1410 1 3 . 1 1 18 18 ASP C C 43 175.947 175.947 177.559 -1.612 17865
1411 1 3 . 1 1 18 18 ASP CA C 43 52.858 52.858 52.358 0.501 17865
1412 1 3 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.145 -1.925 17865
1413 1 3 . 1 1 18 18 ASP H H 43 7.789 7.789 8.262 -0.473 17865
1414 1 3 . 1 1 19 19 ALA N N 44 120.147 120.147 126.787 -6.640 17865
1415 1 3 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.167 -0.181 17865
1416 1 3 . 1 1 19 19 ALA C C 44 179.476 179.476 179.035 0.441 17865
1417 1 3 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.334 0.829 17865
1418 1 3 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.823 -0.436 17865
1419 1 3 . 1 1 19 19 ALA H H 44 8.561 8.561 8.756 -0.195 17865
1420 1 3 . 1 1 20 20 SER N N 45 115.037 115.037 116.126 -1.089 17865
1421 1 3 . 1 1 20 20 SER HA H 45 4.151 4.151 4.187 -0.036 17865
1422 1 3 . 1 1 20 20 SER C C 45 177.191 177.191 176.492 0.699 17865
1423 1 3 . 1 1 20 20 SER CA C 45 61.629 61.629 61.709 -0.080 17865
1424 1 3 . 1 1 20 20 SER CB C 45 62.804 62.804 63.096 -0.292 17865
1425 1 3 . 1 1 20 20 SER H H 45 8.466 8.466 8.744 -0.278 17865
1426 1 3 . 1 1 21 21 PHE N N 46 125.030 125.030 123.435 1.595 17865
1427 1 3 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.383 -0.152 17865
1428 1 3 . 1 1 21 21 PHE C C 46 176.850 176.850 176.358 0.492 17865
1429 1 3 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.678 0.128 17865
1430 1 3 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.458 0.423 17865
1431 1 3 . 1 1 21 21 PHE H H 46 8.034 8.034 7.847 0.187 17865
1432 1 3 . 1 1 22 22 CYS N N 47 113.943 113.943 117.390 -3.447 17865
1433 1 3 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.228 0.023 17865
1434 1 3 . 1 1 22 22 CYS C C 47 176.449 176.449 175.640 0.809 17865
1435 1 3 . 1 1 22 22 CYS CA C 47 53.600 53.600 59.460 -5.860 17865
1436 1 3 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.563 10.828 17865
1437 1 3 . 1 1 22 22 CYS H H 47 7.691 7.691 8.057 -0.366 17865
1438 1 3 . 1 1 23 23 ARG N N 48 119.958 119.958 118.996 0.962 17865
1439 1 3 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.138 -0.058 17865
1440 1 3 . 1 1 23 23 ARG C C 48 177.904 177.904 177.441 0.463 17865
1441 1 3 . 1 1 23 23 ARG CA C 48 58.907 58.907 58.306 0.601 17865
1442 1 3 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.311 0.860 17865
1443 1 3 . 1 1 23 23 ARG H H 48 7.628 7.628 7.354 0.274 17865
1444 1 3 . 1 1 24 24 THR N N 49 106.445 106.445 113.163 -6.718 17865
1445 1 3 . 1 1 24 24 THR HA H 49 4.385 4.385 4.219 0.166 17865
1446 1 3 . 1 1 24 24 THR C C 49 174.758 174.758 174.565 0.193 17865
1447 1 3 . 1 1 24 24 THR CA C 49 61.573 61.573 63.026 -1.453 17865
1448 1 3 . 1 1 24 24 THR CB C 49 68.794 68.794 69.137 -0.343 17865
1449 1 3 . 1 1 24 24 THR H H 49 7.307 7.307 7.381 -0.074 17865
1450 1 3 . 1 1 25 25 ALA N N 50 122.242 122.242 122.375 -0.133 17865
1451 1 3 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.296 0.108 17865
1452 1 3 . 1 1 25 25 ALA C C 50 178.554 178.554 178.896 -0.342 17865
1453 1 3 . 1 1 25 25 ALA CA C 50 52.381 52.381 52.840 -0.459 17865
1454 1 3 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.944 -1.549 17865
1455 1 3 . 1 1 25 25 ALA H H 50 7.401 7.401 7.273 0.128 17865
1456 1 3 . 1 1 26 26 GLY N N 51 110.604 110.604 106.625 3.979 17865
1457 1 3 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.453 0.569 17865
1458 1 3 . 1 1 26 26 GLY H H 51 8.285 8.285 8.111 0.174 17865
1459 1 3 . 1 1 27 27 SER HA H 52 4.382 4.382 4.256 0.126 17865
1460 1 3 . 1 1 27 27 SER C C 52 175.774 175.774 175.338 0.436 17865
1461 1 3 . 1 1 27 27 SER CA C 52 60.803 60.803 60.773 0.030 17865
1462 1 3 . 1 1 27 27 SER CB C 52 62.827 62.827 63.195 -0.368 17865
1463 1 3 . 1 1 28 28 ARG N N 53 119.682 119.682 118.942 0.740 17865
1464 1 3 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.652 0.228 17865
1465 1 3 . 1 1 28 28 ARG C C 53 175.796 175.796 176.139 -0.343 17865
1466 1 3 . 1 1 28 28 ARG CA C 53 55.738 55.738 54.776 0.962 17865
1467 1 3 . 1 1 28 28 ARG CB C 53 30.237 30.237 28.860 1.377 17865
1468 1 3 . 1 1 28 28 ARG H H 53 7.894 7.894 8.433 -0.539 17865
1469 1 3 . 1 1 29 29 GLU N N 54 122.318 122.318 122.021 0.297 17865
1470 1 3 . 1 1 29 29 GLU HA H 54 3.595 3.595 4.095 -0.500 17865
1471 1 3 . 1 1 29 29 GLU C C 54 177.523 177.523 177.660 -0.137 17865
1472 1 3 . 1 1 29 29 GLU CA C 54 61.223 61.223 60.360 0.863 17865
1473 1 3 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.550 -0.614 17865
1474 1 3 . 1 1 29 29 GLU H H 54 7.730 7.730 7.657 0.073 17865
1475 1 3 . 1 1 30 30 LYS N N 55 118.377 118.377 117.281 1.096 17865
1476 1 3 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.102 -0.274 17865
1477 1 3 . 1 1 30 30 LYS C C 55 179.205 179.205 178.776 0.429 17865
1478 1 3 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.202 1.225 17865
1479 1 3 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.218 -0.617 17865
1480 1 3 . 1 1 30 30 LYS H H 55 8.659 8.659 8.457 0.202 17865
1481 1 3 . 1 1 31 31 ASP N N 56 121.614 121.614 119.186 2.428 17865
1482 1 3 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.513 -0.202 17865
1483 1 3 . 1 1 31 31 ASP C C 56 177.393 177.393 177.504 -0.111 17865
1484 1 3 . 1 1 31 31 ASP CA C 56 57.316 57.316 56.775 0.541 17865
1485 1 3 . 1 1 31 31 ASP CB C 56 40.423 40.423 40.693 -0.270 17865
1486 1 3 . 1 1 31 31 ASP H H 56 7.646 7.646 8.211 -0.565 17865
1487 1 3 . 1 1 32 32 CYS N N 57 120.345 120.345 119.529 0.816 17865
1488 1 3 . 1 1 32 32 CYS HA H 57 3.601 3.601 4.337 -0.736 17865
1489 1 3 . 1 1 32 32 CYS C C 57 175.772 175.772 176.671 -0.899 17865
1490 1 3 . 1 1 32 32 CYS CA C 57 60.197 60.197 60.651 -0.454 17865
1491 1 3 . 1 1 32 32 CYS CB C 57 33.966 33.966 26.229 7.737 17865
1492 1 3 . 1 1 32 32 CYS H H 57 8.042 8.042 8.041 0.001 17865
1493 1 3 . 1 1 33 33 ARG N N 58 120.293 120.293 120.267 0.026 17865
1494 1 3 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.883 -0.207 17865
1495 1 3 . 1 1 33 33 ARG C C 58 179.633 179.633 178.115 1.518 17865
1496 1 3 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.536 0.850 17865
1497 1 3 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.376 0.465 17865
1498 1 3 . 1 1 33 33 ARG H H 58 8.531 8.531 7.789 0.742 17865
1499 1 3 . 1 1 34 34 LYS N N 59 121.166 121.166 119.921 1.245 17865
1500 1 3 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.134 -0.098 17865
1501 1 3 . 1 1 34 34 LYS C C 59 179.220 179.220 178.293 0.927 17865
1502 1 3 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.833 0.697 17865
1503 1 3 . 1 1 34 34 LYS CB C 59 32.110 32.110 31.786 0.324 17865
1504 1 3 . 1 1 34 34 LYS H H 59 7.633 7.633 7.671 -0.038 17865
1505 1 3 . 1 1 35 35 ASP N N 60 122.166 122.166 119.846 2.320 17865
1506 1 3 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.433 -0.002 17865
1507 1 3 . 1 1 35 35 ASP C C 60 179.709 179.709 178.493 1.216 17865
1508 1 3 . 1 1 35 35 ASP CA C 60 57.703 57.703 56.897 0.806 17865
1509 1 3 . 1 1 35 35 ASP CB C 60 40.672 40.672 40.618 0.054 17865
1510 1 3 . 1 1 35 35 ASP H H 60 8.221 8.221 7.887 0.334 17865
1511 1 3 . 1 1 36 36 VAL N N 61 121.312 121.312 117.739 3.573 17865
1512 1 3 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.777 -0.376 17865
1513 1 3 . 1 1 36 36 VAL C C 61 178.339 178.339 178.258 0.081 17865
1514 1 3 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.739 1.394 17865
1515 1 3 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.732 -0.075 17865
1516 1 3 . 1 1 36 36 VAL H H 61 8.916 8.916 8.162 0.754 17865
1517 1 3 . 1 1 37 37 GLN N N 62 119.166 119.166 118.336 0.830 17865
1518 1 3 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.105 -0.163 17865
1519 1 3 . 1 1 37 37 GLN C C 62 177.293 177.293 177.113 0.180 17865
1520 1 3 . 1 1 37 37 GLN CA C 62 58.280 58.280 58.148 0.132 17865
1521 1 3 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.869 -0.498 17865
1522 1 3 . 1 1 37 37 GLN H H 62 7.697 7.697 7.519 0.178 17865
1523 1 3 . 1 1 38 38 ALA N N 63 118.964 118.964 119.256 -0.292 17865
1524 1 3 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.373 -0.131 17865
1525 1 3 . 1 1 38 38 ALA C C 63 177.221 177.221 176.799 0.422 17865
1526 1 3 . 1 1 38 38 ALA CA C 63 53.137 53.137 52.288 0.849 17865
1527 1 3 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.285 -0.388 17865
1528 1 3 . 1 1 38 38 ALA H H 63 7.508 7.508 7.575 -0.067 17865
1529 1 3 . 1 1 39 39 CYS N N 64 119.081 119.081 118.480 0.601 17865
1530 1 3 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.644 0.309 17865
1531 1 3 . 1 1 39 39 CYS C C 64 172.052 172.052 173.926 -1.874 17865
1532 1 3 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.903 -7.023 17865
1533 1 3 . 1 1 39 39 CYS CB C 64 34.328 34.328 27.612 6.716 17865
1534 1 3 . 1 1 39 39 CYS H H 64 7.354 7.354 7.478 -0.124 17865
1535 1 3 . 1 1 40 40 ASP N N 65 124.167 124.167 125.399 -1.232 17865
1536 1 3 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.492 -0.167 17865
1537 1 3 . 1 1 40 40 ASP C C 65 176.496 176.496 176.736 -0.240 17865
1538 1 3 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.258 0.466 17865
1539 1 3 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.177 0.136 17865
1540 1 3 . 1 1 40 40 ASP H H 65 8.142 8.142 8.586 -0.444 17865
1541 1 3 . 1 1 41 41 LYS N N 66 118.844 118.844 119.537 -0.693 17865
1542 1 3 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.376 0.148 17865
1543 1 3 . 1 1 41 41 LYS C C 66 175.586 175.586 176.733 -1.147 17865
1544 1 3 . 1 1 41 41 LYS CA C 66 55.275 55.275 55.361 -0.086 17865
1545 1 3 . 1 1 41 41 LYS CB C 66 32.598 32.598 31.131 1.467 17865
1546 1 3 . 1 1 41 41 LYS H H 66 7.858 7.858 8.214 -0.356 17865
1547 1 3 . 1 1 42 42 LYS N N 67 126.081 126.081 122.661 3.420 17865
1548 1 3 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.310 -0.395 17865
1549 1 3 . 1 1 42 42 LYS C C 67 174.665 174.665 174.938 -0.273 17865
1550 1 3 . 1 1 42 42 LYS CA C 67 57.827 57.827 56.977 0.850 17865
1551 1 3 . 1 1 42 42 LYS CB C 67 34.059 34.059 32.841 1.218 17865
1552 1 3 . 1 1 42 42 LYS H H 67 8.790 8.790 8.065 0.725 17865
1553 1 3 . 1 1 43 43 TYR N N 68 114.138 114.138 115.742 -1.604 17865
1554 1 3 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.760 0.499 17865
1555 1 3 . 1 1 43 43 TYR C C 68 175.767 175.767 174.430 1.337 17865
1556 1 3 . 1 1 43 43 TYR CA C 68 55.880 55.880 56.670 -0.791 17865
1557 1 3 . 1 1 43 43 TYR CB C 68 42.363 42.363 42.322 0.041 17865
1558 1 3 . 1 1 43 43 TYR H H 68 7.294 7.294 7.321 -0.027 17865
1559 1 3 . 1 1 44 44 ASP N N 69 121.807 121.807 120.622 1.185 17865
1560 1 3 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.629 0.011 17865
1561 1 3 . 1 1 44 44 ASP C C 69 177.812 177.812 177.417 0.395 17865
1562 1 3 . 1 1 44 44 ASP CA C 69 52.110 52.110 54.248 -2.138 17865
1563 1 3 . 1 1 44 44 ASP CB C 69 41.440 41.440 42.645 -1.206 17865
1564 1 3 . 1 1 44 44 ASP H H 69 8.995 8.995 8.990 0.005 17865
1565 1 3 . 1 1 45 45 ASP N N 70 116.686 116.686 123.552 -6.866 17865
1566 1 3 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.430 -0.006 17865
1567 1 3 . 1 1 45 45 ASP C C 70 177.054 177.054 176.916 0.138 17865
1568 1 3 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.496 -0.115 17865
1569 1 3 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.434 -0.187 17865
1570 1 3 . 1 1 45 45 ASP H H 70 8.369 8.369 8.850 -0.481 17865
1571 1 3 . 1 1 46 46 GLN N N 71 117.949 117.949 116.265 1.684 17865
1572 1 3 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.445 0.011 17865
1573 1 3 . 1 1 46 46 GLN C C 71 176.273 176.273 176.763 -0.490 17865
1574 1 3 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.663 -0.297 17865
1575 1 3 . 1 1 46 46 GLN CB C 71 29.330 29.330 30.102 -0.772 17865
1576 1 3 . 1 1 46 46 GLN H H 71 8.274 8.274 8.344 -0.070 17865
1577 1 3 . 1 1 47 47 GLY N N 72 108.369 108.369 106.584 1.785 17865
1578 1 3 . 1 1 47 47 GLY C C 72 174.145 174.145 174.368 -0.223 17865
1579 1 3 . 1 1 47 47 GLY CA C 72 45.823 45.823 44.855 0.968 17865
1580 1 3 . 1 1 47 47 GLY H H 72 8.174 8.174 8.244 -0.070 17865
1581 1 3 . 1 1 48 48 ARG N N 73 121.554 121.554 120.039 1.515 17865
1582 1 3 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.625 -0.140 17865
1583 1 3 . 1 1 48 48 ARG C C 73 176.855 176.855 175.574 1.281 17865
1584 1 3 . 1 1 48 48 ARG CA C 73 55.289 55.289 53.426 1.863 17865
1585 1 3 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.454 -0.896 17865
1586 1 3 . 1 1 48 48 ARG H H 73 8.462 8.462 8.002 0.460 17865
1587 1 3 . 1 1 49 49 GLU N N 74 122.784 122.784 121.277 1.507 17865
1588 1 3 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.253 0.230 17865
1589 1 3 . 1 1 49 49 GLU C C 74 178.098 178.098 176.666 1.432 17865
1590 1 3 . 1 1 49 49 GLU CA C 74 57.184 57.184 57.252 -0.068 17865
1591 1 3 . 1 1 49 49 GLU CB C 74 30.777 30.777 30.430 0.347 17865
1592 1 3 . 1 1 49 49 GLU H H 74 8.703 8.703 8.720 -0.017 17865
1593 1 3 . 1 1 50 50 THR N N 75 114.563 114.563 114.760 -0.197 17865
1594 1 3 . 1 1 50 50 THR HA H 75 4.212 4.212 4.563 -0.351 17865
1595 1 3 . 1 1 50 50 THR C C 75 175.170 175.170 175.575 -0.405 17865
1596 1 3 . 1 1 50 50 THR CA C 75 60.589 60.589 60.264 0.325 17865
1597 1 3 . 1 1 50 50 THR CB C 75 70.952 70.952 70.474 0.478 17865
1598 1 3 . 1 1 50 50 THR H H 75 7.717 7.717 8.302 -0.585 17865
1599 1 3 . 1 1 51 51 ALA N N 76 122.097 122.097 122.492 -0.395 17865
1600 1 3 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.135 -0.097 17865
1601 1 3 . 1 1 51 51 ALA C C 76 181.906 181.906 179.433 2.473 17865
1602 1 3 . 1 1 51 51 ALA CA C 76 55.654 55.654 54.651 1.003 17865
1603 1 3 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.198 -0.205 17865
1604 1 3 . 1 1 51 51 ALA H H 76 8.734 8.734 8.683 0.051 17865
1605 1 3 . 1 1 52 52 CYS N N 77 115.347 115.347 116.705 -1.358 17865
1606 1 3 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.292 0.188 17865
1607 1 3 . 1 1 52 52 CYS C C 77 176.299 176.299 176.597 -0.298 17865
1608 1 3 . 1 1 52 52 CYS CA C 77 57.701 57.701 59.707 -2.006 17865
1609 1 3 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.765 9.866 17865
1610 1 3 . 1 1 52 52 CYS H H 77 9.073 9.073 7.784 1.289 17865
1611 1 3 . 1 1 53 53 ALA N N 78 128.517 128.517 123.207 5.310 17865
1612 1 3 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.736 0.119 17865
1613 1 3 . 1 1 53 53 ALA C C 78 178.736 178.736 179.093 -0.357 17865
1614 1 3 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.261 0.372 17865
1615 1 3 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.837 1.354 17865
1616 1 3 . 1 1 53 53 ALA H H 78 7.174 7.174 8.225 -1.051 17865
1617 1 3 . 1 1 54 54 LYS N N 79 118.706 118.706 117.843 0.863 17865
1618 1 3 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.175 -0.372 17865
1619 1 3 . 1 1 54 54 LYS C C 79 179.611 179.611 178.837 0.774 17865
1620 1 3 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.369 1.356 17865
1621 1 3 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.501 0.152 17865
1622 1 3 . 1 1 54 54 LYS H H 79 8.313 8.313 7.940 0.373 17865
1623 1 3 . 1 1 55 55 GLY N N 80 104.822 104.822 107.845 -3.023 17865
1624 1 3 . 1 1 55 55 GLY C C 80 176.504 176.504 176.017 0.487 17865
1625 1 3 . 1 1 55 55 GLY CA C 80 46.839 46.839 46.584 0.255 17865
1626 1 3 . 1 1 55 55 GLY H H 80 8.175 8.175 7.288 0.887 17865
1627 1 3 . 1 1 56 56 ILE N N 81 123.697 123.697 123.167 0.530 17865
1628 1 3 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.875 -0.080 17865
1629 1 3 . 1 1 56 56 ILE C C 81 177.334 177.334 177.355 -0.021 17865
1630 1 3 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.686 0.595 17865
1631 1 3 . 1 1 56 56 ILE CB C 81 38.335 38.335 38.217 0.118 17865
1632 1 3 . 1 1 56 56 ILE H H 81 7.590 7.590 8.021 -0.431 17865
1633 1 3 . 1 1 57 57 ARG N N 82 118.161 118.161 118.946 -0.785 17865
1634 1 3 . 1 1 57 57 ARG HA H 82 3.935 3.935 4.024 -0.089 17865
1635 1 3 . 1 1 57 57 ARG C C 82 178.662 178.662 177.983 0.679 17865
1636 1 3 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.410 0.292 17865
1637 1 3 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.606 0.293 17865
1638 1 3 . 1 1 57 57 ARG H H 82 7.569 7.569 7.844 -0.275 17865
1639 1 3 . 1 1 58 58 GLU N N 83 115.085 115.085 118.092 -3.007 17865
1640 1 3 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.057 -0.026 17865
1641 1 3 . 1 1 58 58 GLU C C 83 178.224 178.224 178.674 -0.450 17865
1642 1 3 . 1 1 58 58 GLU CA C 83 58.304 58.304 58.421 -0.117 17865
1643 1 3 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.330 0.701 17865
1644 1 3 . 1 1 58 58 GLU H H 83 7.786 7.786 7.892 -0.106 17865
1645 1 3 . 1 1 59 59 LYS N N 84 119.183 119.183 117.485 1.698 17865
1646 1 3 . 1 1 59 59 LYS HA H 84 3.830 3.830 4.152 -0.322 17865
1647 1 3 . 1 1 59 59 LYS C C 84 177.933 177.933 177.059 0.874 17865
1648 1 3 . 1 1 59 59 LYS CA C 84 59.043 59.043 57.995 1.048 17865
1649 1 3 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.261 1.389 17865
1650 1 3 . 1 1 59 59 LYS H H 84 7.968 7.968 7.747 0.221 17865
1651 1 3 . 1 1 60 60 TYR N N 85 113.663 113.663 117.357 -3.694 17865
1652 1 3 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.793 -0.090 17865
1653 1 3 . 1 1 60 60 TYR C C 85 174.729 174.729 174.878 -0.149 17865
1654 1 3 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.687 0.515 17865
1655 1 3 . 1 1 60 60 TYR CB C 85 37.902 37.902 38.243 -0.341 17865
1656 1 3 . 1 1 60 60 TYR H H 85 7.562 7.562 7.817 -0.255 17865
1657 1 3 . 1 1 61 61 LYS N N 86 121.862 121.862 122.518 -0.656 17865
1658 1 3 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.742 -0.230 17865
1659 1 3 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.055 -0.113 17865
1660 1 3 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.314 -0.212 17865
1661 1 3 . 1 1 61 61 LYS H H 86 7.222 7.222 7.400 -0.178 17865
1662 1 3 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.552 -0.229 17865
1663 1 3 . 1 1 62 62 PRO C C 87 176.576 176.576 176.029 0.547 17865
1664 1 3 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.754 0.266 17865
1665 1 3 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.568 -0.328 17865
1666 1 3 . 1 1 63 63 ALA N N 88 125.029 125.029 122.543 2.486 17865
1667 1 3 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.860 -0.606 17865
1668 1 3 . 1 1 63 63 ALA C C 88 177.301 177.301 176.953 0.348 17865
1669 1 3 . 1 1 63 63 ALA CA C 88 52.281 52.281 51.838 0.443 17865
1670 1 3 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.905 1.297 17865
1671 1 3 . 1 1 63 63 ALA H H 88 8.329 8.329 8.352 -0.023 17865
1672 1 3 . 1 1 64 64 VAL N N 89 121.843 121.843 119.483 2.360 17865
1673 1 3 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.387 -0.443 17865
1674 1 3 . 1 1 64 64 VAL C C 89 174.791 174.791 174.044 0.747 17865
1675 1 3 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.805 1.176 17865
1676 1 3 . 1 1 64 64 VAL CB C 89 33.485 33.485 34.545 -1.060 17865
1677 1 3 . 1 1 64 64 VAL H H 89 8.075 8.075 7.996 0.079 17865
1678 1 3 . 1 1 65 65 VAL N N 90 125.399 125.399 120.298 5.101 17865
1679 1 3 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.455 -0.317 17865
1680 1 3 . 1 1 65 65 VAL C C 90 174.340 174.340 174.428 -0.088 17865
1681 1 3 . 1 1 65 65 VAL CA C 90 61.162 61.162 61.658 -0.497 17865
1682 1 3 . 1 1 65 65 VAL CB C 90 33.866 33.866 33.392 0.473 17865
1683 1 3 . 1 1 65 65 VAL H H 90 8.229 8.229 8.002 0.227 17865
1684 1 3 . 1 1 66 66 TYR N N 91 124.848 124.848 125.870 -1.022 17865
1685 1 3 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.817 -0.046 17865
1686 1 3 . 1 1 66 66 TYR C C 91 176.658 176.658 175.972 0.686 17865
1687 1 3 . 1 1 66 66 TYR CA C 91 58.084 58.084 57.465 0.619 17865
1688 1 3 . 1 1 66 66 TYR CB C 91 41.535 41.535 41.379 0.156 17865
1689 1 3 . 1 1 66 66 TYR H H 91 9.145 9.145 8.559 0.586 17865
1690 1 3 . 1 1 67 67 GLY N N 92 106.185 106.185 107.280 -1.095 17865
1691 1 3 . 1 1 67 67 GLY C C 92 175.681 175.681 173.860 1.821 17865
1692 1 3 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.408 0.566 17865
1693 1 3 . 1 1 67 67 GLY H H 92 8.730 8.730 8.759 -0.029 17865
1694 1 3 . 1 1 68 68 TYR N N 93 121.815 121.815 116.514 5.301 17865
1695 1 3 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.306 -0.331 17865
1696 1 3 . 1 1 68 68 TYR C C 93 176.035 176.035 176.270 -0.235 17865
1697 1 3 . 1 1 68 68 TYR CA C 93 61.046 61.046 60.266 0.780 17865
1698 1 3 . 1 1 68 68 TYR CB C 93 38.425 38.425 37.908 0.517 17865
1699 1 3 . 1 1 68 68 TYR H H 93 8.711 8.711 8.290 0.421 17865
1700 1 3 . 1 1 69 69 ASP N N 94 115.507 115.507 116.985 -1.478 17865
1701 1 3 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.632 -0.344 17865
1702 1 3 . 1 1 69 69 ASP C C 94 177.063 177.063 177.390 -0.327 17865
1703 1 3 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.753 -0.742 17865
1704 1 3 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.808 -0.641 17865
1705 1 3 . 1 1 69 69 ASP H H 94 8.010 8.010 7.731 0.279 17865
1706 1 3 . 1 1 70 70 GLY N N 95 107.196 107.196 107.808 -0.612 17865
1707 1 3 . 1 1 70 70 GLY C C 95 173.936 173.936 173.926 0.010 17865
1708 1 3 . 1 1 70 70 GLY CA C 95 45.392 45.392 44.836 0.556 17865
1709 1 3 . 1 1 70 70 GLY H H 95 7.986 7.986 7.463 0.523 17865
1710 1 3 . 1 1 71 71 LYS N N 96 121.258 121.258 121.670 -0.412 17865
1711 1 3 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.863 -0.079 17865
1712 1 3 . 1 1 71 71 LYS CA C 96 54.114 54.114 53.305 0.809 17865
1713 1 3 . 1 1 71 71 LYS CB C 96 31.762 31.762 32.939 -1.177 17865
1714 1 3 . 1 1 71 71 LYS H H 96 7.877 7.877 7.926 -0.049 17865
1715 1 3 . 1 1 72 72 PRO C C 97 177.170 177.170 175.535 1.635 17865
1716 1 3 . 1 1 72 72 PRO CA C 97 63.137 63.137 62.838 0.299 17865
1717 1 3 . 1 1 72 72 PRO CB C 97 32.240 32.240 30.463 1.777 17865
1718 1 3 . 1 1 73 73 LEU N N 98 123.503 123.503 121.991 1.512 17865
1719 1 3 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.735 -0.375 17865
1720 1 3 . 1 1 73 73 LEU C C 98 176.354 176.354 175.365 0.989 17865
1721 1 3 . 1 1 73 73 LEU CA C 98 53.927 53.927 52.891 1.036 17865
1722 1 3 . 1 1 73 73 LEU CB C 98 42.272 42.272 46.183 -3.911 17865
1723 1 3 . 1 1 73 73 LEU H H 98 8.850 8.850 7.816 1.034 17865
1724 1 3 . 1 1 74 74 ASP N N 99 122.212 122.212 121.482 0.730 17865
1725 1 3 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.626 -0.029 17865
1726 1 3 . 1 1 74 74 ASP C C 99 175.819 175.819 175.328 0.491 17865
1727 1 3 . 1 1 74 74 ASP CA C 99 53.856 53.856 53.924 -0.068 17865
1728 1 3 . 1 1 74 74 ASP CB C 99 40.989 40.989 38.765 2.224 17865
1729 1 3 . 1 1 74 74 ASP H H 99 8.517 8.517 8.620 -0.103 17865
1730 1 3 . 1 1 75 75 LEU N N 100 125.874 125.874 121.473 4.401 17865
1731 1 3 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.586 -0.220 17865
1732 1 3 . 1 1 75 75 LEU C C 100 178.426 178.426 176.541 1.885 17865
1733 1 3 . 1 1 75 75 LEU CA C 100 53.631 53.631 54.611 -0.980 17865
1734 1 3 . 1 1 75 75 LEU CB C 100 40.676 40.676 43.245 -2.569 17865
1735 1 3 . 1 1 75 75 LEU H H 100 8.281 8.281 7.753 0.528 17865
1736 1 3 . 1 1 76 76 GLY N N 101 110.604 110.604 110.375 0.229 17865
1737 1 3 . 1 1 76 76 GLY C C 101 176.936 176.936 175.483 1.453 17865
1738 1 3 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.476 0.351 17865
1739 1 3 . 1 1 76 76 GLY H H 101 8.914 8.914 8.570 0.344 17865
1740 1 3 . 1 1 77 77 PHE N N 102 117.639 117.639 114.323 3.316 17865
1741 1 3 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.972 -0.591 17865
1742 1 3 . 1 1 77 77 PHE C C 102 177.878 177.878 176.048 1.830 17865
1743 1 3 . 1 1 77 77 PHE CA C 102 59.139 59.139 56.113 3.026 17865
1744 1 3 . 1 1 77 77 PHE CB C 102 36.935 36.935 37.789 -0.854 17865
1745 1 3 . 1 1 77 77 PHE H H 102 7.992 7.992 7.822 0.170 17865
1746 1 3 . 1 1 78 78 CYS N N 103 121.136 121.136 120.670 0.466 17865
1747 1 3 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.950 -0.565 17865
1748 1 3 . 1 1 78 78 CYS C C 103 172.780 172.780 176.767 -3.987 17865
1749 1 3 . 1 1 78 78 CYS CA C 103 53.696 53.696 59.347 -5.651 17865
1750 1 3 . 1 1 78 78 CYS CB C 103 34.237 34.237 26.949 7.288 17865
1751 1 3 . 1 1 78 78 CYS H H 103 7.362 7.362 7.857 -0.495 17865
1752 1 3 . 1 1 79 79 THR N N 104 114.773 114.773 116.071 -1.298 17865
1753 1 3 . 1 1 79 79 THR HA H 104 3.984 3.984 4.039 -0.055 17865
1754 1 3 . 1 1 79 79 THR C C 104 176.624 176.624 175.873 0.751 17865
1755 1 3 . 1 1 79 79 THR CA C 104 65.180 65.180 65.233 -0.053 17865
1756 1 3 . 1 1 79 79 THR CB C 104 69.062 69.062 68.350 0.712 17865
1757 1 3 . 1 1 79 79 THR H H 104 7.864 7.864 7.834 0.030 17865
1758 1 3 . 1 1 80 80 LEU N N 105 119.785 119.785 119.663 0.122 17865
1759 1 3 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.270 0.061 17865
1760 1 3 . 1 1 80 80 LEU C C 105 177.208 177.208 177.306 -0.098 17865
1761 1 3 . 1 1 80 80 LEU CA C 105 55.453 55.453 56.017 -0.565 17865
1762 1 3 . 1 1 80 80 LEU CB C 105 41.293 41.293 41.474 -0.181 17865
1763 1 3 . 1 1 80 80 LEU H H 105 7.238 7.238 7.735 -0.497 17865
1764 1 3 . 1 1 81 81 ALA N N 106 119.309 119.309 118.625 0.684 17865
1765 1 3 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.550 -0.023 17865
1766 1 3 . 1 1 81 81 ALA C C 106 178.769 178.769 177.826 0.943 17865
1767 1 3 . 1 1 81 81 ALA CA C 106 52.049 52.049 51.654 0.395 17865
1768 1 3 . 1 1 81 81 ALA CB C 106 18.820 18.820 20.562 -1.742 17865
1769 1 3 . 1 1 81 81 ALA H H 106 7.432 7.432 7.503 -0.071 17865
1770 1 3 . 1 1 82 82 GLY N N 107 109.793 109.793 108.354 1.439 17865
1771 1 3 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.616 1.503 17865
1772 1 3 . 1 1 82 82 GLY H H 107 7.918 7.918 7.772 0.146 17865
1773 1 3 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.821 0.445 17865
1774 1 3 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.459 -0.196 17865
1775 1 3 . 1 1 83 83 ILE CB C 108 38.261 38.261 37.964 0.297 17865
1776 1 3 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.395 0.360 17865
1777 1 3 . 1 1 84 84 ARG C C 109 181.344 181.344 177.418 3.926 17865
1778 1 3 . 1 1 84 84 ARG CA C 109 55.939 55.939 57.201 -1.262 17865
1779 1 3 . 1 1 84 84 ARG CB C 109 30.283 30.283 29.416 0.867 17865
1780 1 3 . 1 1 85 85 GLU N N 110 122.944 122.944 121.474 1.470 17865
1781 1 3 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.158 -0.541 17865
1782 1 3 . 1 1 85 85 GLU C C 110 177.797 177.797 178.076 -0.279 17865
1783 1 3 . 1 1 85 85 GLU CA C 110 60.728 60.728 58.891 1.837 17865
1784 1 3 . 1 1 85 85 GLU CB C 110 28.871 28.871 28.812 0.059 17865
1785 1 3 . 1 1 85 85 GLU H H 110 8.003 8.003 8.454 -0.451 17865
1786 1 3 . 1 1 86 86 VAL N N 111 117.101 117.101 120.068 -2.967 17865
1787 1 3 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.640 -0.129 17865
1788 1 3 . 1 1 86 86 VAL C C 111 177.710 177.710 178.324 -0.614 17865
1789 1 3 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.742 -0.312 17865
1790 1 3 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.191 0.022 17865
1791 1 3 . 1 1 86 86 VAL H H 111 8.106 8.106 7.577 0.529 17865
1792 1 3 . 1 1 87 87 ASP N N 112 122.242 122.242 121.308 0.934 17865
1793 1 3 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.401 -0.097 17865
1794 1 3 . 1 1 87 87 ASP C C 112 176.912 176.912 178.081 -1.169 17865
1795 1 3 . 1 1 87 87 ASP CA C 112 57.417 57.417 57.118 0.299 17865
1796 1 3 . 1 1 87 87 ASP CB C 112 40.476 40.476 39.973 0.503 17865
1797 1 3 . 1 1 87 87 ASP H H 112 7.401 7.401 7.883 -0.482 17865
1798 1 3 . 1 1 88 88 CYS N N 113 120.819 120.819 117.634 3.185 17865
1799 1 3 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.173 -0.864 17865
1800 1 3 . 1 1 88 88 CYS C C 113 175.270 175.270 176.856 -1.586 17865
1801 1 3 . 1 1 88 88 CYS CA C 113 59.759 59.759 61.109 -1.350 17865
1802 1 3 . 1 1 88 88 CYS CB C 113 33.835 33.835 25.566 8.269 17865
1803 1 3 . 1 1 88 88 CYS H H 113 7.785 7.785 7.761 0.024 17865
1804 1 3 . 1 1 89 89 ARG N N 114 118.654 118.654 121.162 -2.508 17865
1805 1 3 . 1 1 89 89 ARG HA H 114 3.641 3.641 3.957 -0.316 17865
1806 1 3 . 1 1 89 89 ARG C C 114 179.018 179.018 178.237 0.781 17865
1807 1 3 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.099 1.094 17865
1808 1 3 . 1 1 89 89 ARG CB C 114 29.713 29.713 29.657 0.056 17865
1809 1 3 . 1 1 89 89 ARG H H 114 8.142 8.142 7.761 0.381 17865
1810 1 3 . 1 1 90 90 LYS N N 115 120.964 120.964 117.967 2.997 17865
1811 1 3 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.216 -0.186 17865
1812 1 3 . 1 1 90 90 LYS C C 115 180.092 180.092 178.997 1.095 17865
1813 1 3 . 1 1 90 90 LYS CA C 115 59.568 59.568 59.083 0.485 17865
1814 1 3 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.577 -0.356 17865
1815 1 3 . 1 1 90 90 LYS H H 115 7.936 7.936 7.733 0.203 17865
1816 1 3 . 1 1 91 91 ASP N N 116 121.690 121.690 120.791 0.899 17865
1817 1 3 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.480 0.033 17865
1818 1 3 . 1 1 91 91 ASP C C 116 179.419 179.419 178.325 1.094 17865
1819 1 3 . 1 1 91 91 ASP CA C 116 57.237 57.237 57.347 -0.110 17865
1820 1 3 . 1 1 91 91 ASP CB C 116 40.648 40.648 40.528 0.120 17865
1821 1 3 . 1 1 91 91 ASP H H 116 8.558 8.558 7.705 0.853 17865
1822 1 3 . 1 1 92 92 ALA N N 117 122.784 122.784 122.816 -0.032 17865
1823 1 3 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.160 -0.137 17865
1824 1 3 . 1 1 92 92 ALA C C 117 178.789 178.789 179.453 -0.664 17865
1825 1 3 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.312 -0.261 17865
1826 1 3 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.744 0.431 17865
1827 1 3 . 1 1 92 92 ALA H H 117 8.703 8.703 8.397 0.306 17865
1828 1 3 . 1 1 93 93 GLN N N 118 115.510 115.510 115.510 0.000 17865
1829 1 3 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.134 -0.190 17865
1830 1 3 . 1 1 93 93 GLN C C 118 178.745 178.745 177.376 1.369 17865
1831 1 3 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.932 0.550 17865
1832 1 3 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.198 0.199 17865
1833 1 3 . 1 1 93 93 GLN H H 118 7.664 7.664 8.119 -0.455 17865
1834 1 3 . 1 1 94 94 THR N N 119 110.110 110.110 109.039 1.071 17865
1835 1 3 . 1 1 94 94 THR HA H 119 4.237 4.237 4.349 -0.112 17865
1836 1 3 . 1 1 94 94 THR C C 119 175.861 175.861 175.572 0.289 17865
1837 1 3 . 1 1 94 94 THR CA C 119 64.604 64.604 63.278 1.326 17865
1838 1 3 . 1 1 94 94 THR CB C 119 69.716 69.716 69.188 0.528 17865
1839 1 3 . 1 1 94 94 THR H H 119 7.726 7.726 7.705 0.021 17865
1840 1 3 . 1 1 95 95 CYS N N 120 118.523 118.523 123.141 -4.618 17865
1841 1 3 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.538 0.195 17865
1842 1 3 . 1 1 95 95 CYS C C 120 175.165 175.165 174.721 0.444 17865
1843 1 3 . 1 1 95 95 CYS CA C 120 52.973 52.973 59.659 -6.686 17865
1844 1 3 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.868 11.863 17865
1845 1 3 . 1 1 95 95 CYS H H 120 7.756 7.756 7.994 -0.238 17865
1846 1 3 . 1 1 96 96 ASP N N 121 119.081 119.081 121.947 -2.866 17865
1847 1 3 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.505 0.173 17865
1848 1 3 . 1 1 96 96 ASP CA C 121 56.224 56.224 56.743 -0.519 17865
1849 1 3 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.829 0.902 17865
1850 1 3 . 1 1 96 96 ASP H H 121 7.354 7.354 8.112 -0.758 17865
1851 1 3 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.372 -0.797 17865
1852 1 3 . 1 1 97 97 LYS C C 122 175.510 175.510 177.076 -1.566 17865
1853 1 3 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.827 0.012 17865
1854 1 3 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.152 -3.402 17865
1855 1 3 . 1 1 98 98 LYS N N 123 119.980 119.980 119.239 0.741 17865
1856 1 3 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.424 -0.130 17865
1857 1 3 . 1 1 98 98 LYS C C 123 176.968 176.968 178.637 -1.669 17865
1858 1 3 . 1 1 98 98 LYS CA C 123 55.904 55.904 56.985 -1.081 17865
1859 1 3 . 1 1 98 98 LYS CB C 123 33.232 33.232 32.777 0.455 17865
1860 1 3 . 1 1 98 98 LYS H H 123 7.799 7.799 8.193 -0.394 17865
1861 1 3 . 1 1 99 99 TYR N N 124 122.378 122.378 124.379 -2.001 17865
1862 1 3 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.202 -0.307 17865
1863 1 3 . 1 1 99 99 TYR C C 124 177.126 177.126 176.389 0.737 17865
1864 1 3 . 1 1 99 99 TYR CA C 124 60.211 60.211 60.824 -0.613 17865
1865 1 3 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.299 -0.028 17865
1866 1 3 . 1 1 99 99 TYR H H 124 8.536 8.536 8.448 0.088 17865
1867 1 3 . 1 1 100 100 GLU N N 125 118.610 118.610 116.070 2.540 17865
1868 1 3 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.480 -0.212 17865
1869 1 3 . 1 1 100 100 GLU C C 125 177.387 177.387 176.047 1.340 17865
1870 1 3 . 1 1 100 100 GLU CA C 125 55.759 55.759 55.524 0.235 17865
1871 1 3 . 1 1 100 100 GLU CB C 125 27.321 27.321 30.349 -3.028 17865
1872 1 3 . 1 1 100 100 GLU H H 125 8.385 8.385 8.490 -0.105 17865
1873 1 3 . 1 1 101 101 SER N N 126 115.949 115.949 117.231 -1.282 17865
1874 1 3 . 1 1 101 101 SER HA H 126 3.959 3.959 4.097 -0.138 17865
1875 1 3 . 1 1 101 101 SER C C 126 176.047 176.047 175.811 0.236 17865
1876 1 3 . 1 1 101 101 SER CA C 126 62.439 62.439 62.395 0.044 17865
1877 1 3 . 1 1 101 101 SER CB C 126 63.299 63.299 63.173 0.126 17865
1878 1 3 . 1 1 101 101 SER H H 126 7.823 7.823 7.640 0.183 17865
1879 1 3 . 1 1 102 102 ASP N N 127 120.920 120.920 120.405 0.515 17865
1880 1 3 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.311 0.096 17865
1881 1 3 . 1 1 102 102 ASP C C 127 178.234 178.234 177.842 0.392 17865
1882 1 3 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.549 -0.138 17865
1883 1 3 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.798 -1.082 17865
1884 1 3 . 1 1 102 102 ASP H H 127 8.683 8.683 8.637 0.046 17865
1885 1 3 . 1 1 103 103 LYS N N 128 121.753 121.753 118.585 3.168 17865
1886 1 3 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.095 -0.091 17865
1887 1 3 . 1 1 103 103 LYS C C 128 179.395 179.395 178.197 1.198 17865
1888 1 3 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.482 0.989 17865
1889 1 3 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.888 0.513 17865
1890 1 3 . 1 1 103 103 LYS H H 128 7.771 7.771 7.995 -0.224 17865
1891 1 3 . 1 1 104 104 CYS N N 129 120.109 120.109 119.647 0.462 17865
1892 1 3 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.355 -0.161 17865
1893 1 3 . 1 1 104 104 CYS C C 129 176.779 176.779 176.960 -0.181 17865
1894 1 3 . 1 1 104 104 CYS CA C 129 59.790 59.790 60.639 -0.849 17865
1895 1 3 . 1 1 104 104 CYS CB C 129 36.879 36.879 26.117 10.762 17865
1896 1 3 . 1 1 104 104 CYS H H 129 7.973 7.973 8.297 -0.324 17865
1897 1 3 . 1 1 105 105 LEU N N 130 121.804 121.804 121.850 -0.046 17865
1898 1 3 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.968 0.122 17865
1899 1 3 . 1 1 105 105 LEU C C 130 179.373 179.373 178.571 0.802 17865
1900 1 3 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.153 -0.784 17865
1901 1 3 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.915 0.183 17865
1902 1 3 . 1 1 105 105 LEU H H 130 8.666 8.666 8.426 0.240 17865
1903 1 3 . 1 1 106 106 ASN N N 131 118.535 118.535 116.477 2.058 17865
1904 1 3 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.477 -0.239 17865
1905 1 3 . 1 1 106 106 ASN C C 131 177.830 177.830 177.320 0.510 17865
1906 1 3 . 1 1 106 106 ASN CA C 131 56.256 56.256 55.732 0.524 17865
1907 1 3 . 1 1 106 106 ASN CB C 131 37.817 37.817 37.939 -0.122 17865
1908 1 3 . 1 1 106 106 ASN H H 131 8.438 8.438 7.934 0.504 17865
1909 1 3 . 1 1 107 107 ALA N N 132 121.485 121.485 122.038 -0.553 17865
1910 1 3 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.221 -0.002 17865
1911 1 3 . 1 1 107 107 ALA C C 132 180.726 180.726 178.634 2.092 17865
1912 1 3 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.338 0.625 17865
1913 1 3 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.876 -1.055 17865
1914 1 3 . 1 1 107 107 ALA H H 132 7.541 7.541 7.500 0.041 17865
1915 1 3 . 1 1 108 108 ILE N N 133 120.979 120.979 117.103 3.876 17865
1916 1 3 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.914 0.017 17865
1917 1 3 . 1 1 108 108 ILE C C 133 178.114 178.114 177.421 0.693 17865
1918 1 3 . 1 1 108 108 ILE CA C 133 63.353 63.353 62.025 1.328 17865
1919 1 3 . 1 1 108 108 ILE CB C 133 36.454 36.454 37.523 -1.069 17865
1920 1 3 . 1 1 108 108 ILE H H 133 7.551 7.551 7.632 -0.081 17865
1921 1 3 . 1 1 109 109 LYS N N 134 121.415 121.415 119.736 1.679 17865
1922 1 3 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.091 -0.503 17865
1923 1 3 . 1 1 109 109 LYS C C 134 179.561 179.561 178.211 1.350 17865
1924 1 3 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.743 0.365 17865
1925 1 3 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.342 -0.180 17865
1926 1 3 . 1 1 109 109 LYS H H 134 8.414 8.414 7.828 0.586 17865
1927 1 3 . 1 1 110 110 GLU N N 135 116.099 116.099 117.353 -1.254 17865
1928 1 3 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.170 -0.241 17865
1929 1 3 . 1 1 110 110 GLU C C 135 178.239 178.239 179.015 -0.776 17865
1930 1 3 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.654 -0.008 17865
1931 1 3 . 1 1 110 110 GLU CB C 135 29.638 29.638 29.148 0.490 17865
1932 1 3 . 1 1 110 110 GLU H H 135 7.473 7.473 7.793 -0.320 17865
1933 1 3 . 1 1 111 111 LYS N N 136 119.805 119.805 120.108 -0.303 17865
1934 1 3 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.125 -0.219 17865
1935 1 3 . 1 1 111 111 LYS C C 136 177.600 177.600 177.550 0.050 17865
1936 1 3 . 1 1 111 111 LYS CA C 136 58.749 58.749 57.502 1.247 17865
1937 1 3 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.204 1.034 17865
1938 1 3 . 1 1 111 111 LYS H H 136 7.540 7.540 7.395 0.145 17865
1939 1 3 . 1 1 112 112 TYR N N 137 114.768 114.768 116.660 -1.892 17865
1940 1 3 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.731 -0.208 17865
1941 1 3 . 1 1 112 112 TYR C C 137 174.690 174.690 174.804 -0.114 17865
1942 1 3 . 1 1 112 112 TYR CA C 137 58.359 58.359 55.410 2.949 17865
1943 1 3 . 1 1 112 112 TYR CB C 137 38.328 38.328 36.653 1.675 17865
1944 1 3 . 1 1 112 112 TYR H H 137 7.488 7.488 7.309 0.179 17865
1945 1 3 . 1 1 113 113 LYS N N 138 123.694 123.694 123.684 0.010 17865
1946 1 3 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.356 0.145 17865
1947 1 3 . 1 1 113 113 LYS CA C 138 55.282 55.282 55.783 -0.501 17865
1948 1 3 . 1 1 113 113 LYS CB C 138 32.124 32.124 33.201 -1.077 17865
1949 1 3 . 1 1 113 113 LYS H H 138 7.217 7.217 7.316 -0.099 17865
1950 1 3 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.576 -0.124 17865
1951 1 3 . 1 1 114 114 PRO C C 139 176.974 176.974 176.198 0.776 17865
1952 1 3 . 1 1 114 114 PRO CA C 139 63.189 63.189 62.792 0.397 17865
1953 1 3 . 1 1 114 114 PRO CB C 139 32.251 32.251 29.865 2.386 17865
1954 1 3 . 1 1 115 115 VAL N N 140 121.098 121.098 117.774 3.324 17865
1955 1 3 . 1 1 115 115 VAL HA H 140 4.102 4.102 3.984 0.118 17865
1956 1 3 . 1 1 115 115 VAL C C 140 176.207 176.207 176.200 0.007 17865
1957 1 3 . 1 1 115 115 VAL CA C 140 62.356 62.356 64.106 -1.750 17865
1958 1 3 . 1 1 115 115 VAL CB C 140 33.256 33.256 32.119 1.137 17865
1959 1 3 . 1 1 115 115 VAL H H 140 8.272 8.272 7.928 0.344 17865
1960 1 3 . 1 1 116 116 VAL N N 141 124.167 124.167 120.206 3.961 17865
1961 1 3 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.221 -0.099 17865
1962 1 3 . 1 1 116 116 VAL C C 141 175.415 175.415 174.869 0.546 17865
1963 1 3 . 1 1 116 116 VAL CA C 141 61.731 61.731 62.255 -0.524 17865
1964 1 3 . 1 1 116 116 VAL CB C 141 33.145 33.145 32.572 0.573 17865
1965 1 3 . 1 1 116 116 VAL H H 141 8.142 8.142 7.822 0.320 17865
1966 1 3 . 1 1 117 117 ASP N N 142 126.737 126.737 128.639 -1.902 17865
1967 1 3 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.982 -0.170 17865
1968 1 3 . 1 1 117 117 ASP CA C 142 52.217 52.217 51.122 1.095 17865
1969 1 3 . 1 1 117 117 ASP CB C 142 41.368 41.368 42.665 -1.297 17865
1970 1 3 . 1 1 117 117 ASP H H 142 8.419 8.419 8.191 0.228 17865
1971 1 3 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.199 0.212 17865
1972 1 3 . 1 1 118 118 PRO C C 143 176.662 176.662 176.866 -0.204 17865
1973 1 3 . 1 1 118 118 PRO CA C 143 63.247 63.247 64.020 -0.773 17865
1974 1 3 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.173 0.137 17865
1975 1 3 . 1 1 119 119 ASN N N 144 119.287 119.287 117.901 1.386 17865
1976 1 3 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.875 0.072 17865
1977 1 3 . 1 1 119 119 ASN CA C 144 51.633 51.633 51.102 0.531 17865
1978 1 3 . 1 1 119 119 ASN CB C 144 38.859 38.859 39.818 -0.959 17865
1979 1 3 . 1 1 119 119 ASN H H 144 8.432 8.432 8.278 0.154 17865
1980 1 3 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.831 -0.151 17865
1981 1 3 . 1 1 120 120 PRO CA C 145 61.640 61.640 61.967 -0.327 17865
1982 1 3 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.274 -0.356 17865
1983 1 3 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.318 0.059 17865
1984 1 3 . 1 1 121 121 PRO C C 146 175.876 175.876 176.195 -0.319 17865
1985 1 3 . 1 1 121 121 PRO CA C 146 63.174 63.174 63.708 -0.534 17865
1986 1 3 . 1 1 121 121 PRO CB C 146 31.939 31.939 31.934 0.005 17865
1987 1 4 . 1 1 2 2 ASP N N 27 121.041 121.041 123.762 -2.721 17865
1988 1 4 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.744 -0.106 17865
1989 1 4 . 1 1 2 2 ASP C C 27 175.878 175.878 176.415 -0.537 17865
1990 1 4 . 1 1 2 2 ASP CA C 27 54.382 54.382 53.949 0.433 17865
1991 1 4 . 1 1 2 2 ASP CB C 27 41.729 41.729 41.486 0.243 17865
1992 1 4 . 1 1 2 2 ASP H H 27 8.639 8.639 8.930 -0.291 17865
1993 1 4 . 1 1 3 3 VAL N N 28 119.901 119.901 115.555 4.346 17865
1994 1 4 . 1 1 3 3 VAL HA H 28 4.033 4.033 3.830 0.203 17865
1995 1 4 . 1 1 3 3 VAL C C 28 175.521 175.521 174.407 1.114 17865
1996 1 4 . 1 1 3 3 VAL CA C 28 62.216 62.216 64.162 -1.946 17865
1997 1 4 . 1 1 3 3 VAL CB C 28 33.003 33.003 29.416 3.587 17865
1998 1 4 . 1 1 3 3 VAL H H 28 8.113 8.113 7.975 0.138 17865
1999 1 4 . 1 1 4 4 PHE N N 29 123.707 123.707 120.650 3.057 17865
2000 1 4 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.827 -0.171 17865
2001 1 4 . 1 1 4 4 PHE C C 29 174.874 174.874 174.565 0.309 17865
2002 1 4 . 1 1 4 4 PHE CA C 29 57.159 57.159 57.094 0.065 17865
2003 1 4 . 1 1 4 4 PHE CB C 29 39.795 39.795 40.733 -0.938 17865
2004 1 4 . 1 1 4 4 PHE H H 29 8.255 8.255 7.715 0.540 17865
2005 1 4 . 1 1 5 5 ASP N N 30 124.203 124.203 127.259 -3.056 17865
2006 1 4 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.698 0.140 17865
2007 1 4 . 1 1 5 5 ASP CA C 30 52.385 52.385 52.974 -0.589 17865
2008 1 4 . 1 1 5 5 ASP CB C 30 40.801 40.801 41.256 -0.455 17865
2009 1 4 . 1 1 5 5 ASP H H 30 8.226 8.226 8.080 0.146 17865
2010 1 4 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.532 0.005 17865
2011 1 4 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.344 -0.680 17865
2012 1 4 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.574 -0.748 17865
2013 1 4 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.222 0.204 17865
2014 1 4 . 1 1 7 7 PRO C C 32 177.226 177.226 176.534 0.692 17865
2015 1 4 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.848 -0.679 17865
2016 1 4 . 1 1 7 7 PRO CB C 32 31.948 31.948 31.607 0.341 17865
2017 1 4 . 1 1 8 8 THR N N 33 114.158 114.158 115.284 -1.126 17865
2018 1 4 . 1 1 8 8 THR HA H 33 4.195 4.195 3.942 0.253 17865
2019 1 4 . 1 1 8 8 THR C C 33 174.468 174.468 174.576 -0.108 17865
2020 1 4 . 1 1 8 8 THR CA C 33 62.110 62.110 62.831 -0.721 17865
2021 1 4 . 1 1 8 8 THR CB C 33 69.975 69.975 67.754 2.221 17865
2022 1 4 . 1 1 8 8 THR H H 33 8.096 8.096 8.407 -0.311 17865
2023 1 4 . 1 1 9 9 GLN N N 34 122.411 122.411 121.502 0.909 17865
2024 1 4 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.293 -0.030 17865
2025 1 4 . 1 1 9 9 GLN C C 34 175.445 175.445 173.873 1.572 17865
2026 1 4 . 1 1 9 9 GLN CA C 34 55.763 55.763 55.221 0.542 17865
2027 1 4 . 1 1 9 9 GLN CB C 34 29.691 29.691 29.790 -0.099 17865
2028 1 4 . 1 1 9 9 GLN H H 34 8.278 8.278 7.605 0.673 17865
2029 1 4 . 1 1 10 10 TYR N N 35 121.048 121.048 118.250 2.798 17865
2030 1 4 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.692 -0.172 17865
2031 1 4 . 1 1 10 10 TYR C C 35 176.314 176.314 175.881 0.433 17865
2032 1 4 . 1 1 10 10 TYR CA C 35 57.972 57.972 56.941 1.031 17865
2033 1 4 . 1 1 10 10 TYR CB C 35 38.936 38.936 39.691 -0.755 17865
2034 1 4 . 1 1 10 10 TYR H H 35 8.227 8.227 7.321 0.906 17865
2035 1 4 . 1 1 11 11 GLY N N 36 109.711 109.711 108.632 1.079 17865
2036 1 4 . 1 1 11 11 GLY C C 36 174.128 174.128 174.775 -0.647 17865
2037 1 4 . 1 1 11 11 GLY CA C 36 45.212 45.212 46.158 -0.946 17865
2038 1 4 . 1 1 11 11 GLY H H 36 8.247 8.247 8.942 -0.695 17865
2039 1 4 . 1 1 12 12 TYR N N 37 120.302 120.302 117.302 3.000 17865
2040 1 4 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.818 -0.336 17865
2041 1 4 . 1 1 12 12 TYR C C 37 175.864 175.864 174.513 1.351 17865
2042 1 4 . 1 1 12 12 TYR CA C 37 58.541 58.541 55.735 2.806 17865
2043 1 4 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.162 -0.447 17865
2044 1 4 . 1 1 12 12 TYR H H 37 8.101 8.101 7.843 0.258 17865
2045 1 4 . 1 1 13 13 ASP N N 38 121.883 121.883 119.868 2.015 17865
2046 1 4 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.488 -0.002 17865
2047 1 4 . 1 1 13 13 ASP C C 38 176.538 176.538 175.891 0.647 17865
2048 1 4 . 1 1 13 13 ASP CA C 38 54.223 54.223 55.340 -1.117 17865
2049 1 4 . 1 1 13 13 ASP CB C 38 40.988 40.988 40.733 0.254 17865
2050 1 4 . 1 1 13 13 ASP H H 38 8.266 8.266 7.985 0.281 17865
2051 1 4 . 1 1 14 14 GLY N N 39 107.705 107.705 110.259 -2.554 17865
2052 1 4 . 1 1 14 14 GLY C C 39 173.822 173.822 172.946 0.876 17865
2053 1 4 . 1 1 14 14 GLY CA C 39 45.404 45.404 44.610 0.794 17865
2054 1 4 . 1 1 14 14 GLY H H 39 7.647 7.647 8.119 -0.472 17865
2055 1 4 . 1 1 15 15 LYS N N 40 121.621 121.621 121.911 -0.290 17865
2056 1 4 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.895 -0.320 17865
2057 1 4 . 1 1 15 15 LYS CA C 40 54.100 54.100 52.802 1.298 17865
2058 1 4 . 1 1 15 15 LYS CB C 40 32.510 32.510 34.278 -1.768 17865
2059 1 4 . 1 1 15 15 LYS H H 40 7.908 7.908 7.441 0.467 17865
2060 1 4 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.951 -0.599 17865
2061 1 4 . 1 1 16 16 PRO C C 41 176.806 176.806 176.462 0.344 17865
2062 1 4 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.231 0.527 17865
2063 1 4 . 1 1 16 16 PRO CB C 41 32.314 32.314 33.077 -0.763 17865
2064 1 4 . 1 1 17 17 LEU N N 42 123.488 123.488 120.577 2.911 17865
2065 1 4 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.599 -0.550 17865
2066 1 4 . 1 1 17 17 LEU C C 42 174.973 174.973 176.007 -1.034 17865
2067 1 4 . 1 1 17 17 LEU CA C 42 55.436 55.436 55.456 -0.020 17865
2068 1 4 . 1 1 17 17 LEU CB C 42 42.093 42.093 41.647 0.446 17865
2069 1 4 . 1 1 17 17 LEU H H 42 8.499 8.499 8.618 -0.119 17865
2070 1 4 . 1 1 18 18 ASP N N 43 123.354 123.354 124.097 -0.743 17865
2071 1 4 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.806 -0.308 17865
2072 1 4 . 1 1 18 18 ASP C C 43 175.947 175.947 176.312 -0.365 17865
2073 1 4 . 1 1 18 18 ASP CA C 43 52.858 52.858 53.280 -0.422 17865
2074 1 4 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.822 -2.601 17865
2075 1 4 . 1 1 18 18 ASP H H 43 7.789 7.789 8.601 -0.812 17865
2076 1 4 . 1 1 19 19 ALA N N 44 120.147 120.147 123.278 -3.131 17865
2077 1 4 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.204 -0.218 17865
2078 1 4 . 1 1 19 19 ALA C C 44 179.476 179.476 179.126 0.350 17865
2079 1 4 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.091 1.072 17865
2080 1 4 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.884 -0.496 17865
2081 1 4 . 1 1 19 19 ALA H H 44 8.561 8.561 8.534 0.027 17865
2082 1 4 . 1 1 20 20 SER N N 45 115.037 115.037 115.312 -0.275 17865
2083 1 4 . 1 1 20 20 SER HA H 45 4.151 4.151 4.038 0.113 17865
2084 1 4 . 1 1 20 20 SER C C 45 177.191 177.191 176.363 0.828 17865
2085 1 4 . 1 1 20 20 SER CA C 45 61.629 61.629 61.164 0.465 17865
2086 1 4 . 1 1 20 20 SER CB C 45 62.804 62.804 62.348 0.456 17865
2087 1 4 . 1 1 20 20 SER H H 45 8.466 8.466 8.242 0.224 17865
2088 1 4 . 1 1 21 21 PHE N N 46 125.030 125.030 120.274 4.756 17865
2089 1 4 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.384 -0.153 17865
2090 1 4 . 1 1 21 21 PHE C C 46 176.850 176.850 177.525 -0.675 17865
2091 1 4 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.471 0.335 17865
2092 1 4 . 1 1 21 21 PHE CB C 46 39.881 39.881 38.213 1.668 17865
2093 1 4 . 1 1 21 21 PHE H H 46 8.034 8.034 7.292 0.742 17865
2094 1 4 . 1 1 22 22 CYS N N 47 113.943 113.943 116.551 -2.608 17865
2095 1 4 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.371 -0.120 17865
2096 1 4 . 1 1 22 22 CYS C C 47 176.449 176.449 176.189 0.260 17865
2097 1 4 . 1 1 22 22 CYS CA C 47 53.600 53.600 59.418 -5.818 17865
2098 1 4 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.611 10.780 17865
2099 1 4 . 1 1 22 22 CYS H H 47 7.691 7.691 8.285 -0.594 17865
2100 1 4 . 1 1 23 23 ARG N N 48 119.958 119.958 121.163 -1.205 17865
2101 1 4 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.122 -0.042 17865
2102 1 4 . 1 1 23 23 ARG C C 48 177.904 177.904 177.723 0.181 17865
2103 1 4 . 1 1 23 23 ARG CA C 48 58.907 58.907 59.683 -0.776 17865
2104 1 4 . 1 1 23 23 ARG CB C 48 30.171 30.171 30.105 0.066 17865
2105 1 4 . 1 1 23 23 ARG H H 48 7.628 7.628 7.541 0.087 17865
2106 1 4 . 1 1 24 24 THR N N 49 106.445 106.445 112.487 -6.042 17865
2107 1 4 . 1 1 24 24 THR HA H 49 4.385 4.385 4.215 0.170 17865
2108 1 4 . 1 1 24 24 THR C C 49 174.758 174.758 175.062 -0.304 17865
2109 1 4 . 1 1 24 24 THR CA C 49 61.573 61.573 64.601 -3.028 17865
2110 1 4 . 1 1 24 24 THR CB C 49 68.794 68.794 68.504 0.290 17865
2111 1 4 . 1 1 24 24 THR H H 49 7.307 7.307 7.869 -0.562 17865
2112 1 4 . 1 1 25 25 ALA N N 50 122.242 122.242 121.730 0.512 17865
2113 1 4 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.362 0.042 17865
2114 1 4 . 1 1 25 25 ALA C C 50 178.554 178.554 178.818 -0.264 17865
2115 1 4 . 1 1 25 25 ALA CA C 50 52.381 52.381 53.095 -0.714 17865
2116 1 4 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.105 -0.710 17865
2117 1 4 . 1 1 25 25 ALA H H 50 7.401 7.401 7.161 0.240 17865
2118 1 4 . 1 1 26 26 GLY N N 51 110.604 110.604 106.944 3.660 17865
2119 1 4 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.825 0.197 17865
2120 1 4 . 1 1 26 26 GLY H H 51 8.285 8.285 8.116 0.169 17865
2121 1 4 . 1 1 27 27 SER HA H 52 4.382 4.382 4.240 0.142 17865
2122 1 4 . 1 1 27 27 SER C C 52 175.774 175.774 176.030 -0.256 17865
2123 1 4 . 1 1 27 27 SER CA C 52 60.803 60.803 61.623 -0.820 17865
2124 1 4 . 1 1 27 27 SER CB C 52 62.827 62.827 62.877 -0.050 17865
2125 1 4 . 1 1 28 28 ARG N N 53 119.682 119.682 117.505 2.177 17865
2126 1 4 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.546 0.334 17865
2127 1 4 . 1 1 28 28 ARG C C 53 175.796 175.796 177.478 -1.682 17865
2128 1 4 . 1 1 28 28 ARG CA C 53 55.738 55.738 56.352 -0.614 17865
2129 1 4 . 1 1 28 28 ARG CB C 53 30.237 30.237 29.908 0.329 17865
2130 1 4 . 1 1 28 28 ARG H H 53 7.894 7.894 8.451 -0.557 17865
2131 1 4 . 1 1 29 29 GLU N N 54 122.318 122.318 121.929 0.389 17865
2132 1 4 . 1 1 29 29 GLU HA H 54 3.595 3.595 3.934 -0.339 17865
2133 1 4 . 1 1 29 29 GLU C C 54 177.523 177.523 178.311 -0.788 17865
2134 1 4 . 1 1 29 29 GLU CA C 54 61.223 61.223 59.662 1.561 17865
2135 1 4 . 1 1 29 29 GLU CB C 54 28.937 28.937 28.876 0.061 17865
2136 1 4 . 1 1 29 29 GLU H H 54 7.730 7.730 8.000 -0.270 17865
2137 1 4 . 1 1 30 30 LYS N N 55 118.377 118.377 117.426 0.951 17865
2138 1 4 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.040 -0.212 17865
2139 1 4 . 1 1 30 30 LYS C C 55 179.205 179.205 178.926 0.279 17865
2140 1 4 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.444 0.983 17865
2141 1 4 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.156 -0.555 17865
2142 1 4 . 1 1 30 30 LYS H H 55 8.659 8.659 7.708 0.951 17865
2143 1 4 . 1 1 31 31 ASP N N 56 121.614 121.614 120.194 1.420 17865
2144 1 4 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.678 -0.367 17865
2145 1 4 . 1 1 31 31 ASP C C 56 177.393 177.393 177.785 -0.392 17865
2146 1 4 . 1 1 31 31 ASP CA C 56 57.316 57.316 56.673 0.643 17865
2147 1 4 . 1 1 31 31 ASP CB C 56 40.423 40.423 41.312 -0.889 17865
2148 1 4 . 1 1 31 31 ASP H H 56 7.646 7.646 7.586 0.060 17865
2149 1 4 . 1 1 32 32 CYS N N 57 120.345 120.345 120.723 -0.378 17865
2150 1 4 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.830 -0.229 17865
2151 1 4 . 1 1 32 32 CYS C C 57 175.772 175.772 176.520 -0.748 17865
2152 1 4 . 1 1 32 32 CYS CA C 57 60.197 60.197 61.618 -1.421 17865
2153 1 4 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.907 8.059 17865
2154 1 4 . 1 1 32 32 CYS H H 57 8.042 8.042 8.621 -0.579 17865
2155 1 4 . 1 1 33 33 ARG N N 58 120.293 120.293 118.915 1.378 17865
2156 1 4 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.865 -0.189 17865
2157 1 4 . 1 1 33 33 ARG C C 58 179.633 179.633 178.552 1.081 17865
2158 1 4 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.535 0.851 17865
2159 1 4 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.234 0.607 17865
2160 1 4 . 1 1 33 33 ARG H H 58 8.531 8.531 8.478 0.053 17865
2161 1 4 . 1 1 34 34 LYS N N 59 121.166 121.166 119.707 1.459 17865
2162 1 4 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.144 -0.108 17865
2163 1 4 . 1 1 34 34 LYS C C 59 179.220 179.220 178.446 0.774 17865
2164 1 4 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.576 0.954 17865
2165 1 4 . 1 1 34 34 LYS CB C 59 32.110 32.110 31.968 0.142 17865
2166 1 4 . 1 1 34 34 LYS H H 59 7.633 7.633 7.495 0.138 17865
2167 1 4 . 1 1 35 35 ASP N N 60 122.166 122.166 120.370 1.796 17865
2168 1 4 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.449 -0.018 17865
2169 1 4 . 1 1 35 35 ASP C C 60 179.709 179.709 178.827 0.882 17865
2170 1 4 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.337 0.366 17865
2171 1 4 . 1 1 35 35 ASP CB C 60 40.672 40.672 41.079 -0.407 17865
2172 1 4 . 1 1 35 35 ASP H H 60 8.221 8.221 8.172 0.049 17865
2173 1 4 . 1 1 36 36 VAL N N 61 121.312 121.312 118.579 2.733 17865
2174 1 4 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.765 -0.364 17865
2175 1 4 . 1 1 36 36 VAL C C 61 178.339 178.339 176.409 1.930 17865
2176 1 4 . 1 1 36 36 VAL CA C 61 67.133 67.133 64.994 2.139 17865
2177 1 4 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.814 -0.157 17865
2178 1 4 . 1 1 36 36 VAL H H 61 8.916 8.916 8.118 0.798 17865
2179 1 4 . 1 1 37 37 GLN N N 62 119.166 119.166 116.644 2.522 17865
2180 1 4 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.124 -0.182 17865
2181 1 4 . 1 1 37 37 GLN C C 62 177.293 177.293 177.886 -0.593 17865
2182 1 4 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.915 0.365 17865
2183 1 4 . 1 1 37 37 GLN CB C 62 28.371 28.371 29.191 -0.820 17865
2184 1 4 . 1 1 37 37 GLN H H 62 7.697 7.697 7.481 0.216 17865
2185 1 4 . 1 1 38 38 ALA N N 63 118.964 118.964 122.288 -3.324 17865
2186 1 4 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.204 0.038 17865
2187 1 4 . 1 1 38 38 ALA C C 63 177.221 177.221 178.169 -0.948 17865
2188 1 4 . 1 1 38 38 ALA CA C 63 53.137 53.137 53.870 -0.733 17865
2189 1 4 . 1 1 38 38 ALA CB C 63 18.897 18.897 18.805 0.092 17865
2190 1 4 . 1 1 38 38 ALA H H 63 7.508 7.508 7.941 -0.433 17865
2191 1 4 . 1 1 39 39 CYS N N 64 119.081 119.081 118.131 0.950 17865
2192 1 4 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.342 0.611 17865
2193 1 4 . 1 1 39 39 CYS C C 64 172.052 172.052 175.180 -3.128 17865
2194 1 4 . 1 1 39 39 CYS CA C 64 51.880 51.880 59.010 -7.130 17865
2195 1 4 . 1 1 39 39 CYS CB C 64 34.328 34.328 24.425 9.903 17865
2196 1 4 . 1 1 39 39 CYS H H 64 7.354 7.354 7.798 -0.444 17865
2197 1 4 . 1 1 40 40 ASP N N 65 124.167 124.167 125.724 -1.557 17865
2198 1 4 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.430 -0.105 17865
2199 1 4 . 1 1 40 40 ASP C C 65 176.496 176.496 176.612 -0.116 17865
2200 1 4 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.703 0.021 17865
2201 1 4 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.525 -0.212 17865
2202 1 4 . 1 1 40 40 ASP H H 65 8.142 8.142 8.018 0.124 17865
2203 1 4 . 1 1 41 41 LYS N N 66 118.844 118.844 120.055 -1.211 17865
2204 1 4 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.394 0.130 17865
2205 1 4 . 1 1 41 41 LYS C C 66 175.586 175.586 176.679 -1.093 17865
2206 1 4 . 1 1 41 41 LYS CA C 66 55.275 55.275 55.703 -0.428 17865
2207 1 4 . 1 1 41 41 LYS CB C 66 32.598 32.598 32.346 0.251 17865
2208 1 4 . 1 1 41 41 LYS H H 66 7.858 7.858 8.277 -0.419 17865
2209 1 4 . 1 1 42 42 LYS N N 67 126.081 126.081 125.119 0.962 17865
2210 1 4 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.087 -0.172 17865
2211 1 4 . 1 1 42 42 LYS C C 67 174.665 174.665 175.066 -0.401 17865
2212 1 4 . 1 1 42 42 LYS CA C 67 57.827 57.827 57.877 -0.050 17865
2213 1 4 . 1 1 42 42 LYS CB C 67 34.059 34.059 33.068 0.991 17865
2214 1 4 . 1 1 42 42 LYS H H 67 8.790 8.790 8.327 0.463 17865
2215 1 4 . 1 1 43 43 TYR N N 68 114.138 114.138 114.333 -0.195 17865
2216 1 4 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.698 0.561 17865
2217 1 4 . 1 1 43 43 TYR C C 68 175.767 175.767 175.087 0.680 17865
2218 1 4 . 1 1 43 43 TYR CA C 68 55.880 55.880 56.860 -0.980 17865
2219 1 4 . 1 1 43 43 TYR CB C 68 42.363 42.363 42.161 0.202 17865
2220 1 4 . 1 1 43 43 TYR H H 68 7.294 7.294 7.450 -0.156 17865
2221 1 4 . 1 1 44 44 ASP N N 69 121.807 121.807 121.365 0.442 17865
2222 1 4 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.684 -0.044 17865
2223 1 4 . 1 1 44 44 ASP C C 69 177.812 177.812 177.396 0.416 17865
2224 1 4 . 1 1 44 44 ASP CA C 69 52.110 52.110 54.370 -2.260 17865
2225 1 4 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.003 -1.563 17865
2226 1 4 . 1 1 44 44 ASP H H 69 8.995 8.995 8.873 0.122 17865
2227 1 4 . 1 1 45 45 ASP N N 70 116.686 116.686 124.219 -7.533 17865
2228 1 4 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.467 -0.043 17865
2229 1 4 . 1 1 45 45 ASP C C 70 177.054 177.054 177.015 0.039 17865
2230 1 4 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.439 -0.058 17865
2231 1 4 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.941 -0.694 17865
2232 1 4 . 1 1 45 45 ASP H H 70 8.369 8.369 8.821 -0.452 17865
2233 1 4 . 1 1 46 46 GLN N N 71 117.949 117.949 117.164 0.785 17865
2234 1 4 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.377 0.079 17865
2235 1 4 . 1 1 46 46 GLN C C 71 176.273 176.273 176.839 -0.566 17865
2236 1 4 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.827 -0.460 17865
2237 1 4 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.073 0.257 17865
2238 1 4 . 1 1 46 46 GLN H H 71 8.274 8.274 8.526 -0.252 17865
2239 1 4 . 1 1 47 47 GLY N N 72 108.369 108.369 107.628 0.741 17865
2240 1 4 . 1 1 47 47 GLY C C 72 174.145 174.145 173.817 0.328 17865
2241 1 4 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.162 0.661 17865
2242 1 4 . 1 1 47 47 GLY H H 72 8.174 8.174 8.143 0.031 17865
2243 1 4 . 1 1 48 48 ARG N N 73 121.554 121.554 119.278 2.276 17865
2244 1 4 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.597 -0.112 17865
2245 1 4 . 1 1 48 48 ARG C C 73 176.855 176.855 175.908 0.947 17865
2246 1 4 . 1 1 48 48 ARG CA C 73 55.289 55.289 54.333 0.956 17865
2247 1 4 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.243 -0.685 17865
2248 1 4 . 1 1 48 48 ARG H H 73 8.462 8.462 7.928 0.534 17865
2249 1 4 . 1 1 49 49 GLU N N 74 122.784 122.784 120.544 2.240 17865
2250 1 4 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.306 0.177 17865
2251 1 4 . 1 1 49 49 GLU C C 74 178.098 178.098 176.891 1.207 17865
2252 1 4 . 1 1 49 49 GLU CA C 74 57.184 57.184 57.282 -0.099 17865
2253 1 4 . 1 1 49 49 GLU CB C 74 30.777 30.777 29.944 0.833 17865
2254 1 4 . 1 1 49 49 GLU H H 74 8.703 8.703 8.635 0.068 17865
2255 1 4 . 1 1 50 50 THR N N 75 114.563 114.563 115.556 -0.993 17865
2256 1 4 . 1 1 50 50 THR HA H 75 4.212 4.212 4.513 -0.301 17865
2257 1 4 . 1 1 50 50 THR C C 75 175.170 175.170 175.633 -0.463 17865
2258 1 4 . 1 1 50 50 THR CA C 75 60.589 60.589 60.223 0.366 17865
2259 1 4 . 1 1 50 50 THR CB C 75 70.952 70.952 71.291 -0.339 17865
2260 1 4 . 1 1 50 50 THR H H 75 7.717 7.717 8.082 -0.365 17865
2261 1 4 . 1 1 51 51 ALA N N 76 122.097 122.097 123.361 -1.264 17865
2262 1 4 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.026 0.012 17865
2263 1 4 . 1 1 51 51 ALA C C 76 181.906 181.906 179.032 2.874 17865
2264 1 4 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.116 0.538 17865
2265 1 4 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.359 -0.366 17865
2266 1 4 . 1 1 51 51 ALA H H 76 8.734 8.734 8.823 -0.089 17865
2267 1 4 . 1 1 52 52 CYS N N 77 115.347 115.347 115.529 -0.182 17865
2268 1 4 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.145 0.335 17865
2269 1 4 . 1 1 52 52 CYS C C 77 176.299 176.299 176.785 -0.486 17865
2270 1 4 . 1 1 52 52 CYS CA C 77 57.701 57.701 59.469 -1.768 17865
2271 1 4 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.692 9.939 17865
2272 1 4 . 1 1 52 52 CYS H H 77 9.073 9.073 8.214 0.859 17865
2273 1 4 . 1 1 53 53 ALA N N 78 128.517 128.517 124.113 4.404 17865
2274 1 4 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.870 -0.015 17865
2275 1 4 . 1 1 53 53 ALA C C 78 178.736 178.736 179.131 -0.395 17865
2276 1 4 . 1 1 53 53 ALA CA C 78 55.633 55.633 54.931 0.702 17865
2277 1 4 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.879 1.312 17865
2278 1 4 . 1 1 53 53 ALA H H 78 7.174 7.174 7.882 -0.708 17865
2279 1 4 . 1 1 54 54 LYS N N 79 118.706 118.706 119.111 -0.405 17865
2280 1 4 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.422 -0.619 17865
2281 1 4 . 1 1 54 54 LYS C C 79 179.611 179.611 179.106 0.505 17865
2282 1 4 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.573 1.152 17865
2283 1 4 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.654 -0.001 17865
2284 1 4 . 1 1 54 54 LYS H H 79 8.313 8.313 8.307 0.006 17865
2285 1 4 . 1 1 55 55 GLY N N 80 104.822 104.822 107.532 -2.710 17865
2286 1 4 . 1 1 55 55 GLY C C 80 176.504 176.504 176.047 0.457 17865
2287 1 4 . 1 1 55 55 GLY CA C 80 46.839 46.839 46.960 -0.121 17865
2288 1 4 . 1 1 55 55 GLY H H 80 8.175 8.175 7.736 0.439 17865
2289 1 4 . 1 1 56 56 ILE N N 81 123.697 123.697 122.972 0.725 17865
2290 1 4 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.916 -0.121 17865
2291 1 4 . 1 1 56 56 ILE C C 81 177.334 177.334 177.686 -0.352 17865
2292 1 4 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.584 0.697 17865
2293 1 4 . 1 1 56 56 ILE CB C 81 38.335 38.335 38.155 0.180 17865
2294 1 4 . 1 1 56 56 ILE H H 81 7.590 7.590 7.414 0.176 17865
2295 1 4 . 1 1 57 57 ARG N N 82 118.161 118.161 118.675 -0.514 17865
2296 1 4 . 1 1 57 57 ARG HA H 82 3.935 3.935 3.983 -0.048 17865
2297 1 4 . 1 1 57 57 ARG C C 82 178.662 178.662 178.353 0.309 17865
2298 1 4 . 1 1 57 57 ARG CA C 82 59.702 59.702 58.940 0.762 17865
2299 1 4 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.151 0.748 17865
2300 1 4 . 1 1 57 57 ARG H H 82 7.569 7.569 7.635 -0.066 17865
2301 1 4 . 1 1 58 58 GLU N N 83 115.085 115.085 118.140 -3.055 17865
2302 1 4 . 1 1 58 58 GLU HA H 83 4.031 4.031 3.917 0.114 17865
2303 1 4 . 1 1 58 58 GLU C C 83 178.224 178.224 177.874 0.350 17865
2304 1 4 . 1 1 58 58 GLU CA C 83 58.304 58.304 58.109 0.195 17865
2305 1 4 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.099 0.931 17865
2306 1 4 . 1 1 58 58 GLU H H 83 7.786 7.786 7.722 0.064 17865
2307 1 4 . 1 1 59 59 LYS N N 84 119.183 119.183 119.058 0.125 17865
2308 1 4 . 1 1 59 59 LYS HA H 84 3.830 3.830 3.872 -0.042 17865
2309 1 4 . 1 1 59 59 LYS C C 84 177.933 177.933 178.271 -0.338 17865
2310 1 4 . 1 1 59 59 LYS CA C 84 59.043 59.043 58.261 0.782 17865
2311 1 4 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.668 0.982 17865
2312 1 4 . 1 1 59 59 LYS H H 84 7.968 7.968 7.431 0.537 17865
2313 1 4 . 1 1 60 60 TYR N N 85 113.663 113.663 115.985 -2.322 17865
2314 1 4 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.562 0.141 17865
2315 1 4 . 1 1 60 60 TYR C C 85 174.729 174.729 174.360 0.369 17865
2316 1 4 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.458 0.744 17865
2317 1 4 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.138 0.764 17865
2318 1 4 . 1 1 60 60 TYR H H 85 7.562 7.562 7.718 -0.156 17865
2319 1 4 . 1 1 61 61 LYS N N 86 121.862 121.862 121.190 0.672 17865
2320 1 4 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.202 0.310 17865
2321 1 4 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.651 -0.709 17865
2322 1 4 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.234 -0.132 17865
2323 1 4 . 1 1 61 61 LYS H H 86 7.222 7.222 7.609 -0.387 17865
2324 1 4 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.375 -0.052 17865
2325 1 4 . 1 1 62 62 PRO C C 87 176.576 176.576 176.739 -0.163 17865
2326 1 4 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.466 0.554 17865
2327 1 4 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.471 -0.231 17865
2328 1 4 . 1 1 63 63 ALA N N 88 125.029 125.029 124.212 0.817 17865
2329 1 4 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.255 -0.001 17865
2330 1 4 . 1 1 63 63 ALA C C 88 177.301 177.301 176.569 0.732 17865
2331 1 4 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.306 -0.025 17865
2332 1 4 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.688 1.514 17865
2333 1 4 . 1 1 63 63 ALA H H 88 8.329 8.329 8.249 0.080 17865
2334 1 4 . 1 1 64 64 VAL N N 89 121.843 121.843 119.718 2.125 17865
2335 1 4 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.416 -0.472 17865
2336 1 4 . 1 1 64 64 VAL C C 89 174.791 174.791 174.225 0.566 17865
2337 1 4 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.463 1.518 17865
2338 1 4 . 1 1 64 64 VAL CB C 89 33.485 33.485 34.681 -1.196 17865
2339 1 4 . 1 1 64 64 VAL H H 89 8.075 8.075 7.805 0.270 17865
2340 1 4 . 1 1 65 65 VAL N N 90 125.399 125.399 122.298 3.101 17865
2341 1 4 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.332 -0.194 17865
2342 1 4 . 1 1 65 65 VAL C C 90 174.340 174.340 175.143 -0.803 17865
2343 1 4 . 1 1 65 65 VAL CA C 90 61.162 61.162 61.949 -0.787 17865
2344 1 4 . 1 1 65 65 VAL CB C 90 33.866 33.866 30.597 3.269 17865
2345 1 4 . 1 1 65 65 VAL H H 90 8.229 8.229 8.228 0.001 17865
2346 1 4 . 1 1 66 66 TYR N N 91 124.848 124.848 127.211 -2.363 17865
2347 1 4 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.482 0.289 17865
2348 1 4 . 1 1 66 66 TYR C C 91 176.658 176.658 175.885 0.773 17865
2349 1 4 . 1 1 66 66 TYR CA C 91 58.084 58.084 58.572 -0.488 17865
2350 1 4 . 1 1 66 66 TYR CB C 91 41.535 41.535 40.809 0.726 17865
2351 1 4 . 1 1 66 66 TYR H H 91 9.145 9.145 8.198 0.947 17865
2352 1 4 . 1 1 67 67 GLY N N 92 106.185 106.185 106.309 -0.124 17865
2353 1 4 . 1 1 67 67 GLY C C 92 175.681 175.681 174.729 0.952 17865
2354 1 4 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.313 0.662 17865
2355 1 4 . 1 1 67 67 GLY H H 92 8.730 8.730 8.676 0.054 17865
2356 1 4 . 1 1 68 68 TYR N N 93 121.815 121.815 117.553 4.262 17865
2357 1 4 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.324 -0.349 17865
2358 1 4 . 1 1 68 68 TYR C C 93 176.035 176.035 176.154 -0.119 17865
2359 1 4 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.767 1.279 17865
2360 1 4 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.330 0.095 17865
2361 1 4 . 1 1 68 68 TYR H H 93 8.711 8.711 8.804 -0.093 17865
2362 1 4 . 1 1 69 69 ASP N N 94 115.507 115.507 118.984 -3.477 17865
2363 1 4 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.305 -0.017 17865
2364 1 4 . 1 1 69 69 ASP C C 94 177.063 177.063 176.989 0.074 17865
2365 1 4 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.809 -0.798 17865
2366 1 4 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.603 -0.436 17865
2367 1 4 . 1 1 69 69 ASP H H 94 8.010 8.010 7.820 0.190 17865
2368 1 4 . 1 1 70 70 GLY N N 95 107.196 107.196 107.227 -0.031 17865
2369 1 4 . 1 1 70 70 GLY C C 95 173.936 173.936 172.748 1.188 17865
2370 1 4 . 1 1 70 70 GLY CA C 95 45.392 45.392 45.234 0.157 17865
2371 1 4 . 1 1 70 70 GLY H H 95 7.986 7.986 7.923 0.063 17865
2372 1 4 . 1 1 71 71 LYS N N 96 121.258 121.258 117.690 3.568 17865
2373 1 4 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.955 -0.171 17865
2374 1 4 . 1 1 71 71 LYS CA C 96 54.114 54.114 52.444 1.670 17865
2375 1 4 . 1 1 71 71 LYS CB C 96 31.762 31.762 34.041 -2.279 17865
2376 1 4 . 1 1 71 71 LYS H H 96 7.877 7.877 7.397 0.480 17865
2377 1 4 . 1 1 72 72 PRO C C 97 177.170 177.170 175.666 1.504 17865
2378 1 4 . 1 1 72 72 PRO CA C 97 63.137 63.137 62.912 0.225 17865
2379 1 4 . 1 1 72 72 PRO CB C 97 32.240 32.240 30.575 1.665 17865
2380 1 4 . 1 1 73 73 LEU N N 98 123.503 123.503 120.999 2.504 17865
2381 1 4 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.738 -0.378 17865
2382 1 4 . 1 1 73 73 LEU C C 98 176.354 176.354 175.277 1.077 17865
2383 1 4 . 1 1 73 73 LEU CA C 98 53.927 53.927 52.641 1.286 17865
2384 1 4 . 1 1 73 73 LEU CB C 98 42.272 42.272 45.715 -3.443 17865
2385 1 4 . 1 1 73 73 LEU H H 98 8.850 8.850 7.860 0.990 17865
2386 1 4 . 1 1 74 74 ASP N N 99 122.212 122.212 124.246 -2.034 17865
2387 1 4 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.624 -0.027 17865
2388 1 4 . 1 1 74 74 ASP C C 99 175.819 175.819 176.383 -0.564 17865
2389 1 4 . 1 1 74 74 ASP CA C 99 53.856 53.856 55.575 -1.719 17865
2390 1 4 . 1 1 74 74 ASP CB C 99 40.989 40.989 42.250 -1.261 17865
2391 1 4 . 1 1 74 74 ASP H H 99 8.517 8.517 8.636 -0.119 17865
2392 1 4 . 1 1 75 75 LEU N N 100 125.874 125.874 116.859 9.015 17865
2393 1 4 . 1 1 75 75 LEU HA H 100 4.366 4.366 3.807 0.559 17865
2394 1 4 . 1 1 75 75 LEU C C 100 178.426 178.426 177.133 1.293 17865
2395 1 4 . 1 1 75 75 LEU CA C 100 53.631 53.631 55.554 -1.923 17865
2396 1 4 . 1 1 75 75 LEU CB C 100 40.676 40.676 38.884 1.792 17865
2397 1 4 . 1 1 75 75 LEU H H 100 8.281 8.281 8.506 -0.225 17865
2398 1 4 . 1 1 76 76 GLY N N 101 110.604 110.604 108.976 1.628 17865
2399 1 4 . 1 1 76 76 GLY C C 101 176.936 176.936 174.872 2.064 17865
2400 1 4 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.181 0.646 17865
2401 1 4 . 1 1 76 76 GLY H H 101 8.914 8.914 8.249 0.665 17865
2402 1 4 . 1 1 77 77 PHE N N 102 117.639 117.639 114.609 3.030 17865
2403 1 4 . 1 1 77 77 PHE HA H 102 4.381 4.381 5.133 -0.752 17865
2404 1 4 . 1 1 77 77 PHE C C 102 177.878 177.878 175.175 2.703 17865
2405 1 4 . 1 1 77 77 PHE CA C 102 59.139 59.139 55.974 3.164 17865
2406 1 4 . 1 1 77 77 PHE CB C 102 36.935 36.935 38.294 -1.359 17865
2407 1 4 . 1 1 77 77 PHE H H 102 7.992 7.992 7.801 0.191 17865
2408 1 4 . 1 1 78 78 CYS N N 103 121.136 121.136 118.761 2.375 17865
2409 1 4 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.320 0.065 17865
2410 1 4 . 1 1 78 78 CYS C C 103 172.780 172.780 176.939 -4.159 17865
2411 1 4 . 1 1 78 78 CYS CA C 103 53.696 53.696 58.816 -5.120 17865
2412 1 4 . 1 1 78 78 CYS CB C 103 34.237 34.237 27.026 7.211 17865
2413 1 4 . 1 1 78 78 CYS H H 103 7.362 7.362 7.868 -0.506 17865
2414 1 4 . 1 1 79 79 THR N N 104 114.773 114.773 118.880 -4.107 17865
2415 1 4 . 1 1 79 79 THR HA H 104 3.984 3.984 4.295 -0.311 17865
2416 1 4 . 1 1 79 79 THR C C 104 176.624 176.624 176.420 0.204 17865
2417 1 4 . 1 1 79 79 THR CA C 104 65.180 65.180 66.343 -1.163 17865
2418 1 4 . 1 1 79 79 THR CB C 104 69.062 69.062 68.735 0.327 17865
2419 1 4 . 1 1 79 79 THR H H 104 7.864 7.864 7.775 0.089 17865
2420 1 4 . 1 1 80 80 LEU N N 105 119.785 119.785 118.078 1.707 17865
2421 1 4 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.185 0.146 17865
2422 1 4 . 1 1 80 80 LEU C C 105 177.208 177.208 177.160 0.048 17865
2423 1 4 . 1 1 80 80 LEU CA C 105 55.453 55.453 55.351 0.102 17865
2424 1 4 . 1 1 80 80 LEU CB C 105 41.293 41.293 40.999 0.294 17865
2425 1 4 . 1 1 80 80 LEU H H 105 7.238 7.238 8.245 -1.007 17865
2426 1 4 . 1 1 81 81 ALA N N 106 119.309 119.309 119.841 -0.532 17865
2427 1 4 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.655 -0.128 17865
2428 1 4 . 1 1 81 81 ALA C C 106 178.769 178.769 177.894 0.875 17865
2429 1 4 . 1 1 81 81 ALA CA C 106 52.049 52.049 51.444 0.605 17865
2430 1 4 . 1 1 81 81 ALA CB C 106 18.820 18.820 20.754 -1.934 17865
2431 1 4 . 1 1 81 81 ALA H H 106 7.432 7.432 7.676 -0.244 17865
2432 1 4 . 1 1 82 82 GLY N N 107 109.793 109.793 109.361 0.432 17865
2433 1 4 . 1 1 82 82 GLY CA C 107 47.119 47.119 46.526 0.593 17865
2434 1 4 . 1 1 82 82 GLY H H 107 7.918 7.918 7.814 0.104 17865
2435 1 4 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.867 0.399 17865
2436 1 4 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.208 0.055 17865
2437 1 4 . 1 1 83 83 ILE CB C 108 38.261 38.261 37.996 0.265 17865
2438 1 4 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.126 0.629 17865
2439 1 4 . 1 1 84 84 ARG C C 109 181.344 181.344 177.428 3.916 17865
2440 1 4 . 1 1 84 84 ARG CA C 109 55.939 55.939 57.088 -1.149 17865
2441 1 4 . 1 1 84 84 ARG CB C 109 30.283 30.283 28.879 1.404 17865
2442 1 4 . 1 1 85 85 GLU N N 110 122.944 122.944 121.379 1.565 17865
2443 1 4 . 1 1 85 85 GLU HA H 110 3.617 3.617 3.976 -0.359 17865
2444 1 4 . 1 1 85 85 GLU C C 110 177.797 177.797 177.702 0.095 17865
2445 1 4 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.507 1.221 17865
2446 1 4 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.558 -0.687 17865
2447 1 4 . 1 1 85 85 GLU H H 110 8.003 8.003 7.505 0.498 17865
2448 1 4 . 1 1 86 86 VAL N N 111 117.101 117.101 117.944 -0.843 17865
2449 1 4 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.663 -0.152 17865
2450 1 4 . 1 1 86 86 VAL C C 111 177.710 177.710 178.295 -0.585 17865
2451 1 4 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.161 0.269 17865
2452 1 4 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.203 0.010 17865
2453 1 4 . 1 1 86 86 VAL H H 111 8.106 8.106 7.358 0.748 17865
2454 1 4 . 1 1 87 87 ASP N N 112 122.242 122.242 118.573 3.669 17865
2455 1 4 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.504 -0.200 17865
2456 1 4 . 1 1 87 87 ASP C C 112 176.912 176.912 178.106 -1.194 17865
2457 1 4 . 1 1 87 87 ASP CA C 112 57.417 57.417 56.620 0.797 17865
2458 1 4 . 1 1 87 87 ASP CB C 112 40.476 40.476 41.174 -0.698 17865
2459 1 4 . 1 1 87 87 ASP H H 112 7.401 7.401 8.109 -0.708 17865
2460 1 4 . 1 1 88 88 CYS N N 113 120.819 120.819 119.255 1.564 17865
2461 1 4 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.123 -0.814 17865
2462 1 4 . 1 1 88 88 CYS C C 113 175.270 175.270 176.557 -1.287 17865
2463 1 4 . 1 1 88 88 CYS CA C 113 59.759 59.759 61.922 -2.163 17865
2464 1 4 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.516 7.319 17865
2465 1 4 . 1 1 88 88 CYS H H 113 7.785 7.785 8.198 -0.413 17865
2466 1 4 . 1 1 89 89 ARG N N 114 118.654 118.654 118.907 -0.253 17865
2467 1 4 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.071 -0.430 17865
2468 1 4 . 1 1 89 89 ARG C C 114 179.018 179.018 177.843 1.175 17865
2469 1 4 . 1 1 89 89 ARG CA C 114 60.193 60.193 58.500 1.693 17865
2470 1 4 . 1 1 89 89 ARG CB C 114 29.713 29.713 29.042 0.671 17865
2471 1 4 . 1 1 89 89 ARG H H 114 8.142 8.142 7.652 0.490 17865
2472 1 4 . 1 1 90 90 LYS N N 115 120.964 120.964 119.046 1.918 17865
2473 1 4 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.216 -0.186 17865
2474 1 4 . 1 1 90 90 LYS C C 115 180.092 180.092 178.932 1.160 17865
2475 1 4 . 1 1 90 90 LYS CA C 115 59.568 59.568 58.925 0.643 17865
2476 1 4 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.467 -0.246 17865
2477 1 4 . 1 1 90 90 LYS H H 115 7.936 7.936 7.697 0.239 17865
2478 1 4 . 1 1 91 91 ASP N N 116 121.690 121.690 120.018 1.672 17865
2479 1 4 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.613 -0.100 17865
2480 1 4 . 1 1 91 91 ASP C C 116 179.419 179.419 178.258 1.161 17865
2481 1 4 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.938 0.299 17865
2482 1 4 . 1 1 91 91 ASP CB C 116 40.648 40.648 40.970 -0.322 17865
2483 1 4 . 1 1 91 91 ASP H H 116 8.558 8.558 7.743 0.815 17865
2484 1 4 . 1 1 92 92 ALA N N 117 122.784 122.784 123.422 -0.638 17865
2485 1 4 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.156 -0.133 17865
2486 1 4 . 1 1 92 92 ALA C C 117 178.789 178.789 179.377 -0.588 17865
2487 1 4 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.279 -0.228 17865
2488 1 4 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.529 0.646 17865
2489 1 4 . 1 1 92 92 ALA H H 117 8.703 8.703 7.838 0.865 17865
2490 1 4 . 1 1 93 93 GLN N N 118 115.510 115.510 115.995 -0.485 17865
2491 1 4 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.221 -0.277 17865
2492 1 4 . 1 1 93 93 GLN C C 118 178.745 178.745 177.848 0.897 17865
2493 1 4 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.417 1.065 17865
2494 1 4 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.303 0.094 17865
2495 1 4 . 1 1 93 93 GLN H H 118 7.664 7.664 8.405 -0.741 17865
2496 1 4 . 1 1 94 94 THR N N 119 110.110 110.110 116.231 -6.121 17865
2497 1 4 . 1 1 94 94 THR HA H 119 4.237 4.237 4.163 0.074 17865
2498 1 4 . 1 1 94 94 THR C C 119 175.861 175.861 175.117 0.744 17865
2499 1 4 . 1 1 94 94 THR CA C 119 64.604 64.604 65.087 -0.483 17865
2500 1 4 . 1 1 94 94 THR CB C 119 69.716 69.716 69.033 0.683 17865
2501 1 4 . 1 1 94 94 THR H H 119 7.726 7.726 7.740 -0.014 17865
2502 1 4 . 1 1 95 95 CYS N N 120 118.523 118.523 119.712 -1.189 17865
2503 1 4 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.637 0.096 17865
2504 1 4 . 1 1 95 95 CYS C C 120 175.165 175.165 174.752 0.413 17865
2505 1 4 . 1 1 95 95 CYS CA C 120 52.973 52.973 58.058 -5.085 17865
2506 1 4 . 1 1 95 95 CYS CB C 120 36.731 36.731 25.762 10.969 17865
2507 1 4 . 1 1 95 95 CYS H H 120 7.756 7.756 7.675 0.081 17865
2508 1 4 . 1 1 96 96 ASP N N 121 119.081 119.081 122.646 -3.565 17865
2509 1 4 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.467 0.211 17865
2510 1 4 . 1 1 96 96 ASP CA C 121 56.224 56.224 56.776 -0.552 17865
2511 1 4 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.300 1.431 17865
2512 1 4 . 1 1 96 96 ASP H H 121 7.354 7.354 7.985 -0.631 17865
2513 1 4 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.426 -0.851 17865
2514 1 4 . 1 1 97 97 LYS C C 122 175.510 175.510 176.903 -1.393 17865
2515 1 4 . 1 1 97 97 LYS CA C 122 57.839 57.839 56.963 0.876 17865
2516 1 4 . 1 1 97 97 LYS CB C 122 30.750 30.750 33.487 -2.737 17865
2517 1 4 . 1 1 98 98 LYS N N 123 119.980 119.980 118.345 1.635 17865
2518 1 4 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.357 -0.063 17865
2519 1 4 . 1 1 98 98 LYS C C 123 176.968 176.968 179.056 -2.088 17865
2520 1 4 . 1 1 98 98 LYS CA C 123 55.904 55.904 56.757 -0.853 17865
2521 1 4 . 1 1 98 98 LYS CB C 123 33.232 33.232 32.980 0.252 17865
2522 1 4 . 1 1 98 98 LYS H H 123 7.799 7.799 7.553 0.246 17865
2523 1 4 . 1 1 99 99 TYR N N 124 122.378 122.378 118.463 3.915 17865
2524 1 4 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.548 -0.653 17865
2525 1 4 . 1 1 99 99 TYR C C 124 177.126 177.126 176.821 0.305 17865
2526 1 4 . 1 1 99 99 TYR CA C 124 60.211 60.211 59.282 0.929 17865
2527 1 4 . 1 1 99 99 TYR CB C 124 38.271 38.271 37.661 0.610 17865
2528 1 4 . 1 1 99 99 TYR H H 124 8.536 8.536 7.198 1.338 17865
2529 1 4 . 1 1 100 100 GLU N N 125 118.610 118.610 118.959 -0.349 17865
2530 1 4 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.386 -0.118 17865
2531 1 4 . 1 1 100 100 GLU C C 125 177.387 177.387 178.605 -1.218 17865
2532 1 4 . 1 1 100 100 GLU CA C 125 55.759 55.759 57.388 -1.629 17865
2533 1 4 . 1 1 100 100 GLU CB C 125 27.321 27.321 28.120 -0.799 17865
2534 1 4 . 1 1 100 100 GLU H H 125 8.385 8.385 8.640 -0.255 17865
2535 1 4 . 1 1 101 101 SER N N 126 115.949 115.949 116.323 -0.374 17865
2536 1 4 . 1 1 101 101 SER HA H 126 3.959 3.959 4.133 -0.174 17865
2537 1 4 . 1 1 101 101 SER C C 126 176.047 176.047 175.802 0.245 17865
2538 1 4 . 1 1 101 101 SER CA C 126 62.439 62.439 62.277 0.162 17865
2539 1 4 . 1 1 101 101 SER CB C 126 63.299 63.299 63.042 0.257 17865
2540 1 4 . 1 1 101 101 SER H H 126 7.823 7.823 7.553 0.270 17865
2541 1 4 . 1 1 102 102 ASP N N 127 120.920 120.920 120.942 -0.022 17865
2542 1 4 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.350 0.057 17865
2543 1 4 . 1 1 102 102 ASP C C 127 178.234 178.234 178.358 -0.124 17865
2544 1 4 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.647 -0.236 17865
2545 1 4 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.438 -0.722 17865
2546 1 4 . 1 1 102 102 ASP H H 127 8.683 8.683 8.042 0.641 17865
2547 1 4 . 1 1 103 103 LYS N N 128 121.753 121.753 118.952 2.801 17865
2548 1 4 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.135 -0.131 17865
2549 1 4 . 1 1 103 103 LYS C C 128 179.395 179.395 179.042 0.353 17865
2550 1 4 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.452 1.019 17865
2551 1 4 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.717 0.684 17865
2552 1 4 . 1 1 103 103 LYS H H 128 7.771 7.771 8.224 -0.453 17865
2553 1 4 . 1 1 104 104 CYS N N 129 120.109 120.109 120.095 0.014 17865
2554 1 4 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.270 -0.076 17865
2555 1 4 . 1 1 104 104 CYS C C 129 176.779 176.779 176.728 0.051 17865
2556 1 4 . 1 1 104 104 CYS CA C 129 59.790 59.790 61.733 -1.943 17865
2557 1 4 . 1 1 104 104 CYS CB C 129 36.879 36.879 26.288 10.591 17865
2558 1 4 . 1 1 104 104 CYS H H 129 7.973 7.973 8.168 -0.195 17865
2559 1 4 . 1 1 105 105 LEU N N 130 121.804 121.804 122.284 -0.480 17865
2560 1 4 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.984 0.106 17865
2561 1 4 . 1 1 105 105 LEU C C 130 179.373 179.373 178.592 0.781 17865
2562 1 4 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.642 -1.274 17865
2563 1 4 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.694 0.404 17865
2564 1 4 . 1 1 105 105 LEU H H 130 8.666 8.666 8.539 0.127 17865
2565 1 4 . 1 1 106 106 ASN N N 131 118.535 118.535 116.005 2.530 17865
2566 1 4 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.534 -0.296 17865
2567 1 4 . 1 1 106 106 ASN C C 131 177.830 177.830 177.135 0.695 17865
2568 1 4 . 1 1 106 106 ASN CA C 131 56.256 56.256 55.603 0.653 17865
2569 1 4 . 1 1 106 106 ASN CB C 131 37.817 37.817 37.935 -0.118 17865
2570 1 4 . 1 1 106 106 ASN H H 131 8.438 8.438 7.954 0.484 17865
2571 1 4 . 1 1 107 107 ALA N N 132 121.485 121.485 121.315 0.170 17865
2572 1 4 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.272 -0.053 17865
2573 1 4 . 1 1 107 107 ALA C C 132 180.726 180.726 178.677 2.049 17865
2574 1 4 . 1 1 107 107 ALA CA C 132 54.963 54.963 53.976 0.987 17865
2575 1 4 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.868 -1.047 17865
2576 1 4 . 1 1 107 107 ALA H H 132 7.541 7.541 7.218 0.323 17865
2577 1 4 . 1 1 108 108 ILE N N 133 120.979 120.979 116.336 4.643 17865
2578 1 4 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.908 0.023 17865
2579 1 4 . 1 1 108 108 ILE C C 133 178.114 178.114 177.418 0.696 17865
2580 1 4 . 1 1 108 108 ILE CA C 133 63.353 63.353 61.913 1.440 17865
2581 1 4 . 1 1 108 108 ILE CB C 133 36.454 36.454 37.404 -0.951 17865
2582 1 4 . 1 1 108 108 ILE H H 133 7.551 7.551 7.823 -0.272 17865
2583 1 4 . 1 1 109 109 LYS N N 134 121.415 121.415 118.767 2.648 17865
2584 1 4 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.160 -0.572 17865
2585 1 4 . 1 1 109 109 LYS C C 134 179.561 179.561 179.003 0.558 17865
2586 1 4 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.435 0.673 17865
2587 1 4 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.375 -0.214 17865
2588 1 4 . 1 1 109 109 LYS H H 134 8.414 8.414 7.462 0.952 17865
2589 1 4 . 1 1 110 110 GLU N N 135 116.099 116.099 118.600 -2.501 17865
2590 1 4 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.222 -0.293 17865
2591 1 4 . 1 1 110 110 GLU C C 135 178.239 178.239 178.605 -0.366 17865
2592 1 4 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.707 -0.061 17865
2593 1 4 . 1 1 110 110 GLU CB C 135 29.638 29.638 29.016 0.622 17865
2594 1 4 . 1 1 110 110 GLU H H 135 7.473 7.473 8.060 -0.587 17865
2595 1 4 . 1 1 111 111 LYS N N 136 119.805 119.805 119.772 0.033 17865
2596 1 4 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.166 -0.260 17865
2597 1 4 . 1 1 111 111 LYS C C 136 177.600 177.600 177.228 0.372 17865
2598 1 4 . 1 1 111 111 LYS CA C 136 58.749 58.749 58.070 0.679 17865
2599 1 4 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.194 1.044 17865
2600 1 4 . 1 1 111 111 LYS H H 136 7.540 7.540 7.685 -0.145 17865
2601 1 4 . 1 1 112 112 TYR N N 137 114.768 114.768 117.503 -2.735 17865
2602 1 4 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.686 -0.163 17865
2603 1 4 . 1 1 112 112 TYR C C 137 174.690 174.690 174.262 0.428 17865
2604 1 4 . 1 1 112 112 TYR CA C 137 58.359 58.359 56.379 1.980 17865
2605 1 4 . 1 1 112 112 TYR CB C 137 38.328 38.328 37.855 0.473 17865
2606 1 4 . 1 1 112 112 TYR H H 137 7.488 7.488 7.668 -0.180 17865
2607 1 4 . 1 1 113 113 LYS N N 138 123.694 123.694 121.468 2.226 17865
2608 1 4 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.294 0.207 17865
2609 1 4 . 1 1 113 113 LYS CA C 138 55.282 55.282 55.952 -0.670 17865
2610 1 4 . 1 1 113 113 LYS CB C 138 32.124 32.124 31.778 0.346 17865
2611 1 4 . 1 1 113 113 LYS H H 138 7.217 7.217 7.219 -0.002 17865
2612 1 4 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.523 -0.071 17865
2613 1 4 . 1 1 114 114 PRO C C 139 176.974 176.974 175.935 1.039 17865
2614 1 4 . 1 1 114 114 PRO CA C 139 63.189 63.189 63.098 0.091 17865
2615 1 4 . 1 1 114 114 PRO CB C 139 32.251 32.251 30.276 1.975 17865
2616 1 4 . 1 1 115 115 VAL N N 140 121.098 121.098 115.548 5.550 17865
2617 1 4 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.139 -0.037 17865
2618 1 4 . 1 1 115 115 VAL C C 140 176.207 176.207 175.482 0.725 17865
2619 1 4 . 1 1 115 115 VAL CA C 140 62.356 62.356 62.266 0.090 17865
2620 1 4 . 1 1 115 115 VAL CB C 140 33.256 33.256 31.992 1.264 17865
2621 1 4 . 1 1 115 115 VAL H H 140 8.272 8.272 8.063 0.209 17865
2622 1 4 . 1 1 116 116 VAL N N 141 124.167 124.167 123.491 0.676 17865
2623 1 4 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.230 -0.108 17865
2624 1 4 . 1 1 116 116 VAL C C 141 175.415 175.415 175.348 0.067 17865
2625 1 4 . 1 1 116 116 VAL CA C 141 61.731 61.731 61.598 0.133 17865
2626 1 4 . 1 1 116 116 VAL CB C 141 33.145 33.145 31.656 1.489 17865
2627 1 4 . 1 1 116 116 VAL H H 141 8.142 8.142 7.470 0.672 17865
2628 1 4 . 1 1 117 117 ASP N N 142 126.737 126.737 128.071 -1.334 17865
2629 1 4 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.954 -0.142 17865
2630 1 4 . 1 1 117 117 ASP CA C 142 52.217 52.217 51.775 0.442 17865
2631 1 4 . 1 1 117 117 ASP CB C 142 41.368 41.368 41.343 0.025 17865
2632 1 4 . 1 1 117 117 ASP H H 142 8.419 8.419 8.405 0.014 17865
2633 1 4 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.353 0.058 17865
2634 1 4 . 1 1 118 118 PRO C C 143 176.662 176.662 176.595 0.067 17865
2635 1 4 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.218 0.029 17865
2636 1 4 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.320 -0.010 17865
2637 1 4 . 1 1 119 119 ASN N N 144 119.287 119.287 116.675 2.612 17865
2638 1 4 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.950 -0.003 17865
2639 1 4 . 1 1 119 119 ASN CA C 144 51.633 51.633 51.551 0.082 17865
2640 1 4 . 1 1 119 119 ASN CB C 144 38.859 38.859 39.912 -1.053 17865
2641 1 4 . 1 1 119 119 ASN H H 144 8.432 8.432 8.162 0.270 17865
2642 1 4 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.777 -0.097 17865
2643 1 4 . 1 1 120 120 PRO CA C 145 61.640 61.640 61.959 -0.319 17865
2644 1 4 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.318 -0.400 17865
2645 1 4 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.381 -0.004 17865
2646 1 4 . 1 1 121 121 PRO C C 146 175.876 175.876 176.550 -0.674 17865
2647 1 4 . 1 1 121 121 PRO CA C 146 63.174 63.174 62.681 0.493 17865
2648 1 4 . 1 1 121 121 PRO CB C 146 31.939 31.939 31.895 0.044 17865
2649 1 5 . 1 1 2 2 ASP N N 27 121.041 121.041 126.006 -4.965 17865
2650 1 5 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.627 0.011 17865
2651 1 5 . 1 1 2 2 ASP C C 27 175.878 175.878 175.448 0.430 17865
2652 1 5 . 1 1 2 2 ASP CA C 27 54.382 54.382 53.585 0.797 17865
2653 1 5 . 1 1 2 2 ASP CB C 27 41.729 41.729 40.938 0.791 17865
2654 1 5 . 1 1 2 2 ASP H H 27 8.639 8.639 8.272 0.367 17865
2655 1 5 . 1 1 3 3 VAL N N 28 119.901 119.901 120.695 -0.794 17865
2656 1 5 . 1 1 3 3 VAL HA H 28 4.033 4.033 3.613 0.420 17865
2657 1 5 . 1 1 3 3 VAL C C 28 175.521 175.521 175.638 -0.117 17865
2658 1 5 . 1 1 3 3 VAL CA C 28 62.216 62.216 62.418 -0.202 17865
2659 1 5 . 1 1 3 3 VAL CB C 28 33.003 33.003 30.966 2.037 17865
2660 1 5 . 1 1 3 3 VAL H H 28 8.113 8.113 8.092 0.021 17865
2661 1 5 . 1 1 4 4 PHE N N 29 123.707 123.707 124.517 -0.810 17865
2662 1 5 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.447 0.209 17865
2663 1 5 . 1 1 4 4 PHE C C 29 174.874 174.874 175.530 -0.656 17865
2664 1 5 . 1 1 4 4 PHE CA C 29 57.159 57.159 57.338 -0.179 17865
2665 1 5 . 1 1 4 4 PHE CB C 29 39.795 39.795 39.675 0.119 17865
2666 1 5 . 1 1 4 4 PHE H H 29 8.255 8.255 8.068 0.187 17865
2667 1 5 . 1 1 5 5 ASP N N 30 124.203 124.203 121.076 3.127 17865
2668 1 5 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.693 0.145 17865
2669 1 5 . 1 1 5 5 ASP CA C 30 52.385 52.385 53.275 -0.890 17865
2670 1 5 . 1 1 5 5 ASP CB C 30 40.801 40.801 40.406 0.395 17865
2671 1 5 . 1 1 5 5 ASP H H 30 8.226 8.226 8.473 -0.247 17865
2672 1 5 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.851 -0.314 17865
2673 1 5 . 1 1 6 6 PRO CA C 31 61.664 61.664 61.816 -0.151 17865
2674 1 5 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.426 -0.600 17865
2675 1 5 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.524 -0.098 17865
2676 1 5 . 1 1 7 7 PRO C C 32 177.226 177.226 176.668 0.558 17865
2677 1 5 . 1 1 7 7 PRO CA C 32 63.169 63.169 61.707 1.462 17865
2678 1 5 . 1 1 7 7 PRO CB C 32 31.948 31.948 33.648 -1.700 17865
2679 1 5 . 1 1 8 8 THR N N 33 114.158 114.158 111.903 2.255 17865
2680 1 5 . 1 1 8 8 THR HA H 33 4.195 4.195 3.975 0.220 17865
2681 1 5 . 1 1 8 8 THR C C 33 174.468 174.468 174.765 -0.297 17865
2682 1 5 . 1 1 8 8 THR CA C 33 62.110 62.110 62.032 0.078 17865
2683 1 5 . 1 1 8 8 THR CB C 33 69.975 69.975 69.033 0.942 17865
2684 1 5 . 1 1 8 8 THR H H 33 8.096 8.096 8.244 -0.148 17865
2685 1 5 . 1 1 9 9 GLN N N 34 122.411 122.411 116.976 5.435 17865
2686 1 5 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.143 0.120 17865
2687 1 5 . 1 1 9 9 GLN C C 34 175.445 175.445 174.930 0.515 17865
2688 1 5 . 1 1 9 9 GLN CA C 34 55.763 55.763 55.282 0.481 17865
2689 1 5 . 1 1 9 9 GLN CB C 34 29.691 29.691 27.456 2.235 17865
2690 1 5 . 1 1 9 9 GLN H H 34 8.278 8.278 7.934 0.344 17865
2691 1 5 . 1 1 10 10 TYR N N 35 121.048 121.048 116.332 4.716 17865
2692 1 5 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.444 0.076 17865
2693 1 5 . 1 1 10 10 TYR C C 35 176.314 176.314 176.296 0.018 17865
2694 1 5 . 1 1 10 10 TYR CA C 35 57.972 57.972 56.543 1.429 17865
2695 1 5 . 1 1 10 10 TYR CB C 35 38.936 38.936 39.879 -0.943 17865
2696 1 5 . 1 1 10 10 TYR H H 35 8.227 8.227 7.139 1.088 17865
2697 1 5 . 1 1 11 11 GLY N N 36 109.711 109.711 107.140 2.571 17865
2698 1 5 . 1 1 11 11 GLY C C 36 174.128 174.128 173.838 0.290 17865
2699 1 5 . 1 1 11 11 GLY CA C 36 45.212 45.212 46.151 -0.939 17865
2700 1 5 . 1 1 11 11 GLY H H 36 8.247 8.247 8.749 -0.502 17865
2701 1 5 . 1 1 12 12 TYR N N 37 120.302 120.302 115.790 4.512 17865
2702 1 5 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.757 -0.275 17865
2703 1 5 . 1 1 12 12 TYR C C 37 175.864 175.864 174.042 1.822 17865
2704 1 5 . 1 1 12 12 TYR CA C 37 58.541 58.541 57.178 1.363 17865
2705 1 5 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.979 -1.264 17865
2706 1 5 . 1 1 12 12 TYR H H 37 8.101 8.101 7.424 0.677 17865
2707 1 5 . 1 1 13 13 ASP N N 38 121.883 121.883 120.204 1.679 17865
2708 1 5 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.273 0.213 17865
2709 1 5 . 1 1 13 13 ASP C C 38 176.538 176.538 176.078 0.460 17865
2710 1 5 . 1 1 13 13 ASP CA C 38 54.223 54.223 54.017 0.206 17865
2711 1 5 . 1 1 13 13 ASP CB C 38 40.988 40.988 43.204 -2.216 17865
2712 1 5 . 1 1 13 13 ASP H H 38 8.266 8.266 6.700 1.566 17865
2713 1 5 . 1 1 14 14 GLY N N 39 107.705 107.705 114.369 -6.664 17865
2714 1 5 . 1 1 14 14 GLY C C 39 173.822 173.822 173.850 -0.028 17865
2715 1 5 . 1 1 14 14 GLY CA C 39 45.404 45.404 45.481 -0.077 17865
2716 1 5 . 1 1 14 14 GLY H H 39 7.647 7.647 7.449 0.198 17865
2717 1 5 . 1 1 15 15 LYS N N 40 121.621 121.621 122.468 -0.847 17865
2718 1 5 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.857 -0.282 17865
2719 1 5 . 1 1 15 15 LYS CA C 40 54.100 54.100 53.545 0.555 17865
2720 1 5 . 1 1 15 15 LYS CB C 40 32.510 32.510 33.651 -1.141 17865
2721 1 5 . 1 1 15 15 LYS H H 40 7.908 7.908 7.680 0.228 17865
2722 1 5 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.716 -0.364 17865
2723 1 5 . 1 1 16 16 PRO C C 41 176.806 176.806 176.449 0.357 17865
2724 1 5 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.248 0.510 17865
2725 1 5 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.468 -0.154 17865
2726 1 5 . 1 1 17 17 LEU N N 42 123.488 123.488 121.614 1.874 17865
2727 1 5 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.166 -0.117 17865
2728 1 5 . 1 1 17 17 LEU C C 42 174.973 174.973 176.113 -1.140 17865
2729 1 5 . 1 1 17 17 LEU CA C 42 55.436 55.436 55.326 0.110 17865
2730 1 5 . 1 1 17 17 LEU CB C 42 42.093 42.093 41.400 0.693 17865
2731 1 5 . 1 1 17 17 LEU H H 42 8.499 8.499 8.481 0.018 17865
2732 1 5 . 1 1 18 18 ASP N N 43 123.354 123.354 125.473 -2.119 17865
2733 1 5 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.848 -0.350 17865
2734 1 5 . 1 1 18 18 ASP C C 43 175.947 175.947 177.091 -1.144 17865
2735 1 5 . 1 1 18 18 ASP CA C 43 52.858 52.858 52.714 0.144 17865
2736 1 5 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.069 -1.848 17865
2737 1 5 . 1 1 18 18 ASP H H 43 7.789 7.789 7.911 -0.122 17865
2738 1 5 . 1 1 19 19 ALA N N 44 120.147 120.147 125.923 -5.776 17865
2739 1 5 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.191 -0.205 17865
2740 1 5 . 1 1 19 19 ALA C C 44 179.476 179.476 179.651 -0.175 17865
2741 1 5 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.465 0.698 17865
2742 1 5 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.782 -0.395 17865
2743 1 5 . 1 1 19 19 ALA H H 44 8.561 8.561 8.697 -0.136 17865
2744 1 5 . 1 1 20 20 SER N N 45 115.037 115.037 114.841 0.196 17865
2745 1 5 . 1 1 20 20 SER HA H 45 4.151 4.151 4.248 -0.097 17865
2746 1 5 . 1 1 20 20 SER C C 45 177.191 177.191 176.521 0.670 17865
2747 1 5 . 1 1 20 20 SER CA C 45 61.629 61.629 61.225 0.404 17865
2748 1 5 . 1 1 20 20 SER CB C 45 62.804 62.804 63.056 -0.252 17865
2749 1 5 . 1 1 20 20 SER H H 45 8.466 8.466 8.929 -0.463 17865
2750 1 5 . 1 1 21 21 PHE N N 46 125.030 125.030 123.416 1.614 17865
2751 1 5 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.357 -0.126 17865
2752 1 5 . 1 1 21 21 PHE C C 46 176.850 176.850 175.786 1.064 17865
2753 1 5 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.934 -0.128 17865
2754 1 5 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.492 0.389 17865
2755 1 5 . 1 1 21 21 PHE H H 46 8.034 8.034 8.133 -0.099 17865
2756 1 5 . 1 1 22 22 CYS N N 47 113.943 113.943 115.865 -1.922 17865
2757 1 5 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.224 0.027 17865
2758 1 5 . 1 1 22 22 CYS C C 47 176.449 176.449 176.162 0.287 17865
2759 1 5 . 1 1 22 22 CYS CA C 47 53.600 53.600 58.500 -4.900 17865
2760 1 5 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.592 10.799 17865
2761 1 5 . 1 1 22 22 CYS H H 47 7.691 7.691 7.847 -0.156 17865
2762 1 5 . 1 1 23 23 ARG N N 48 119.958 119.958 120.196 -0.238 17865
2763 1 5 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.149 -0.069 17865
2764 1 5 . 1 1 23 23 ARG C C 48 177.904 177.904 177.811 0.093 17865
2765 1 5 . 1 1 23 23 ARG CA C 48 58.907 58.907 57.849 1.058 17865
2766 1 5 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.518 0.652 17865
2767 1 5 . 1 1 23 23 ARG H H 48 7.628 7.628 7.436 0.192 17865
2768 1 5 . 1 1 24 24 THR N N 49 106.445 106.445 109.581 -3.136 17865
2769 1 5 . 1 1 24 24 THR HA H 49 4.385 4.385 4.294 0.091 17865
2770 1 5 . 1 1 24 24 THR C C 49 174.758 174.758 175.397 -0.639 17865
2771 1 5 . 1 1 24 24 THR CA C 49 61.573 61.573 64.010 -2.437 17865
2772 1 5 . 1 1 24 24 THR CB C 49 68.794 68.794 68.924 -0.130 17865
2773 1 5 . 1 1 24 24 THR H H 49 7.307 7.307 7.364 -0.057 17865
2774 1 5 . 1 1 25 25 ALA N N 50 122.242 122.242 123.777 -1.535 17865
2775 1 5 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.146 0.258 17865
2776 1 5 . 1 1 25 25 ALA C C 50 178.554 178.554 179.097 -0.543 17865
2777 1 5 . 1 1 25 25 ALA CA C 50 52.381 52.381 53.982 -1.601 17865
2778 1 5 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.097 -0.702 17865
2779 1 5 . 1 1 25 25 ALA H H 50 7.401 7.401 7.309 0.092 17865
2780 1 5 . 1 1 26 26 GLY N N 51 110.604 110.604 107.584 3.020 17865
2781 1 5 . 1 1 26 26 GLY CA C 51 47.022 47.022 47.053 -0.031 17865
2782 1 5 . 1 1 26 26 GLY H H 51 8.285 8.285 7.906 0.379 17865
2783 1 5 . 1 1 27 27 SER HA H 52 4.382 4.382 4.261 0.121 17865
2784 1 5 . 1 1 27 27 SER C C 52 175.774 175.774 174.691 1.083 17865
2785 1 5 . 1 1 27 27 SER CA C 52 60.803 60.803 60.866 -0.063 17865
2786 1 5 . 1 1 27 27 SER CB C 52 62.827 62.827 62.937 -0.110 17865
2787 1 5 . 1 1 28 28 ARG N N 53 119.682 119.682 117.476 2.206 17865
2788 1 5 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.692 0.188 17865
2789 1 5 . 1 1 28 28 ARG C C 53 175.796 175.796 176.855 -1.059 17865
2790 1 5 . 1 1 28 28 ARG CA C 53 55.738 55.738 54.210 1.528 17865
2791 1 5 . 1 1 28 28 ARG CB C 53 30.237 30.237 30.090 0.147 17865
2792 1 5 . 1 1 28 28 ARG H H 53 7.894 7.894 7.490 0.404 17865
2793 1 5 . 1 1 29 29 GLU N N 54 122.318 122.318 121.996 0.322 17865
2794 1 5 . 1 1 29 29 GLU HA H 54 3.595 3.595 3.922 -0.327 17865
2795 1 5 . 1 1 29 29 GLU C C 54 177.523 177.523 177.893 -0.370 17865
2796 1 5 . 1 1 29 29 GLU CA C 54 61.223 61.223 60.301 0.922 17865
2797 1 5 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.354 -0.417 17865
2798 1 5 . 1 1 29 29 GLU H H 54 7.730 7.730 7.865 -0.135 17865
2799 1 5 . 1 1 30 30 LYS N N 55 118.377 118.377 117.844 0.533 17865
2800 1 5 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.018 -0.190 17865
2801 1 5 . 1 1 30 30 LYS C C 55 179.205 179.205 178.931 0.274 17865
2802 1 5 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.331 1.096 17865
2803 1 5 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.110 -0.509 17865
2804 1 5 . 1 1 30 30 LYS H H 55 8.659 8.659 8.363 0.296 17865
2805 1 5 . 1 1 31 31 ASP N N 56 121.614 121.614 119.879 1.735 17865
2806 1 5 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.579 -0.268 17865
2807 1 5 . 1 1 31 31 ASP C C 56 177.393 177.393 177.500 -0.107 17865
2808 1 5 . 1 1 31 31 ASP CA C 56 57.316 57.316 57.347 -0.031 17865
2809 1 5 . 1 1 31 31 ASP CB C 56 40.423 40.423 41.306 -0.883 17865
2810 1 5 . 1 1 31 31 ASP H H 56 7.646 7.646 7.853 -0.207 17865
2811 1 5 . 1 1 32 32 CYS N N 57 120.345 120.345 120.012 0.333 17865
2812 1 5 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.022 0.579 17865
2813 1 5 . 1 1 32 32 CYS C C 57 175.772 175.772 176.428 -0.656 17865
2814 1 5 . 1 1 32 32 CYS CA C 57 60.197 60.197 61.039 -0.842 17865
2815 1 5 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.975 7.991 17865
2816 1 5 . 1 1 32 32 CYS H H 57 8.042 8.042 8.036 0.006 17865
2817 1 5 . 1 1 33 33 ARG N N 58 120.293 120.293 119.451 0.842 17865
2818 1 5 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.980 -0.304 17865
2819 1 5 . 1 1 33 33 ARG C C 58 179.633 179.633 177.908 1.725 17865
2820 1 5 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.173 1.212 17865
2821 1 5 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.740 0.101 17865
2822 1 5 . 1 1 33 33 ARG H H 58 8.531 8.531 8.366 0.165 17865
2823 1 5 . 1 1 34 34 LYS N N 59 121.166 121.166 118.247 2.919 17865
2824 1 5 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.133 -0.097 17865
2825 1 5 . 1 1 34 34 LYS C C 59 179.220 179.220 178.565 0.655 17865
2826 1 5 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.773 0.757 17865
2827 1 5 . 1 1 34 34 LYS CB C 59 32.110 32.110 31.505 0.605 17865
2828 1 5 . 1 1 34 34 LYS H H 59 7.633 7.633 7.451 0.182 17865
2829 1 5 . 1 1 35 35 ASP N N 60 122.166 122.166 120.666 1.500 17865
2830 1 5 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.478 -0.047 17865
2831 1 5 . 1 1 35 35 ASP C C 60 179.709 179.709 178.540 1.169 17865
2832 1 5 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.159 0.544 17865
2833 1 5 . 1 1 35 35 ASP CB C 60 40.672 40.672 40.717 -0.045 17865
2834 1 5 . 1 1 35 35 ASP H H 60 8.221 8.221 7.687 0.534 17865
2835 1 5 . 1 1 36 36 VAL N N 61 121.312 121.312 118.814 2.498 17865
2836 1 5 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.700 -0.299 17865
2837 1 5 . 1 1 36 36 VAL C C 61 178.339 178.339 178.302 0.037 17865
2838 1 5 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.946 1.187 17865
2839 1 5 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.120 0.537 17865
2840 1 5 . 1 1 36 36 VAL H H 61 8.916 8.916 8.006 0.910 17865
2841 1 5 . 1 1 37 37 GLN N N 62 119.166 119.166 118.084 1.082 17865
2842 1 5 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.104 -0.162 17865
2843 1 5 . 1 1 37 37 GLN C C 62 177.293 177.293 177.189 0.104 17865
2844 1 5 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.492 0.788 17865
2845 1 5 . 1 1 37 37 GLN CB C 62 28.371 28.371 27.893 0.478 17865
2846 1 5 . 1 1 37 37 GLN H H 62 7.697 7.697 7.607 0.090 17865
2847 1 5 . 1 1 38 38 ALA N N 63 118.964 118.964 120.067 -1.103 17865
2848 1 5 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.319 -0.077 17865
2849 1 5 . 1 1 38 38 ALA C C 63 177.221 177.221 177.593 -0.372 17865
2850 1 5 . 1 1 38 38 ALA CA C 63 53.137 53.137 52.463 0.674 17865
2851 1 5 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.195 -0.298 17865
2852 1 5 . 1 1 38 38 ALA H H 63 7.508 7.508 7.466 0.042 17865
2853 1 5 . 1 1 39 39 CYS N N 64 119.081 119.081 119.164 -0.083 17865
2854 1 5 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.582 0.371 17865
2855 1 5 . 1 1 39 39 CYS C C 64 172.052 172.052 174.331 -2.279 17865
2856 1 5 . 1 1 39 39 CYS CA C 64 51.880 51.880 59.081 -7.202 17865
2857 1 5 . 1 1 39 39 CYS CB C 64 34.328 34.328 25.921 8.408 17865
2858 1 5 . 1 1 39 39 CYS H H 64 7.354 7.354 7.558 -0.204 17865
2859 1 5 . 1 1 40 40 ASP N N 65 124.167 124.167 125.911 -1.744 17865
2860 1 5 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.358 -0.033 17865
2861 1 5 . 1 1 40 40 ASP C C 65 176.496 176.496 177.685 -1.189 17865
2862 1 5 . 1 1 40 40 ASP CA C 65 56.724 56.724 57.718 -0.994 17865
2863 1 5 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.522 -0.209 17865
2864 1 5 . 1 1 40 40 ASP H H 65 8.142 8.142 8.509 -0.367 17865
2865 1 5 . 1 1 41 41 LYS N N 66 118.844 118.844 119.438 -0.594 17865
2866 1 5 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.178 0.346 17865
2867 1 5 . 1 1 41 41 LYS C C 66 175.586 175.586 177.625 -2.039 17865
2868 1 5 . 1 1 41 41 LYS CA C 66 55.275 55.275 58.153 -2.877 17865
2869 1 5 . 1 1 41 41 LYS CB C 66 32.598 32.598 31.992 0.606 17865
2870 1 5 . 1 1 41 41 LYS H H 66 7.858 7.858 8.701 -0.843 17865
2871 1 5 . 1 1 42 42 LYS N N 67 126.081 126.081 114.091 11.990 17865
2872 1 5 . 1 1 42 42 LYS HA H 67 3.915 3.915 3.709 0.206 17865
2873 1 5 . 1 1 42 42 LYS C C 67 174.665 174.665 175.470 -0.805 17865
2874 1 5 . 1 1 42 42 LYS CA C 67 57.827 57.827 58.222 -0.395 17865
2875 1 5 . 1 1 42 42 LYS CB C 67 34.059 34.059 30.537 3.522 17865
2876 1 5 . 1 1 42 42 LYS H H 67 8.790 8.790 8.529 0.261 17865
2877 1 5 . 1 1 43 43 TYR N N 68 114.138 114.138 117.816 -3.678 17865
2878 1 5 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.835 0.424 17865
2879 1 5 . 1 1 43 43 TYR C C 68 175.767 175.767 175.784 -0.017 17865
2880 1 5 . 1 1 43 43 TYR CA C 68 55.880 55.880 57.140 -1.260 17865
2881 1 5 . 1 1 43 43 TYR CB C 68 42.363 42.363 42.075 0.288 17865
2882 1 5 . 1 1 43 43 TYR H H 68 7.294 7.294 8.044 -0.750 17865
2883 1 5 . 1 1 44 44 ASP N N 69 121.807 121.807 120.726 1.081 17865
2884 1 5 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.583 0.057 17865
2885 1 5 . 1 1 44 44 ASP C C 69 177.812 177.812 177.564 0.248 17865
2886 1 5 . 1 1 44 44 ASP CA C 69 52.110 52.110 53.465 -1.355 17865
2887 1 5 . 1 1 44 44 ASP CB C 69 41.440 41.440 42.009 -0.569 17865
2888 1 5 . 1 1 44 44 ASP H H 69 8.995 8.995 8.297 0.698 17865
2889 1 5 . 1 1 45 45 ASP N N 70 116.686 116.686 117.612 -0.926 17865
2890 1 5 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.423 0.001 17865
2891 1 5 . 1 1 45 45 ASP C C 70 177.054 177.054 177.001 0.053 17865
2892 1 5 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.552 -0.171 17865
2893 1 5 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.855 -0.607 17865
2894 1 5 . 1 1 45 45 ASP H H 70 8.369 8.369 8.654 -0.285 17865
2895 1 5 . 1 1 46 46 GLN N N 71 117.949 117.949 116.923 1.026 17865
2896 1 5 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.483 -0.027 17865
2897 1 5 . 1 1 46 46 GLN C C 71 176.273 176.273 176.154 0.119 17865
2898 1 5 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.085 0.282 17865
2899 1 5 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.599 -0.269 17865
2900 1 5 . 1 1 46 46 GLN H H 71 8.274 8.274 8.342 -0.068 17865
2901 1 5 . 1 1 47 47 GLY N N 72 108.369 108.369 108.363 0.006 17865
2902 1 5 . 1 1 47 47 GLY C C 72 174.145 174.145 174.579 -0.434 17865
2903 1 5 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.507 0.316 17865
2904 1 5 . 1 1 47 47 GLY H H 72 8.174 8.174 7.968 0.206 17865
2905 1 5 . 1 1 48 48 ARG N N 73 121.554 121.554 118.813 2.741 17865
2906 1 5 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.698 -0.213 17865
2907 1 5 . 1 1 48 48 ARG C C 73 176.855 176.855 175.849 1.006 17865
2908 1 5 . 1 1 48 48 ARG CA C 73 55.289 55.289 52.566 2.723 17865
2909 1 5 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.401 -0.843 17865
2910 1 5 . 1 1 48 48 ARG H H 73 8.462 8.462 8.776 -0.314 17865
2911 1 5 . 1 1 49 49 GLU N N 74 122.784 122.784 121.738 1.046 17865
2912 1 5 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.303 0.180 17865
2913 1 5 . 1 1 49 49 GLU C C 74 178.098 178.098 176.618 1.480 17865
2914 1 5 . 1 1 49 49 GLU CA C 74 57.184 57.184 57.521 -0.337 17865
2915 1 5 . 1 1 49 49 GLU CB C 74 30.777 30.777 29.555 1.222 17865
2916 1 5 . 1 1 49 49 GLU H H 74 8.703 8.703 8.706 -0.003 17865
2917 1 5 . 1 1 50 50 THR N N 75 114.563 114.563 115.934 -1.371 17865
2918 1 5 . 1 1 50 50 THR HA H 75 4.212 4.212 4.405 -0.193 17865
2919 1 5 . 1 1 50 50 THR C C 75 175.170 175.170 175.377 -0.207 17865
2920 1 5 . 1 1 50 50 THR CA C 75 60.589 60.589 60.813 -0.224 17865
2921 1 5 . 1 1 50 50 THR CB C 75 70.952 70.952 70.260 0.692 17865
2922 1 5 . 1 1 50 50 THR H H 75 7.717 7.717 7.918 -0.201 17865
2923 1 5 . 1 1 51 51 ALA N N 76 122.097 122.097 121.836 0.261 17865
2924 1 5 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.082 -0.044 17865
2925 1 5 . 1 1 51 51 ALA C C 76 181.906 181.906 179.236 2.670 17865
2926 1 5 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.076 0.578 17865
2927 1 5 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.093 -0.100 17865
2928 1 5 . 1 1 51 51 ALA H H 76 8.734 8.734 8.562 0.172 17865
2929 1 5 . 1 1 52 52 CYS N N 77 115.347 115.347 117.427 -2.080 17865
2930 1 5 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.271 0.209 17865
2931 1 5 . 1 1 52 52 CYS C C 77 176.299 176.299 176.883 -0.584 17865
2932 1 5 . 1 1 52 52 CYS CA C 77 57.701 57.701 60.310 -2.609 17865
2933 1 5 . 1 1 52 52 CYS CB C 77 35.631 35.631 26.121 9.510 17865
2934 1 5 . 1 1 52 52 CYS H H 77 9.073 9.073 8.053 1.020 17865
2935 1 5 . 1 1 53 53 ALA N N 78 128.517 128.517 123.114 5.403 17865
2936 1 5 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.677 0.178 17865
2937 1 5 . 1 1 53 53 ALA C C 78 178.736 178.736 179.100 -0.364 17865
2938 1 5 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.230 0.403 17865
2939 1 5 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.849 1.342 17865
2940 1 5 . 1 1 53 53 ALA H H 78 7.174 7.174 8.016 -0.842 17865
2941 1 5 . 1 1 54 54 LYS N N 79 118.706 118.706 117.955 0.751 17865
2942 1 5 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.185 -0.382 17865
2943 1 5 . 1 1 54 54 LYS C C 79 179.611 179.611 178.530 1.081 17865
2944 1 5 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.491 1.234 17865
2945 1 5 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.472 0.181 17865
2946 1 5 . 1 1 54 54 LYS H H 79 8.313 8.313 8.158 0.155 17865
2947 1 5 . 1 1 55 55 GLY N N 80 104.822 104.822 108.148 -3.326 17865
2948 1 5 . 1 1 55 55 GLY C C 80 176.504 176.504 176.562 -0.058 17865
2949 1 5 . 1 1 55 55 GLY CA C 80 46.839 46.839 46.789 0.050 17865
2950 1 5 . 1 1 55 55 GLY H H 80 8.175 8.175 7.328 0.847 17865
2951 1 5 . 1 1 56 56 ILE N N 81 123.697 123.697 123.101 0.596 17865
2952 1 5 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.916 -0.121 17865
2953 1 5 . 1 1 56 56 ILE C C 81 177.334 177.334 177.573 -0.239 17865
2954 1 5 . 1 1 56 56 ILE CA C 81 65.281 65.281 65.231 0.050 17865
2955 1 5 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.957 0.378 17865
2956 1 5 . 1 1 56 56 ILE H H 81 7.590 7.590 8.056 -0.466 17865
2957 1 5 . 1 1 57 57 ARG N N 82 118.161 118.161 119.568 -1.407 17865
2958 1 5 . 1 1 57 57 ARG HA H 82 3.935 3.935 4.098 -0.163 17865
2959 1 5 . 1 1 57 57 ARG C C 82 178.662 178.662 178.592 0.070 17865
2960 1 5 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.880 -0.179 17865
2961 1 5 . 1 1 57 57 ARG CB C 82 29.899 29.899 30.071 -0.172 17865
2962 1 5 . 1 1 57 57 ARG H H 82 7.569 7.569 7.557 0.012 17865
2963 1 5 . 1 1 58 58 GLU N N 83 115.085 115.085 116.070 -0.985 17865
2964 1 5 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.185 -0.154 17865
2965 1 5 . 1 1 58 58 GLU C C 83 178.224 178.224 178.685 -0.461 17865
2966 1 5 . 1 1 58 58 GLU CA C 83 58.304 58.304 58.272 0.032 17865
2967 1 5 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.250 0.781 17865
2968 1 5 . 1 1 58 58 GLU H H 83 7.786 7.786 8.293 -0.507 17865
2969 1 5 . 1 1 59 59 LYS N N 84 119.183 119.183 117.930 1.253 17865
2970 1 5 . 1 1 59 59 LYS HA H 84 3.830 3.830 4.080 -0.250 17865
2971 1 5 . 1 1 59 59 LYS C C 84 177.933 177.933 177.505 0.428 17865
2972 1 5 . 1 1 59 59 LYS CA C 84 59.043 59.043 57.967 1.076 17865
2973 1 5 . 1 1 59 59 LYS CB C 84 33.650 33.650 33.240 0.410 17865
2974 1 5 . 1 1 59 59 LYS H H 84 7.968 7.968 7.468 0.500 17865
2975 1 5 . 1 1 60 60 TYR N N 85 113.663 113.663 116.392 -2.729 17865
2976 1 5 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.688 0.015 17865
2977 1 5 . 1 1 60 60 TYR C C 85 174.729 174.729 174.422 0.307 17865
2978 1 5 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.518 0.684 17865
2979 1 5 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.852 0.049 17865
2980 1 5 . 1 1 60 60 TYR H H 85 7.562 7.562 8.051 -0.489 17865
2981 1 5 . 1 1 61 61 LYS N N 86 121.862 121.862 122.008 -0.146 17865
2982 1 5 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.596 -0.084 17865
2983 1 5 . 1 1 61 61 LYS CA C 86 54.942 54.942 54.600 0.342 17865
2984 1 5 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.327 -0.225 17865
2985 1 5 . 1 1 61 61 LYS H H 86 7.222 7.222 7.548 -0.326 17865
2986 1 5 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.374 -0.051 17865
2987 1 5 . 1 1 62 62 PRO C C 87 176.576 176.576 176.749 -0.173 17865
2988 1 5 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.194 0.826 17865
2989 1 5 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.191 0.050 17865
2990 1 5 . 1 1 63 63 ALA N N 88 125.029 125.029 123.791 1.238 17865
2991 1 5 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.210 0.044 17865
2992 1 5 . 1 1 63 63 ALA C C 88 177.301 177.301 176.842 0.459 17865
2993 1 5 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.084 0.197 17865
2994 1 5 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.656 1.546 17865
2995 1 5 . 1 1 63 63 ALA H H 88 8.329 8.329 8.350 -0.021 17865
2996 1 5 . 1 1 64 64 VAL N N 89 121.843 121.843 119.674 2.169 17865
2997 1 5 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.464 -0.520 17865
2998 1 5 . 1 1 64 64 VAL C C 89 174.791 174.791 174.607 0.184 17865
2999 1 5 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.357 1.624 17865
3000 1 5 . 1 1 64 64 VAL CB C 89 33.485 33.485 34.722 -1.237 17865
3001 1 5 . 1 1 64 64 VAL H H 89 8.075 8.075 7.777 0.298 17865
3002 1 5 . 1 1 65 65 VAL N N 90 125.399 125.399 121.594 3.805 17865
3003 1 5 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.376 -0.238 17865
3004 1 5 . 1 1 65 65 VAL C C 90 174.340 174.340 173.970 0.370 17865
3005 1 5 . 1 1 65 65 VAL CA C 90 61.162 61.162 61.678 -0.517 17865
3006 1 5 . 1 1 65 65 VAL CB C 90 33.866 33.866 32.894 0.972 17865
3007 1 5 . 1 1 65 65 VAL H H 90 8.229 8.229 8.099 0.130 17865
3008 1 5 . 1 1 66 66 TYR N N 91 124.848 124.848 127.610 -2.762 17865
3009 1 5 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.900 -0.129 17865
3010 1 5 . 1 1 66 66 TYR C C 91 176.658 176.658 176.236 0.422 17865
3011 1 5 . 1 1 66 66 TYR CA C 91 58.084 58.084 56.986 1.098 17865
3012 1 5 . 1 1 66 66 TYR CB C 91 41.535 41.535 41.915 -0.380 17865
3013 1 5 . 1 1 66 66 TYR H H 91 9.145 9.145 8.534 0.611 17865
3014 1 5 . 1 1 67 67 GLY N N 92 106.185 106.185 109.282 -3.097 17865
3015 1 5 . 1 1 67 67 GLY C C 92 175.681 175.681 174.410 1.271 17865
3016 1 5 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.226 0.749 17865
3017 1 5 . 1 1 67 67 GLY H H 92 8.730 8.730 9.064 -0.334 17865
3018 1 5 . 1 1 68 68 TYR N N 93 121.815 121.815 116.728 5.087 17865
3019 1 5 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.136 -0.161 17865
3020 1 5 . 1 1 68 68 TYR C C 93 176.035 176.035 175.724 0.311 17865
3021 1 5 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.047 1.999 17865
3022 1 5 . 1 1 68 68 TYR CB C 93 38.425 38.425 37.783 0.641 17865
3023 1 5 . 1 1 68 68 TYR H H 93 8.711 8.711 8.567 0.144 17865
3024 1 5 . 1 1 69 69 ASP N N 94 115.507 115.507 119.841 -4.334 17865
3025 1 5 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.431 -0.143 17865
3026 1 5 . 1 1 69 69 ASP C C 94 177.063 177.063 177.348 -0.285 17865
3027 1 5 . 1 1 69 69 ASP CA C 94 53.011 53.011 54.063 -1.052 17865
3028 1 5 . 1 1 69 69 ASP CB C 94 40.167 40.167 41.223 -1.056 17865
3029 1 5 . 1 1 69 69 ASP H H 94 8.010 8.010 7.582 0.428 17865
3030 1 5 . 1 1 70 70 GLY N N 95 107.196 107.196 107.299 -0.103 17865
3031 1 5 . 1 1 70 70 GLY C C 95 173.936 173.936 173.886 0.050 17865
3032 1 5 . 1 1 70 70 GLY CA C 95 45.392 45.392 44.989 0.403 17865
3033 1 5 . 1 1 70 70 GLY H H 95 7.986 7.986 7.615 0.371 17865
3034 1 5 . 1 1 71 71 LYS N N 96 121.258 121.258 120.624 0.634 17865
3035 1 5 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.825 -0.041 17865
3036 1 5 . 1 1 71 71 LYS CA C 96 54.114 54.114 53.591 0.523 17865
3037 1 5 . 1 1 71 71 LYS CB C 96 31.762 31.762 32.945 -1.183 17865
3038 1 5 . 1 1 71 71 LYS H H 96 7.877 7.877 7.793 0.084 17865
3039 1 5 . 1 1 72 72 PRO C C 97 177.170 177.170 175.956 1.214 17865
3040 1 5 . 1 1 72 72 PRO CA C 97 63.137 63.137 62.800 0.337 17865
3041 1 5 . 1 1 72 72 PRO CB C 97 32.240 32.240 30.695 1.545 17865
3042 1 5 . 1 1 73 73 LEU N N 98 123.503 123.503 122.235 1.268 17865
3043 1 5 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.857 -0.497 17865
3044 1 5 . 1 1 73 73 LEU C C 98 176.354 176.354 175.747 0.607 17865
3045 1 5 . 1 1 73 73 LEU CA C 98 53.927 53.927 52.735 1.192 17865
3046 1 5 . 1 1 73 73 LEU CB C 98 42.272 42.272 46.564 -4.292 17865
3047 1 5 . 1 1 73 73 LEU H H 98 8.850 8.850 7.706 1.144 17865
3048 1 5 . 1 1 74 74 ASP N N 99 122.212 122.212 122.524 -0.312 17865
3049 1 5 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.803 -0.206 17865
3050 1 5 . 1 1 74 74 ASP C C 99 175.819 175.819 174.651 1.168 17865
3051 1 5 . 1 1 74 74 ASP CA C 99 53.856 53.856 54.347 -0.491 17865
3052 1 5 . 1 1 74 74 ASP CB C 99 40.989 40.989 39.259 1.730 17865
3053 1 5 . 1 1 74 74 ASP H H 99 8.517 8.517 8.725 -0.208 17865
3054 1 5 . 1 1 75 75 LEU N N 100 125.874 125.874 120.545 5.329 17865
3055 1 5 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.607 -0.241 17865
3056 1 5 . 1 1 75 75 LEU C C 100 178.426 178.426 177.589 0.837 17865
3057 1 5 . 1 1 75 75 LEU CA C 100 53.631 53.631 55.523 -1.892 17865
3058 1 5 . 1 1 75 75 LEU CB C 100 40.676 40.676 43.668 -2.992 17865
3059 1 5 . 1 1 75 75 LEU H H 100 8.281 8.281 7.850 0.431 17865
3060 1 5 . 1 1 76 76 GLY N N 101 110.604 110.604 109.700 0.904 17865
3061 1 5 . 1 1 76 76 GLY C C 101 176.936 176.936 175.367 1.569 17865
3062 1 5 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.780 0.047 17865
3063 1 5 . 1 1 76 76 GLY H H 101 8.914 8.914 7.984 0.930 17865
3064 1 5 . 1 1 77 77 PHE N N 102 117.639 117.639 115.867 1.772 17865
3065 1 5 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.944 -0.563 17865
3066 1 5 . 1 1 77 77 PHE C C 102 177.878 177.878 175.075 2.803 17865
3067 1 5 . 1 1 77 77 PHE CA C 102 59.139 59.139 57.623 1.516 17865
3068 1 5 . 1 1 77 77 PHE CB C 102 36.935 36.935 39.214 -2.279 17865
3069 1 5 . 1 1 77 77 PHE H H 102 7.992 7.992 7.886 0.106 17865
3070 1 5 . 1 1 78 78 CYS N N 103 121.136 121.136 117.274 3.862 17865
3071 1 5 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.845 -0.460 17865
3072 1 5 . 1 1 78 78 CYS C C 103 172.780 172.780 176.700 -3.920 17865
3073 1 5 . 1 1 78 78 CYS CA C 103 53.696 53.696 58.437 -4.741 17865
3074 1 5 . 1 1 78 78 CYS CB C 103 34.237 34.237 28.930 5.307 17865
3075 1 5 . 1 1 78 78 CYS H H 103 7.362 7.362 8.296 -0.934 17865
3076 1 5 . 1 1 79 79 THR N N 104 114.773 114.773 116.975 -2.202 17865
3077 1 5 . 1 1 79 79 THR HA H 104 3.984 3.984 4.293 -0.309 17865
3078 1 5 . 1 1 79 79 THR C C 104 176.624 176.624 176.466 0.158 17865
3079 1 5 . 1 1 79 79 THR CA C 104 65.180 65.180 65.073 0.107 17865
3080 1 5 . 1 1 79 79 THR CB C 104 69.062 69.062 68.451 0.611 17865
3081 1 5 . 1 1 79 79 THR H H 104 7.864 7.864 8.609 -0.745 17865
3082 1 5 . 1 1 80 80 LEU N N 105 119.785 119.785 120.670 -0.885 17865
3083 1 5 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.237 0.094 17865
3084 1 5 . 1 1 80 80 LEU C C 105 177.208 177.208 177.310 -0.102 17865
3085 1 5 . 1 1 80 80 LEU CA C 105 55.453 55.453 56.447 -0.994 17865
3086 1 5 . 1 1 80 80 LEU CB C 105 41.293 41.293 41.393 -0.100 17865
3087 1 5 . 1 1 80 80 LEU H H 105 7.238 7.238 7.987 -0.749 17865
3088 1 5 . 1 1 81 81 ALA N N 106 119.309 119.309 118.196 1.113 17865
3089 1 5 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.743 -0.216 17865
3090 1 5 . 1 1 81 81 ALA C C 106 178.769 178.769 177.881 0.888 17865
3091 1 5 . 1 1 81 81 ALA CA C 106 52.049 52.049 51.008 1.041 17865
3092 1 5 . 1 1 81 81 ALA CB C 106 18.820 18.820 19.918 -1.098 17865
3093 1 5 . 1 1 81 81 ALA H H 106 7.432 7.432 7.598 -0.166 17865
3094 1 5 . 1 1 82 82 GLY N N 107 109.793 109.793 109.884 -0.091 17865
3095 1 5 . 1 1 82 82 GLY CA C 107 47.119 47.119 46.577 0.542 17865
3096 1 5 . 1 1 82 82 GLY H H 107 7.918 7.918 7.932 -0.014 17865
3097 1 5 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.895 0.371 17865
3098 1 5 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.302 -0.039 17865
3099 1 5 . 1 1 83 83 ILE CB C 108 38.261 38.261 37.966 0.295 17865
3100 1 5 . 1 1 84 84 ARG HA H 109 4.755 4.755 3.952 0.803 17865
3101 1 5 . 1 1 84 84 ARG C C 109 181.344 181.344 177.875 3.469 17865
3102 1 5 . 1 1 84 84 ARG CA C 109 55.939 55.939 57.033 -1.094 17865
3103 1 5 . 1 1 84 84 ARG CB C 109 30.283 30.283 28.518 1.765 17865
3104 1 5 . 1 1 85 85 GLU N N 110 122.944 122.944 120.219 2.725 17865
3105 1 5 . 1 1 85 85 GLU HA H 110 3.617 3.617 3.988 -0.371 17865
3106 1 5 . 1 1 85 85 GLU C C 110 177.797 177.797 178.400 -0.603 17865
3107 1 5 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.773 0.955 17865
3108 1 5 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.412 -0.541 17865
3109 1 5 . 1 1 85 85 GLU H H 110 8.003 8.003 7.584 0.419 17865
3110 1 5 . 1 1 86 86 VAL N N 111 117.101 117.101 118.654 -1.553 17865
3111 1 5 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.673 -0.162 17865
3112 1 5 . 1 1 86 86 VAL C C 111 177.710 177.710 178.075 -0.365 17865
3113 1 5 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.475 -0.045 17865
3114 1 5 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.492 -0.279 17865
3115 1 5 . 1 1 86 86 VAL H H 111 8.106 8.106 7.517 0.589 17865
3116 1 5 . 1 1 87 87 ASP N N 112 122.242 122.242 118.449 3.793 17865
3117 1 5 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.548 -0.244 17865
3118 1 5 . 1 1 87 87 ASP C C 112 176.912 176.912 178.627 -1.715 17865
3119 1 5 . 1 1 87 87 ASP CA C 112 57.417 57.417 56.424 0.993 17865
3120 1 5 . 1 1 87 87 ASP CB C 112 40.476 40.476 41.028 -0.552 17865
3121 1 5 . 1 1 87 87 ASP H H 112 7.401 7.401 7.782 -0.381 17865
3122 1 5 . 1 1 88 88 CYS N N 113 120.819 120.819 120.711 0.108 17865
3123 1 5 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.070 -0.761 17865
3124 1 5 . 1 1 88 88 CYS C C 113 175.270 175.270 176.392 -1.122 17865
3125 1 5 . 1 1 88 88 CYS CA C 113 59.759 59.759 61.457 -1.698 17865
3126 1 5 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.012 7.823 17865
3127 1 5 . 1 1 88 88 CYS H H 113 7.785 7.785 8.512 -0.727 17865
3128 1 5 . 1 1 89 89 ARG N N 114 118.654 118.654 120.063 -1.409 17865
3129 1 5 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.003 -0.362 17865
3130 1 5 . 1 1 89 89 ARG C C 114 179.018 179.018 178.324 0.694 17865
3131 1 5 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.640 0.553 17865
3132 1 5 . 1 1 89 89 ARG CB C 114 29.713 29.713 30.009 -0.297 17865
3133 1 5 . 1 1 89 89 ARG H H 114 8.142 8.142 7.876 0.266 17865
3134 1 5 . 1 1 90 90 LYS N N 115 120.964 120.964 117.611 3.353 17865
3135 1 5 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.137 -0.107 17865
3136 1 5 . 1 1 90 90 LYS C C 115 180.092 180.092 178.463 1.629 17865
3137 1 5 . 1 1 90 90 LYS CA C 115 59.568 59.568 59.039 0.529 17865
3138 1 5 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.221 -0.000 17865
3139 1 5 . 1 1 90 90 LYS H H 115 7.936 7.936 7.759 0.177 17865
3140 1 5 . 1 1 91 91 ASP N N 116 121.690 121.690 119.496 2.194 17865
3141 1 5 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.535 -0.022 17865
3142 1 5 . 1 1 91 91 ASP C C 116 179.419 179.419 178.441 0.978 17865
3143 1 5 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.631 0.606 17865
3144 1 5 . 1 1 91 91 ASP CB C 116 40.648 40.648 41.242 -0.594 17865
3145 1 5 . 1 1 91 91 ASP H H 116 8.558 8.558 7.517 1.041 17865
3146 1 5 . 1 1 92 92 ALA N N 117 122.784 122.784 123.283 -0.499 17865
3147 1 5 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.043 -0.020 17865
3148 1 5 . 1 1 92 92 ALA C C 117 178.789 178.789 179.732 -0.943 17865
3149 1 5 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.059 -0.008 17865
3150 1 5 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.347 0.828 17865
3151 1 5 . 1 1 92 92 ALA H H 117 8.703 8.703 8.544 0.159 17865
3152 1 5 . 1 1 93 93 GLN N N 118 115.510 115.510 117.755 -2.245 17865
3153 1 5 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.088 -0.144 17865
3154 1 5 . 1 1 93 93 GLN C C 118 178.745 178.745 177.571 1.174 17865
3155 1 5 . 1 1 93 93 GLN CA C 118 58.482 58.482 58.138 0.344 17865
3156 1 5 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.312 0.085 17865
3157 1 5 . 1 1 93 93 GLN H H 118 7.664 7.664 8.533 -0.869 17865
3158 1 5 . 1 1 94 94 THR N N 119 110.110 110.110 113.857 -3.747 17865
3159 1 5 . 1 1 94 94 THR HA H 119 4.237 4.237 4.210 0.027 17865
3160 1 5 . 1 1 94 94 THR C C 119 175.861 175.861 175.609 0.252 17865
3161 1 5 . 1 1 94 94 THR CA C 119 64.604 64.604 65.339 -0.735 17865
3162 1 5 . 1 1 94 94 THR CB C 119 69.716 69.716 68.782 0.934 17865
3163 1 5 . 1 1 94 94 THR H H 119 7.726 7.726 7.643 0.083 17865
3164 1 5 . 1 1 95 95 CYS N N 120 118.523 118.523 121.089 -2.566 17865
3165 1 5 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.435 0.298 17865
3166 1 5 . 1 1 95 95 CYS C C 120 175.165 175.165 174.865 0.300 17865
3167 1 5 . 1 1 95 95 CYS CA C 120 52.973 52.973 58.704 -5.731 17865
3168 1 5 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.830 11.901 17865
3169 1 5 . 1 1 95 95 CYS H H 120 7.756 7.756 7.758 -0.002 17865
3170 1 5 . 1 1 96 96 ASP N N 121 119.081 119.081 122.996 -3.915 17865
3171 1 5 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.434 0.244 17865
3172 1 5 . 1 1 96 96 ASP CA C 121 56.224 56.224 56.152 0.072 17865
3173 1 5 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.103 1.628 17865
3174 1 5 . 1 1 96 96 ASP H H 121 7.354 7.354 8.277 -0.923 17865
3175 1 5 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.502 -0.927 17865
3176 1 5 . 1 1 97 97 LYS C C 122 175.510 175.510 176.953 -1.443 17865
3177 1 5 . 1 1 97 97 LYS CA C 122 57.839 57.839 56.810 1.029 17865
3178 1 5 . 1 1 97 97 LYS CB C 122 30.750 30.750 33.981 -3.231 17865
3179 1 5 . 1 1 98 98 LYS N N 123 119.980 119.980 118.190 1.790 17865
3180 1 5 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.406 -0.112 17865
3181 1 5 . 1 1 98 98 LYS C C 123 176.968 176.968 178.326 -1.358 17865
3182 1 5 . 1 1 98 98 LYS CA C 123 55.904 55.904 56.756 -0.852 17865
3183 1 5 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.297 -0.065 17865
3184 1 5 . 1 1 98 98 LYS H H 123 7.799 7.799 8.395 -0.596 17865
3185 1 5 . 1 1 99 99 TYR N N 124 122.378 122.378 121.733 0.645 17865
3186 1 5 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.214 -0.319 17865
3187 1 5 . 1 1 99 99 TYR C C 124 177.126 177.126 176.623 0.503 17865
3188 1 5 . 1 1 99 99 TYR CA C 124 60.211 60.211 60.936 -0.725 17865
3189 1 5 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.655 -0.384 17865
3190 1 5 . 1 1 99 99 TYR H H 124 8.536 8.536 8.669 -0.133 17865
3191 1 5 . 1 1 100 100 GLU N N 125 118.610 118.610 115.744 2.866 17865
3192 1 5 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.218 0.050 17865
3193 1 5 . 1 1 100 100 GLU C C 125 177.387 177.387 177.678 -0.291 17865
3194 1 5 . 1 1 100 100 GLU CA C 125 55.759 55.759 56.947 -1.188 17865
3195 1 5 . 1 1 100 100 GLU CB C 125 27.321 27.321 29.111 -1.790 17865
3196 1 5 . 1 1 100 100 GLU H H 125 8.385 8.385 8.384 0.001 17865
3197 1 5 . 1 1 101 101 SER N N 126 115.949 115.949 117.083 -1.134 17865
3198 1 5 . 1 1 101 101 SER HA H 126 3.959 3.959 4.244 -0.285 17865
3199 1 5 . 1 1 101 101 SER C C 126 176.047 176.047 176.067 -0.020 17865
3200 1 5 . 1 1 101 101 SER CA C 126 62.439 62.439 62.272 0.167 17865
3201 1 5 . 1 1 101 101 SER CB C 126 63.299 63.299 63.032 0.267 17865
3202 1 5 . 1 1 101 101 SER H H 126 7.823 7.823 7.897 -0.074 17865
3203 1 5 . 1 1 102 102 ASP N N 127 120.920 120.920 120.993 -0.073 17865
3204 1 5 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.254 0.153 17865
3205 1 5 . 1 1 102 102 ASP C C 127 178.234 178.234 178.381 -0.147 17865
3206 1 5 . 1 1 102 102 ASP CA C 127 57.411 57.411 58.251 -0.840 17865
3207 1 5 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.279 -0.563 17865
3208 1 5 . 1 1 102 102 ASP H H 127 8.683 8.683 7.978 0.705 17865
3209 1 5 . 1 1 103 103 LYS N N 128 121.753 121.753 118.608 3.145 17865
3210 1 5 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.051 -0.047 17865
3211 1 5 . 1 1 103 103 LYS C C 128 179.395 179.395 178.813 0.582 17865
3212 1 5 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.593 0.878 17865
3213 1 5 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.760 0.641 17865
3214 1 5 . 1 1 103 103 LYS H H 128 7.771 7.771 8.038 -0.267 17865
3215 1 5 . 1 1 104 104 CYS N N 129 120.109 120.109 119.461 0.648 17865
3216 1 5 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.261 -0.067 17865
3217 1 5 . 1 1 104 104 CYS C C 129 176.779 176.779 176.934 -0.155 17865
3218 1 5 . 1 1 104 104 CYS CA C 129 59.790 59.790 61.609 -1.819 17865
3219 1 5 . 1 1 104 104 CYS CB C 129 36.879 36.879 25.980 10.899 17865
3220 1 5 . 1 1 104 104 CYS H H 129 7.973 7.973 7.910 0.063 17865
3221 1 5 . 1 1 105 105 LEU N N 130 121.804 121.804 122.092 -0.288 17865
3222 1 5 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.947 0.143 17865
3223 1 5 . 1 1 105 105 LEU C C 130 179.373 179.373 178.843 0.530 17865
3224 1 5 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.198 -0.830 17865
3225 1 5 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.840 0.258 17865
3226 1 5 . 1 1 105 105 LEU H H 130 8.666 8.666 8.607 0.059 17865
3227 1 5 . 1 1 106 106 ASN N N 131 118.535 118.535 117.022 1.513 17865
3228 1 5 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.420 -0.182 17865
3229 1 5 . 1 1 106 106 ASN C C 131 177.830 177.830 177.592 0.238 17865
3230 1 5 . 1 1 106 106 ASN CA C 131 56.256 56.256 56.023 0.234 17865
3231 1 5 . 1 1 106 106 ASN CB C 131 37.817 37.817 37.972 -0.155 17865
3232 1 5 . 1 1 106 106 ASN H H 131 8.438 8.438 8.051 0.387 17865
3233 1 5 . 1 1 107 107 ALA N N 132 121.485 121.485 121.731 -0.246 17865
3234 1 5 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.212 0.007 17865
3235 1 5 . 1 1 107 107 ALA C C 132 180.726 180.726 178.695 2.031 17865
3236 1 5 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.513 0.450 17865
3237 1 5 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.870 -1.049 17865
3238 1 5 . 1 1 107 107 ALA H H 132 7.541 7.541 7.178 0.363 17865
3239 1 5 . 1 1 108 108 ILE N N 133 120.979 120.979 118.307 2.672 17865
3240 1 5 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.935 -0.004 17865
3241 1 5 . 1 1 108 108 ILE C C 133 178.114 178.114 177.606 0.508 17865
3242 1 5 . 1 1 108 108 ILE CA C 133 63.353 63.353 62.190 1.163 17865
3243 1 5 . 1 1 108 108 ILE CB C 133 36.454 36.454 37.120 -0.666 17865
3244 1 5 . 1 1 108 108 ILE H H 133 7.551 7.551 7.877 -0.326 17865
3245 1 5 . 1 1 109 109 LYS N N 134 121.415 121.415 120.097 1.318 17865
3246 1 5 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.120 -0.532 17865
3247 1 5 . 1 1 109 109 LYS C C 134 179.561 179.561 178.246 1.315 17865
3248 1 5 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.938 0.170 17865
3249 1 5 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.322 -0.161 17865
3250 1 5 . 1 1 109 109 LYS H H 134 8.414 8.414 7.825 0.589 17865
3251 1 5 . 1 1 110 110 GLU N N 135 116.099 116.099 117.712 -1.613 17865
3252 1 5 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.148 -0.219 17865
3253 1 5 . 1 1 110 110 GLU C C 135 178.239 178.239 179.119 -0.880 17865
3254 1 5 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.794 -0.148 17865
3255 1 5 . 1 1 110 110 GLU CB C 135 29.638 29.638 29.059 0.579 17865
3256 1 5 . 1 1 110 110 GLU H H 135 7.473 7.473 7.824 -0.351 17865
3257 1 5 . 1 1 111 111 LYS N N 136 119.805 119.805 120.817 -1.012 17865
3258 1 5 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.010 -0.104 17865
3259 1 5 . 1 1 111 111 LYS C C 136 177.600 177.600 177.483 0.117 17865
3260 1 5 . 1 1 111 111 LYS CA C 136 58.749 58.749 58.309 0.439 17865
3261 1 5 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.453 0.785 17865
3262 1 5 . 1 1 111 111 LYS H H 136 7.540 7.540 7.416 0.124 17865
3263 1 5 . 1 1 112 112 TYR N N 137 114.768 114.768 116.368 -1.600 17865
3264 1 5 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.569 -0.046 17865
3265 1 5 . 1 1 112 112 TYR C C 137 174.690 174.690 174.258 0.432 17865
3266 1 5 . 1 1 112 112 TYR CA C 137 58.359 58.359 56.310 2.049 17865
3267 1 5 . 1 1 112 112 TYR CB C 137 38.328 38.328 36.718 1.610 17865
3268 1 5 . 1 1 112 112 TYR H H 137 7.488 7.488 7.489 -0.001 17865
3269 1 5 . 1 1 113 113 LYS N N 138 123.694 123.694 121.579 2.115 17865
3270 1 5 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.355 0.146 17865
3271 1 5 . 1 1 113 113 LYS CA C 138 55.282 55.282 55.447 -0.165 17865
3272 1 5 . 1 1 113 113 LYS CB C 138 32.124 32.124 31.999 0.125 17865
3273 1 5 . 1 1 113 113 LYS H H 138 7.217 7.217 7.159 0.058 17865
3274 1 5 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.444 0.008 17865
3275 1 5 . 1 1 114 114 PRO C C 139 176.974 176.974 176.011 0.963 17865
3276 1 5 . 1 1 114 114 PRO CA C 139 63.189 63.189 63.295 -0.106 17865
3277 1 5 . 1 1 114 114 PRO CB C 139 32.251 32.251 31.033 1.218 17865
3278 1 5 . 1 1 115 115 VAL N N 140 121.098 121.098 121.261 -0.163 17865
3279 1 5 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.254 -0.152 17865
3280 1 5 . 1 1 115 115 VAL C C 140 176.207 176.207 175.636 0.571 17865
3281 1 5 . 1 1 115 115 VAL CA C 140 62.356 62.356 62.334 0.022 17865
3282 1 5 . 1 1 115 115 VAL CB C 140 33.256 33.256 33.151 0.105 17865
3283 1 5 . 1 1 115 115 VAL H H 140 8.272 8.272 8.200 0.072 17865
3284 1 5 . 1 1 116 116 VAL N N 141 124.167 124.167 121.980 2.187 17865
3285 1 5 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.266 -0.144 17865
3286 1 5 . 1 1 116 116 VAL C C 141 175.415 175.415 175.050 0.365 17865
3287 1 5 . 1 1 116 116 VAL CA C 141 61.731 61.731 61.832 -0.101 17865
3288 1 5 . 1 1 116 116 VAL CB C 141 33.145 33.145 34.513 -1.368 17865
3289 1 5 . 1 1 116 116 VAL H H 141 8.142 8.142 7.701 0.441 17865
3290 1 5 . 1 1 117 117 ASP N N 142 126.737 126.737 125.958 0.779 17865
3291 1 5 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.832 -0.020 17865
3292 1 5 . 1 1 117 117 ASP CA C 142 52.217 52.217 52.628 -0.411 17865
3293 1 5 . 1 1 117 117 ASP CB C 142 41.368 41.368 40.887 0.481 17865
3294 1 5 . 1 1 117 117 ASP H H 142 8.419 8.419 8.428 -0.009 17865
3295 1 5 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.314 0.097 17865
3296 1 5 . 1 1 118 118 PRO C C 143 176.662 176.662 176.300 0.362 17865
3297 1 5 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.825 -0.578 17865
3298 1 5 . 1 1 118 118 PRO CB C 143 32.310 32.310 31.994 0.316 17865
3299 1 5 . 1 1 119 119 ASN N N 144 119.287 119.287 116.445 2.842 17865
3300 1 5 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.866 0.081 17865
3301 1 5 . 1 1 119 119 ASN CA C 144 51.633 51.633 50.390 1.243 17865
3302 1 5 . 1 1 119 119 ASN CB C 144 38.859 38.859 39.344 -0.485 17865
3303 1 5 . 1 1 119 119 ASN H H 144 8.432 8.432 7.849 0.583 17865
3304 1 5 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.772 -0.092 17865
3305 1 5 . 1 1 120 120 PRO CA C 145 61.640 61.640 62.040 -0.400 17865
3306 1 5 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.546 -0.628 17865
3307 1 5 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.424 -0.047 17865
3308 1 5 . 1 1 121 121 PRO C C 146 175.876 175.876 175.418 0.458 17865
3309 1 5 . 1 1 121 121 PRO CA C 146 63.174 63.174 63.071 0.103 17865
3310 1 5 . 1 1 121 121 PRO CB C 146 31.939 31.939 32.571 -0.631 17865
3311 1 6 . 1 1 2 2 ASP N N 27 121.041 121.041 123.814 -2.773 17865
3312 1 6 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.946 -0.308 17865
3313 1 6 . 1 1 2 2 ASP C C 27 175.878 175.878 174.992 0.886 17865
3314 1 6 . 1 1 2 2 ASP CA C 27 54.382 54.382 54.569 -0.187 17865
3315 1 6 . 1 1 2 2 ASP CB C 27 41.729 41.729 41.068 0.661 17865
3316 1 6 . 1 1 2 2 ASP H H 27 8.639 8.639 8.558 0.081 17865
3317 1 6 . 1 1 3 3 VAL N N 28 119.901 119.901 123.265 -3.364 17865
3318 1 6 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.334 -0.301 17865
3319 1 6 . 1 1 3 3 VAL C C 28 175.521 175.521 174.315 1.206 17865
3320 1 6 . 1 1 3 3 VAL CA C 28 62.216 62.216 63.538 -1.322 17865
3321 1 6 . 1 1 3 3 VAL CB C 28 33.003 33.003 32.575 0.428 17865
3322 1 6 . 1 1 3 3 VAL H H 28 8.113 8.113 8.636 -0.523 17865
3323 1 6 . 1 1 4 4 PHE N N 29 123.707 123.707 127.276 -3.569 17865
3324 1 6 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.607 0.049 17865
3325 1 6 . 1 1 4 4 PHE C C 29 174.874 174.874 174.020 0.854 17865
3326 1 6 . 1 1 4 4 PHE CA C 29 57.159 57.159 57.359 -0.200 17865
3327 1 6 . 1 1 4 4 PHE CB C 29 39.795 39.795 41.243 -1.448 17865
3328 1 6 . 1 1 4 4 PHE H H 29 8.255 8.255 7.924 0.331 17865
3329 1 6 . 1 1 5 5 ASP N N 30 124.203 124.203 124.846 -0.643 17865
3330 1 6 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.577 0.261 17865
3331 1 6 . 1 1 5 5 ASP CA C 30 52.385 52.385 52.620 -0.235 17865
3332 1 6 . 1 1 5 5 ASP CB C 30 40.801 40.801 40.707 0.094 17865
3333 1 6 . 1 1 5 5 ASP H H 30 8.226 8.226 7.547 0.679 17865
3334 1 6 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.614 -0.077 17865
3335 1 6 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.005 -0.341 17865
3336 1 6 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.329 -0.503 17865
3337 1 6 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.423 0.003 17865
3338 1 6 . 1 1 7 7 PRO C C 32 177.226 177.226 176.922 0.304 17865
3339 1 6 . 1 1 7 7 PRO CA C 32 63.169 63.169 62.742 0.426 17865
3340 1 6 . 1 1 7 7 PRO CB C 32 31.948 31.948 32.154 -0.206 17865
3341 1 6 . 1 1 8 8 THR N N 33 114.158 114.158 117.652 -3.494 17865
3342 1 6 . 1 1 8 8 THR HA H 33 4.195 4.195 4.216 -0.021 17865
3343 1 6 . 1 1 8 8 THR C C 33 174.468 174.468 174.751 -0.283 17865
3344 1 6 . 1 1 8 8 THR CA C 33 62.110 62.110 61.748 0.362 17865
3345 1 6 . 1 1 8 8 THR CB C 33 69.975 69.975 69.307 0.668 17865
3346 1 6 . 1 1 8 8 THR H H 33 8.096 8.096 8.021 0.075 17865
3347 1 6 . 1 1 9 9 GLN N N 34 122.411 122.411 125.004 -2.593 17865
3348 1 6 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.281 -0.018 17865
3349 1 6 . 1 1 9 9 GLN C C 34 175.445 175.445 175.930 -0.485 17865
3350 1 6 . 1 1 9 9 GLN CA C 34 55.763 55.763 56.528 -0.765 17865
3351 1 6 . 1 1 9 9 GLN CB C 34 29.691 29.691 28.805 0.886 17865
3352 1 6 . 1 1 9 9 GLN H H 34 8.278 8.278 8.667 -0.389 17865
3353 1 6 . 1 1 10 10 TYR N N 35 121.048 121.048 113.846 7.202 17865
3354 1 6 . 1 1 10 10 TYR HA H 35 4.520 4.520 3.962 0.558 17865
3355 1 6 . 1 1 10 10 TYR C C 35 176.314 176.314 175.678 0.636 17865
3356 1 6 . 1 1 10 10 TYR CA C 35 57.972 57.972 60.271 -2.299 17865
3357 1 6 . 1 1 10 10 TYR CB C 35 38.936 38.936 36.800 2.136 17865
3358 1 6 . 1 1 10 10 TYR H H 35 8.227 8.227 8.068 0.159 17865
3359 1 6 . 1 1 11 11 GLY N N 36 109.711 109.711 105.445 4.266 17865
3360 1 6 . 1 1 11 11 GLY C C 36 174.128 174.128 173.932 0.196 17865
3361 1 6 . 1 1 11 11 GLY CA C 36 45.212 45.212 45.320 -0.108 17865
3362 1 6 . 1 1 11 11 GLY H H 36 8.247 8.247 7.926 0.321 17865
3363 1 6 . 1 1 12 12 TYR N N 37 120.302 120.302 118.203 2.099 17865
3364 1 6 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.859 -0.377 17865
3365 1 6 . 1 1 12 12 TYR C C 37 175.864 175.864 174.749 1.115 17865
3366 1 6 . 1 1 12 12 TYR CA C 37 58.541 58.541 55.004 3.537 17865
3367 1 6 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.763 -1.048 17865
3368 1 6 . 1 1 12 12 TYR H H 37 8.101 8.101 7.355 0.746 17865
3369 1 6 . 1 1 13 13 ASP N N 38 121.883 121.883 121.466 0.417 17865
3370 1 6 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.528 -0.042 17865
3371 1 6 . 1 1 13 13 ASP C C 38 176.538 176.538 176.137 0.401 17865
3372 1 6 . 1 1 13 13 ASP CA C 38 54.223 54.223 55.333 -1.110 17865
3373 1 6 . 1 1 13 13 ASP CB C 38 40.988 40.988 40.834 0.154 17865
3374 1 6 . 1 1 13 13 ASP H H 38 8.266 8.266 8.383 -0.117 17865
3375 1 6 . 1 1 14 14 GLY N N 39 107.705 107.705 110.604 -2.899 17865
3376 1 6 . 1 1 14 14 GLY C C 39 173.822 173.822 173.461 0.361 17865
3377 1 6 . 1 1 14 14 GLY CA C 39 45.404 45.404 44.709 0.695 17865
3378 1 6 . 1 1 14 14 GLY H H 39 7.647 7.647 8.521 -0.874 17865
3379 1 6 . 1 1 15 15 LYS N N 40 121.621 121.621 124.611 -2.990 17865
3380 1 6 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.653 -0.078 17865
3381 1 6 . 1 1 15 15 LYS CA C 40 54.100 54.100 52.965 1.135 17865
3382 1 6 . 1 1 15 15 LYS CB C 40 32.510 32.510 33.279 -0.769 17865
3383 1 6 . 1 1 15 15 LYS H H 40 7.908 7.908 7.764 0.144 17865
3384 1 6 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.762 -0.410 17865
3385 1 6 . 1 1 16 16 PRO C C 41 176.806 176.806 176.630 0.176 17865
3386 1 6 . 1 1 16 16 PRO CA C 41 62.758 62.758 61.870 0.888 17865
3387 1 6 . 1 1 16 16 PRO CB C 41 32.314 32.314 33.167 -0.854 17865
3388 1 6 . 1 1 17 17 LEU N N 42 123.488 123.488 117.441 6.047 17865
3389 1 6 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.263 -0.214 17865
3390 1 6 . 1 1 17 17 LEU C C 42 174.973 174.973 175.670 -0.697 17865
3391 1 6 . 1 1 17 17 LEU CA C 42 55.436 55.436 55.779 -0.343 17865
3392 1 6 . 1 1 17 17 LEU CB C 42 42.093 42.093 41.075 1.018 17865
3393 1 6 . 1 1 17 17 LEU H H 42 8.499 8.499 8.329 0.170 17865
3394 1 6 . 1 1 18 18 ASP N N 43 123.354 123.354 124.898 -1.544 17865
3395 1 6 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.838 -0.340 17865
3396 1 6 . 1 1 18 18 ASP C C 43 175.947 175.947 177.051 -1.104 17865
3397 1 6 . 1 1 18 18 ASP CA C 43 52.858 52.858 52.654 0.204 17865
3398 1 6 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.640 -2.419 17865
3399 1 6 . 1 1 18 18 ASP H H 43 7.789 7.789 7.942 -0.153 17865
3400 1 6 . 1 1 19 19 ALA N N 44 120.147 120.147 122.240 -2.093 17865
3401 1 6 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.161 -0.175 17865
3402 1 6 . 1 1 19 19 ALA C C 44 179.476 179.476 179.615 -0.139 17865
3403 1 6 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.312 0.851 17865
3404 1 6 . 1 1 19 19 ALA CB C 44 18.387 18.387 19.068 -0.681 17865
3405 1 6 . 1 1 19 19 ALA H H 44 8.561 8.561 8.504 0.057 17865
3406 1 6 . 1 1 20 20 SER N N 45 115.037 115.037 115.536 -0.499 17865
3407 1 6 . 1 1 20 20 SER HA H 45 4.151 4.151 4.185 -0.034 17865
3408 1 6 . 1 1 20 20 SER C C 45 177.191 177.191 176.688 0.503 17865
3409 1 6 . 1 1 20 20 SER CA C 45 61.629 61.629 61.545 0.084 17865
3410 1 6 . 1 1 20 20 SER CB C 45 62.804 62.804 62.817 -0.013 17865
3411 1 6 . 1 1 20 20 SER H H 45 8.466 8.466 8.187 0.279 17865
3412 1 6 . 1 1 21 21 PHE N N 46 125.030 125.030 123.496 1.534 17865
3413 1 6 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.374 -0.143 17865
3414 1 6 . 1 1 21 21 PHE C C 46 176.850 176.850 176.162 0.688 17865
3415 1 6 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.294 0.512 17865
3416 1 6 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.409 0.472 17865
3417 1 6 . 1 1 21 21 PHE H H 46 8.034 8.034 7.800 0.234 17865
3418 1 6 . 1 1 22 22 CYS N N 47 113.943 113.943 116.648 -2.705 17865
3419 1 6 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.176 0.075 17865
3420 1 6 . 1 1 22 22 CYS C C 47 176.449 176.449 176.040 0.409 17865
3421 1 6 . 1 1 22 22 CYS CA C 47 53.600 53.600 58.569 -4.969 17865
3422 1 6 . 1 1 22 22 CYS CB C 47 36.391 36.391 26.171 10.220 17865
3423 1 6 . 1 1 22 22 CYS H H 47 7.691 7.691 7.805 -0.114 17865
3424 1 6 . 1 1 23 23 ARG N N 48 119.958 119.958 120.348 -0.390 17865
3425 1 6 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.112 -0.032 17865
3426 1 6 . 1 1 23 23 ARG C C 48 177.904 177.904 177.280 0.624 17865
3427 1 6 . 1 1 23 23 ARG CA C 48 58.907 58.907 57.822 1.085 17865
3428 1 6 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.534 0.637 17865
3429 1 6 . 1 1 23 23 ARG H H 48 7.628 7.628 7.562 0.066 17865
3430 1 6 . 1 1 24 24 THR N N 49 106.445 106.445 110.806 -4.361 17865
3431 1 6 . 1 1 24 24 THR HA H 49 4.385 4.385 4.294 0.091 17865
3432 1 6 . 1 1 24 24 THR C C 49 174.758 174.758 174.605 0.153 17865
3433 1 6 . 1 1 24 24 THR CA C 49 61.573 61.573 60.971 0.602 17865
3434 1 6 . 1 1 24 24 THR CB C 49 68.794 68.794 68.679 0.115 17865
3435 1 6 . 1 1 24 24 THR H H 49 7.307 7.307 7.577 -0.270 17865
3436 1 6 . 1 1 25 25 ALA N N 50 122.242 122.242 122.661 -0.419 17865
3437 1 6 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.440 -0.036 17865
3438 1 6 . 1 1 25 25 ALA C C 50 178.554 178.554 178.088 0.466 17865
3439 1 6 . 1 1 25 25 ALA CA C 50 52.381 52.381 52.868 -0.487 17865
3440 1 6 . 1 1 25 25 ALA CB C 50 18.395 18.395 20.041 -1.646 17865
3441 1 6 . 1 1 25 25 ALA H H 50 7.401 7.401 7.681 -0.280 17865
3442 1 6 . 1 1 26 26 GLY N N 51 110.604 110.604 107.278 3.326 17865
3443 1 6 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.682 0.340 17865
3444 1 6 . 1 1 26 26 GLY H H 51 8.285 8.285 7.927 0.358 17865
3445 1 6 . 1 1 27 27 SER HA H 52 4.382 4.382 4.220 0.162 17865
3446 1 6 . 1 1 27 27 SER C C 52 175.774 175.774 175.417 0.357 17865
3447 1 6 . 1 1 27 27 SER CA C 52 60.803 60.803 61.293 -0.490 17865
3448 1 6 . 1 1 27 27 SER CB C 52 62.827 62.827 63.389 -0.562 17865
3449 1 6 . 1 1 28 28 ARG N N 53 119.682 119.682 117.762 1.920 17865
3450 1 6 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.689 0.191 17865
3451 1 6 . 1 1 28 28 ARG C C 53 175.796 175.796 177.011 -1.215 17865
3452 1 6 . 1 1 28 28 ARG CA C 53 55.738 55.738 56.171 -0.433 17865
3453 1 6 . 1 1 28 28 ARG CB C 53 30.237 30.237 29.350 0.887 17865
3454 1 6 . 1 1 28 28 ARG H H 53 7.894 7.894 8.224 -0.330 17865
3455 1 6 . 1 1 29 29 GLU N N 54 122.318 122.318 122.236 0.082 17865
3456 1 6 . 1 1 29 29 GLU HA H 54 3.595 3.595 3.913 -0.318 17865
3457 1 6 . 1 1 29 29 GLU C C 54 177.523 177.523 177.673 -0.150 17865
3458 1 6 . 1 1 29 29 GLU CA C 54 61.223 61.223 59.904 1.319 17865
3459 1 6 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.412 -0.475 17865
3460 1 6 . 1 1 29 29 GLU H H 54 7.730 7.730 7.625 0.105 17865
3461 1 6 . 1 1 30 30 LYS N N 55 118.377 118.377 117.429 0.948 17865
3462 1 6 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.033 -0.205 17865
3463 1 6 . 1 1 30 30 LYS C C 55 179.205 179.205 178.893 0.312 17865
3464 1 6 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.344 1.083 17865
3465 1 6 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.245 -0.643 17865
3466 1 6 . 1 1 30 30 LYS H H 55 8.659 8.659 7.484 1.175 17865
3467 1 6 . 1 1 31 31 ASP N N 56 121.614 121.614 119.182 2.432 17865
3468 1 6 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.639 -0.328 17865
3469 1 6 . 1 1 31 31 ASP C C 56 177.393 177.393 177.543 -0.150 17865
3470 1 6 . 1 1 31 31 ASP CA C 56 57.316 57.316 56.699 0.617 17865
3471 1 6 . 1 1 31 31 ASP CB C 56 40.423 40.423 41.190 -0.767 17865
3472 1 6 . 1 1 31 31 ASP H H 56 7.646 7.646 8.217 -0.571 17865
3473 1 6 . 1 1 32 32 CYS N N 57 120.345 120.345 120.140 0.205 17865
3474 1 6 . 1 1 32 32 CYS HA H 57 3.601 3.601 4.030 -0.429 17865
3475 1 6 . 1 1 32 32 CYS C C 57 175.772 175.772 176.708 -0.936 17865
3476 1 6 . 1 1 32 32 CYS CA C 57 60.197 60.197 60.569 -0.372 17865
3477 1 6 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.839 8.127 17865
3478 1 6 . 1 1 32 32 CYS H H 57 8.042 8.042 7.589 0.453 17865
3479 1 6 . 1 1 33 33 ARG N N 58 120.293 120.293 118.768 1.525 17865
3480 1 6 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.884 -0.208 17865
3481 1 6 . 1 1 33 33 ARG C C 58 179.633 179.633 178.149 1.484 17865
3482 1 6 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.162 1.224 17865
3483 1 6 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.345 0.496 17865
3484 1 6 . 1 1 33 33 ARG H H 58 8.531 8.531 8.394 0.137 17865
3485 1 6 . 1 1 34 34 LYS N N 59 121.166 121.166 119.008 2.158 17865
3486 1 6 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.196 -0.160 17865
3487 1 6 . 1 1 34 34 LYS C C 59 179.220 179.220 178.372 0.848 17865
3488 1 6 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.237 1.293 17865
3489 1 6 . 1 1 34 34 LYS CB C 59 32.110 32.110 32.385 -0.275 17865
3490 1 6 . 1 1 34 34 LYS H H 59 7.633 7.633 7.456 0.177 17865
3491 1 6 . 1 1 35 35 ASP N N 60 122.166 122.166 119.535 2.631 17865
3492 1 6 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.545 -0.114 17865
3493 1 6 . 1 1 35 35 ASP C C 60 179.709 179.709 178.809 0.900 17865
3494 1 6 . 1 1 35 35 ASP CA C 60 57.703 57.703 56.967 0.736 17865
3495 1 6 . 1 1 35 35 ASP CB C 60 40.672 40.672 41.419 -0.747 17865
3496 1 6 . 1 1 35 35 ASP H H 60 8.221 8.221 8.022 0.199 17865
3497 1 6 . 1 1 36 36 VAL N N 61 121.312 121.312 119.013 2.299 17865
3498 1 6 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.867 -0.466 17865
3499 1 6 . 1 1 36 36 VAL C C 61 178.339 178.339 177.928 0.411 17865
3500 1 6 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.813 1.320 17865
3501 1 6 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.703 -0.046 17865
3502 1 6 . 1 1 36 36 VAL H H 61 8.916 8.916 8.368 0.548 17865
3503 1 6 . 1 1 37 37 GLN N N 62 119.166 119.166 117.819 1.347 17865
3504 1 6 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.120 -0.178 17865
3505 1 6 . 1 1 37 37 GLN C C 62 177.293 177.293 176.628 0.665 17865
3506 1 6 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.623 0.657 17865
3507 1 6 . 1 1 37 37 GLN CB C 62 28.371 28.371 27.989 0.382 17865
3508 1 6 . 1 1 37 37 GLN H H 62 7.697 7.697 8.340 -0.643 17865
3509 1 6 . 1 1 38 38 ALA N N 63 118.964 118.964 119.734 -0.770 17865
3510 1 6 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.243 -0.001 17865
3511 1 6 . 1 1 38 38 ALA C C 63 177.221 177.221 177.452 -0.231 17865
3512 1 6 . 1 1 38 38 ALA CA C 63 53.137 53.137 53.020 0.117 17865
3513 1 6 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.018 -0.121 17865
3514 1 6 . 1 1 38 38 ALA H H 63 7.508 7.508 7.421 0.087 17865
3515 1 6 . 1 1 39 39 CYS N N 64 119.081 119.081 117.980 1.101 17865
3516 1 6 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.489 0.464 17865
3517 1 6 . 1 1 39 39 CYS C C 64 172.052 172.052 174.535 -2.483 17865
3518 1 6 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.644 -6.764 17865
3519 1 6 . 1 1 39 39 CYS CB C 64 34.328 34.328 25.996 8.332 17865
3520 1 6 . 1 1 39 39 CYS H H 64 7.354 7.354 7.582 -0.228 17865
3521 1 6 . 1 1 40 40 ASP N N 65 124.167 124.167 125.805 -1.638 17865
3522 1 6 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.498 -0.173 17865
3523 1 6 . 1 1 40 40 ASP C C 65 176.496 176.496 176.733 -0.237 17865
3524 1 6 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.424 0.300 17865
3525 1 6 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.361 -0.048 17865
3526 1 6 . 1 1 40 40 ASP H H 65 8.142 8.142 8.674 -0.532 17865
3527 1 6 . 1 1 41 41 LYS N N 66 118.844 118.844 120.435 -1.591 17865
3528 1 6 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.566 -0.042 17865
3529 1 6 . 1 1 41 41 LYS C C 66 175.586 175.586 176.176 -0.590 17865
3530 1 6 . 1 1 41 41 LYS CA C 66 55.275 55.275 55.414 -0.140 17865
3531 1 6 . 1 1 41 41 LYS CB C 66 32.598 32.598 32.084 0.514 17865
3532 1 6 . 1 1 41 41 LYS H H 66 7.858 7.858 8.315 -0.457 17865
3533 1 6 . 1 1 42 42 LYS N N 67 126.081 126.081 122.157 3.924 17865
3534 1 6 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.196 -0.281 17865
3535 1 6 . 1 1 42 42 LYS C C 67 174.665 174.665 175.416 -0.751 17865
3536 1 6 . 1 1 42 42 LYS CA C 67 57.827 57.827 56.829 0.998 17865
3537 1 6 . 1 1 42 42 LYS CB C 67 34.059 34.059 32.911 1.148 17865
3538 1 6 . 1 1 42 42 LYS H H 67 8.790 8.790 8.689 0.101 17865
3539 1 6 . 1 1 43 43 TYR N N 68 114.138 114.138 116.377 -2.239 17865
3540 1 6 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.828 0.431 17865
3541 1 6 . 1 1 43 43 TYR C C 68 175.767 175.767 175.879 -0.112 17865
3542 1 6 . 1 1 43 43 TYR CA C 68 55.880 55.880 56.227 -0.347 17865
3543 1 6 . 1 1 43 43 TYR CB C 68 42.363 42.363 41.571 0.792 17865
3544 1 6 . 1 1 43 43 TYR H H 68 7.294 7.294 7.415 -0.121 17865
3545 1 6 . 1 1 44 44 ASP N N 69 121.807 121.807 122.358 -0.551 17865
3546 1 6 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.574 0.066 17865
3547 1 6 . 1 1 44 44 ASP C C 69 177.812 177.812 176.352 1.460 17865
3548 1 6 . 1 1 44 44 ASP CA C 69 52.110 52.110 53.781 -1.671 17865
3549 1 6 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.309 -1.869 17865
3550 1 6 . 1 1 44 44 ASP H H 69 8.995 8.995 8.985 0.010 17865
3551 1 6 . 1 1 45 45 ASP N N 70 116.686 116.686 120.239 -3.553 17865
3552 1 6 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.422 0.002 17865
3553 1 6 . 1 1 45 45 ASP C C 70 177.054 177.054 176.797 0.257 17865
3554 1 6 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.623 -0.242 17865
3555 1 6 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.809 -0.561 17865
3556 1 6 . 1 1 45 45 ASP H H 70 8.369 8.369 8.706 -0.337 17865
3557 1 6 . 1 1 46 46 GLN N N 71 117.949 117.949 116.186 1.763 17865
3558 1 6 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.368 0.088 17865
3559 1 6 . 1 1 46 46 GLN C C 71 176.273 176.273 176.810 -0.537 17865
3560 1 6 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.175 0.192 17865
3561 1 6 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.661 -0.331 17865
3562 1 6 . 1 1 46 46 GLN H H 71 8.274 8.274 7.876 0.398 17865
3563 1 6 . 1 1 47 47 GLY N N 72 108.369 108.369 105.234 3.135 17865
3564 1 6 . 1 1 47 47 GLY C C 72 174.145 174.145 174.186 -0.041 17865
3565 1 6 . 1 1 47 47 GLY CA C 72 45.823 45.823 44.805 1.018 17865
3566 1 6 . 1 1 47 47 GLY H H 72 8.174 8.174 8.197 -0.023 17865
3567 1 6 . 1 1 48 48 ARG N N 73 121.554 121.554 119.605 1.949 17865
3568 1 6 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.708 -0.223 17865
3569 1 6 . 1 1 48 48 ARG C C 73 176.855 176.855 175.333 1.522 17865
3570 1 6 . 1 1 48 48 ARG CA C 73 55.289 55.289 52.834 2.455 17865
3571 1 6 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.559 -1.001 17865
3572 1 6 . 1 1 48 48 ARG H H 73 8.462 8.462 9.076 -0.614 17865
3573 1 6 . 1 1 49 49 GLU N N 74 122.784 122.784 121.060 1.724 17865
3574 1 6 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.369 0.114 17865
3575 1 6 . 1 1 49 49 GLU C C 74 178.098 178.098 176.950 1.148 17865
3576 1 6 . 1 1 49 49 GLU CA C 74 57.184 57.184 56.792 0.392 17865
3577 1 6 . 1 1 49 49 GLU CB C 74 30.777 30.777 29.850 0.927 17865
3578 1 6 . 1 1 49 49 GLU H H 74 8.703 8.703 8.620 0.083 17865
3579 1 6 . 1 1 50 50 THR N N 75 114.563 114.563 115.976 -1.413 17865
3580 1 6 . 1 1 50 50 THR HA H 75 4.212 4.212 4.377 -0.165 17865
3581 1 6 . 1 1 50 50 THR C C 75 175.170 175.170 175.521 -0.351 17865
3582 1 6 . 1 1 50 50 THR CA C 75 60.589 60.589 60.696 -0.107 17865
3583 1 6 . 1 1 50 50 THR CB C 75 70.952 70.952 70.270 0.682 17865
3584 1 6 . 1 1 50 50 THR H H 75 7.717 7.717 8.132 -0.415 17865
3585 1 6 . 1 1 51 51 ALA N N 76 122.097 122.097 122.926 -0.829 17865
3586 1 6 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.037 0.001 17865
3587 1 6 . 1 1 51 51 ALA C C 76 181.906 181.906 179.470 2.436 17865
3588 1 6 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.198 0.456 17865
3589 1 6 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.099 -0.106 17865
3590 1 6 . 1 1 51 51 ALA H H 76 8.734 8.734 8.634 0.100 17865
3591 1 6 . 1 1 52 52 CYS N N 77 115.347 115.347 116.265 -0.918 17865
3592 1 6 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.111 0.369 17865
3593 1 6 . 1 1 52 52 CYS C C 77 176.299 176.299 176.799 -0.500 17865
3594 1 6 . 1 1 52 52 CYS CA C 77 57.701 57.701 59.999 -2.298 17865
3595 1 6 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.424 10.207 17865
3596 1 6 . 1 1 52 52 CYS H H 77 9.073 9.073 8.395 0.678 17865
3597 1 6 . 1 1 53 53 ALA N N 78 128.517 128.517 124.409 4.108 17865
3598 1 6 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.881 -0.026 17865
3599 1 6 . 1 1 53 53 ALA C C 78 178.736 178.736 179.154 -0.418 17865
3600 1 6 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.112 0.521 17865
3601 1 6 . 1 1 53 53 ALA CB C 78 19.191 19.191 18.011 1.180 17865
3602 1 6 . 1 1 53 53 ALA H H 78 7.174 7.174 7.927 -0.753 17865
3603 1 6 . 1 1 54 54 LYS N N 79 118.706 118.706 119.408 -0.702 17865
3604 1 6 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.156 -0.353 17865
3605 1 6 . 1 1 54 54 LYS C C 79 179.611 179.611 178.894 0.717 17865
3606 1 6 . 1 1 54 54 LYS CA C 79 59.725 59.725 57.888 1.837 17865
3607 1 6 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.126 0.527 17865
3608 1 6 . 1 1 54 54 LYS H H 79 8.313 8.313 7.978 0.335 17865
3609 1 6 . 1 1 55 55 GLY N N 80 104.822 104.822 108.375 -3.553 17865
3610 1 6 . 1 1 55 55 GLY C C 80 176.504 176.504 176.059 0.445 17865
3611 1 6 . 1 1 55 55 GLY CA C 80 46.839 46.839 47.138 -0.299 17865
3612 1 6 . 1 1 55 55 GLY H H 80 8.175 8.175 7.806 0.369 17865
3613 1 6 . 1 1 56 56 ILE N N 81 123.697 123.697 123.451 0.246 17865
3614 1 6 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.551 0.244 17865
3615 1 6 . 1 1 56 56 ILE C C 81 177.334 177.334 178.030 -0.696 17865
3616 1 6 . 1 1 56 56 ILE CA C 81 65.281 65.281 65.514 -0.233 17865
3617 1 6 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.681 0.653 17865
3618 1 6 . 1 1 56 56 ILE H H 81 7.590 7.590 8.211 -0.621 17865
3619 1 6 . 1 1 57 57 ARG N N 82 118.161 118.161 118.765 -0.604 17865
3620 1 6 . 1 1 57 57 ARG HA H 82 3.935 3.935 3.894 0.041 17865
3621 1 6 . 1 1 57 57 ARG C C 82 178.662 178.662 178.788 -0.126 17865
3622 1 6 . 1 1 57 57 ARG CA C 82 59.702 59.702 58.835 0.867 17865
3623 1 6 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.415 0.484 17865
3624 1 6 . 1 1 57 57 ARG H H 82 7.569 7.569 8.170 -0.601 17865
3625 1 6 . 1 1 58 58 GLU N N 83 115.085 115.085 116.940 -1.855 17865
3626 1 6 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.064 -0.033 17865
3627 1 6 . 1 1 58 58 GLU C C 83 178.224 178.224 178.315 -0.091 17865
3628 1 6 . 1 1 58 58 GLU CA C 83 58.304 58.304 57.482 0.822 17865
3629 1 6 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.126 0.905 17865
3630 1 6 . 1 1 58 58 GLU H H 83 7.786 7.786 7.933 -0.147 17865
3631 1 6 . 1 1 59 59 LYS N N 84 119.183 119.183 118.724 0.459 17865
3632 1 6 . 1 1 59 59 LYS HA H 84 3.830 3.830 3.887 -0.057 17865
3633 1 6 . 1 1 59 59 LYS C C 84 177.933 177.933 178.631 -0.698 17865
3634 1 6 . 1 1 59 59 LYS CA C 84 59.043 59.043 59.236 -0.193 17865
3635 1 6 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.812 0.838 17865
3636 1 6 . 1 1 59 59 LYS H H 84 7.968 7.968 8.015 -0.047 17865
3637 1 6 . 1 1 60 60 TYR N N 85 113.663 113.663 115.887 -2.224 17865
3638 1 6 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.646 0.057 17865
3639 1 6 . 1 1 60 60 TYR C C 85 174.729 174.729 174.750 -0.021 17865
3640 1 6 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.554 0.647 17865
3641 1 6 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.472 0.430 17865
3642 1 6 . 1 1 60 60 TYR H H 85 7.562 7.562 8.083 -0.521 17865
3643 1 6 . 1 1 61 61 LYS N N 86 121.862 121.862 121.954 -0.092 17865
3644 1 6 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.604 -0.092 17865
3645 1 6 . 1 1 61 61 LYS CA C 86 54.942 54.942 54.978 -0.036 17865
3646 1 6 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.607 -0.505 17865
3647 1 6 . 1 1 61 61 LYS H H 86 7.222 7.222 7.582 -0.360 17865
3648 1 6 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.659 -0.336 17865
3649 1 6 . 1 1 62 62 PRO C C 87 176.576 176.576 176.674 -0.098 17865
3650 1 6 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.265 0.755 17865
3651 1 6 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.712 -0.472 17865
3652 1 6 . 1 1 63 63 ALA N N 88 125.029 125.029 122.875 2.154 17865
3653 1 6 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.282 -0.028 17865
3654 1 6 . 1 1 63 63 ALA C C 88 177.301 177.301 176.877 0.424 17865
3655 1 6 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.181 0.100 17865
3656 1 6 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.446 1.756 17865
3657 1 6 . 1 1 63 63 ALA H H 88 8.329 8.329 8.243 0.086 17865
3658 1 6 . 1 1 64 64 VAL N N 89 121.843 121.843 120.345 1.498 17865
3659 1 6 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.389 -0.445 17865
3660 1 6 . 1 1 64 64 VAL C C 89 174.791 174.791 174.744 0.047 17865
3661 1 6 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.289 1.692 17865
3662 1 6 . 1 1 64 64 VAL CB C 89 33.485 33.485 34.869 -1.384 17865
3663 1 6 . 1 1 64 64 VAL H H 89 8.075 8.075 7.832 0.243 17865
3664 1 6 . 1 1 65 65 VAL N N 90 125.399 125.399 120.431 4.968 17865
3665 1 6 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.386 -0.248 17865
3666 1 6 . 1 1 65 65 VAL C C 90 174.340 174.340 174.476 -0.136 17865
3667 1 6 . 1 1 65 65 VAL CA C 90 61.162 61.162 61.764 -0.602 17865
3668 1 6 . 1 1 65 65 VAL CB C 90 33.866 33.866 31.550 2.316 17865
3669 1 6 . 1 1 65 65 VAL H H 90 8.229 8.229 8.014 0.215 17865
3670 1 6 . 1 1 66 66 TYR N N 91 124.848 124.848 125.613 -0.765 17865
3671 1 6 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.777 -0.006 17865
3672 1 6 . 1 1 66 66 TYR C C 91 176.658 176.658 176.537 0.121 17865
3673 1 6 . 1 1 66 66 TYR CA C 91 58.084 58.084 56.998 1.086 17865
3674 1 6 . 1 1 66 66 TYR CB C 91 41.535 41.535 41.954 -0.419 17865
3675 1 6 . 1 1 66 66 TYR H H 91 9.145 9.145 8.111 1.034 17865
3676 1 6 . 1 1 67 67 GLY N N 92 106.185 106.185 107.475 -1.290 17865
3677 1 6 . 1 1 67 67 GLY C C 92 175.681 175.681 174.953 0.728 17865
3678 1 6 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.796 0.179 17865
3679 1 6 . 1 1 67 67 GLY H H 92 8.730 8.730 8.877 -0.147 17865
3680 1 6 . 1 1 68 68 TYR N N 93 121.815 121.815 118.799 3.016 17865
3681 1 6 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.366 -0.391 17865
3682 1 6 . 1 1 68 68 TYR C C 93 176.035 176.035 176.138 -0.103 17865
3683 1 6 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.238 1.808 17865
3684 1 6 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.181 0.244 17865
3685 1 6 . 1 1 68 68 TYR H H 93 8.711 8.711 8.448 0.263 17865
3686 1 6 . 1 1 69 69 ASP N N 94 115.507 115.507 118.817 -3.310 17865
3687 1 6 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.557 -0.269 17865
3688 1 6 . 1 1 69 69 ASP C C 94 177.063 177.063 177.071 -0.008 17865
3689 1 6 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.416 -0.405 17865
3690 1 6 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.810 -0.643 17865
3691 1 6 . 1 1 69 69 ASP H H 94 8.010 8.010 7.533 0.477 17865
3692 1 6 . 1 1 70 70 GLY N N 95 107.196 107.196 108.014 -0.818 17865
3693 1 6 . 1 1 70 70 GLY C C 95 173.936 173.936 173.867 0.069 17865
3694 1 6 . 1 1 70 70 GLY CA C 95 45.392 45.392 45.066 0.326 17865
3695 1 6 . 1 1 70 70 GLY H H 95 7.986 7.986 7.724 0.262 17865
3696 1 6 . 1 1 71 71 LYS N N 96 121.258 121.258 120.413 0.845 17865
3697 1 6 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.718 0.066 17865
3698 1 6 . 1 1 71 71 LYS CA C 96 54.114 54.114 53.071 1.043 17865
3699 1 6 . 1 1 71 71 LYS CB C 96 31.762 31.762 33.180 -1.418 17865
3700 1 6 . 1 1 71 71 LYS H H 96 7.877 7.877 7.903 -0.026 17865
3701 1 6 . 1 1 72 72 PRO C C 97 177.170 177.170 175.680 1.490 17865
3702 1 6 . 1 1 72 72 PRO CA C 97 63.137 63.137 63.136 0.001 17865
3703 1 6 . 1 1 72 72 PRO CB C 97 32.240 32.240 30.240 2.000 17865
3704 1 6 . 1 1 73 73 LEU N N 98 123.503 123.503 121.387 2.116 17865
3705 1 6 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.851 -0.491 17865
3706 1 6 . 1 1 73 73 LEU C C 98 176.354 176.354 174.820 1.534 17865
3707 1 6 . 1 1 73 73 LEU CA C 98 53.927 53.927 53.530 0.397 17865
3708 1 6 . 1 1 73 73 LEU CB C 98 42.272 42.272 46.105 -3.833 17865
3709 1 6 . 1 1 73 73 LEU H H 98 8.850 8.850 7.817 1.033 17865
3710 1 6 . 1 1 74 74 ASP N N 99 122.212 122.212 118.364 3.848 17865
3711 1 6 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.925 -0.328 17865
3712 1 6 . 1 1 74 74 ASP C C 99 175.819 175.819 176.669 -0.850 17865
3713 1 6 . 1 1 74 74 ASP CA C 99 53.856 53.856 53.004 0.852 17865
3714 1 6 . 1 1 74 74 ASP CB C 99 40.989 40.989 42.810 -1.821 17865
3715 1 6 . 1 1 74 74 ASP H H 99 8.517 8.517 8.310 0.207 17865
3716 1 6 . 1 1 75 75 LEU N N 100 125.874 125.874 115.442 10.432 17865
3717 1 6 . 1 1 75 75 LEU HA H 100 4.366 4.366 3.761 0.605 17865
3718 1 6 . 1 1 75 75 LEU C C 100 178.426 178.426 177.769 0.657 17865
3719 1 6 . 1 1 75 75 LEU CA C 100 53.631 53.631 56.531 -2.900 17865
3720 1 6 . 1 1 75 75 LEU CB C 100 40.676 40.676 40.828 -0.152 17865
3721 1 6 . 1 1 75 75 LEU H H 100 8.281 8.281 8.786 -0.505 17865
3722 1 6 . 1 1 76 76 GLY N N 101 110.604 110.604 108.470 2.134 17865
3723 1 6 . 1 1 76 76 GLY C C 101 176.936 176.936 175.498 1.438 17865
3724 1 6 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.800 0.027 17865
3725 1 6 . 1 1 76 76 GLY H H 101 8.914 8.914 7.981 0.933 17865
3726 1 6 . 1 1 77 77 PHE N N 102 117.639 117.639 113.117 4.522 17865
3727 1 6 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.925 -0.544 17865
3728 1 6 . 1 1 77 77 PHE C C 102 177.878 177.878 174.866 3.012 17865
3729 1 6 . 1 1 77 77 PHE CA C 102 59.139 59.139 55.884 3.255 17865
3730 1 6 . 1 1 77 77 PHE CB C 102 36.935 36.935 37.980 -1.045 17865
3731 1 6 . 1 1 77 77 PHE H H 102 7.992 7.992 7.732 0.260 17865
3732 1 6 . 1 1 78 78 CYS N N 103 121.136 121.136 118.079 3.057 17865
3733 1 6 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.542 -0.157 17865
3734 1 6 . 1 1 78 78 CYS C C 103 172.780 172.780 176.531 -3.751 17865
3735 1 6 . 1 1 78 78 CYS CA C 103 53.696 53.696 57.990 -4.294 17865
3736 1 6 . 1 1 78 78 CYS CB C 103 34.237 34.237 28.749 5.488 17865
3737 1 6 . 1 1 78 78 CYS H H 103 7.362 7.362 7.921 -0.559 17865
3738 1 6 . 1 1 79 79 THR N N 104 114.773 114.773 117.177 -2.404 17865
3739 1 6 . 1 1 79 79 THR HA H 104 3.984 3.984 4.297 -0.313 17865
3740 1 6 . 1 1 79 79 THR C C 104 176.624 176.624 176.535 0.089 17865
3741 1 6 . 1 1 79 79 THR CA C 104 65.180 65.180 65.385 -0.205 17865
3742 1 6 . 1 1 79 79 THR CB C 104 69.062 69.062 68.721 0.341 17865
3743 1 6 . 1 1 79 79 THR H H 104 7.864 7.864 8.482 -0.618 17865
3744 1 6 . 1 1 80 80 LEU N N 105 119.785 119.785 122.037 -2.252 17865
3745 1 6 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.282 0.049 17865
3746 1 6 . 1 1 80 80 LEU C C 105 177.208 177.208 177.824 -0.616 17865
3747 1 6 . 1 1 80 80 LEU CA C 105 55.453 55.453 56.186 -0.733 17865
3748 1 6 . 1 1 80 80 LEU CB C 105 41.293 41.293 40.131 1.162 17865
3749 1 6 . 1 1 80 80 LEU H H 105 7.238 7.238 8.043 -0.805 17865
3750 1 6 . 1 1 81 81 ALA N N 106 119.309 119.309 118.294 1.015 17865
3751 1 6 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.478 0.049 17865
3752 1 6 . 1 1 81 81 ALA C C 106 178.769 178.769 178.081 0.688 17865
3753 1 6 . 1 1 81 81 ALA CA C 106 52.049 52.049 51.902 0.147 17865
3754 1 6 . 1 1 81 81 ALA CB C 106 18.820 18.820 19.763 -0.943 17865
3755 1 6 . 1 1 81 81 ALA H H 106 7.432 7.432 7.802 -0.370 17865
3756 1 6 . 1 1 82 82 GLY N N 107 109.793 109.793 108.812 0.981 17865
3757 1 6 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.864 1.255 17865
3758 1 6 . 1 1 82 82 GLY H H 107 7.918 7.918 7.614 0.304 17865
3759 1 6 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.820 0.446 17865
3760 1 6 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.594 -0.331 17865
3761 1 6 . 1 1 83 83 ILE CB C 108 38.261 38.261 37.900 0.361 17865
3762 1 6 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.072 0.683 17865
3763 1 6 . 1 1 84 84 ARG C C 109 181.344 181.344 177.835 3.509 17865
3764 1 6 . 1 1 84 84 ARG CA C 109 55.939 55.939 55.629 0.310 17865
3765 1 6 . 1 1 84 84 ARG CB C 109 30.283 30.283 28.721 1.562 17865
3766 1 6 . 1 1 85 85 GLU N N 110 122.944 122.944 120.171 2.773 17865
3767 1 6 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.025 -0.408 17865
3768 1 6 . 1 1 85 85 GLU C C 110 177.797 177.797 178.091 -0.294 17865
3769 1 6 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.260 1.468 17865
3770 1 6 . 1 1 85 85 GLU CB C 110 28.871 28.871 28.777 0.094 17865
3771 1 6 . 1 1 85 85 GLU H H 110 8.003 8.003 8.220 -0.217 17865
3772 1 6 . 1 1 86 86 VAL N N 111 117.101 117.101 120.634 -3.533 17865
3773 1 6 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.570 -0.059 17865
3774 1 6 . 1 1 86 86 VAL C C 111 177.710 177.710 177.878 -0.168 17865
3775 1 6 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.971 -0.541 17865
3776 1 6 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.159 0.054 17865
3777 1 6 . 1 1 86 86 VAL H H 111 8.106 8.106 7.440 0.666 17865
3778 1 6 . 1 1 87 87 ASP N N 112 122.242 122.242 119.686 2.556 17865
3779 1 6 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.329 -0.025 17865
3780 1 6 . 1 1 87 87 ASP C C 112 176.912 176.912 178.376 -1.464 17865
3781 1 6 . 1 1 87 87 ASP CA C 112 57.417 57.417 57.708 -0.291 17865
3782 1 6 . 1 1 87 87 ASP CB C 112 40.476 40.476 40.486 -0.010 17865
3783 1 6 . 1 1 87 87 ASP H H 112 7.401 7.401 7.705 -0.304 17865
3784 1 6 . 1 1 88 88 CYS N N 113 120.819 120.819 120.140 0.679 17865
3785 1 6 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.027 -0.718 17865
3786 1 6 . 1 1 88 88 CYS C C 113 175.270 175.270 176.956 -1.686 17865
3787 1 6 . 1 1 88 88 CYS CA C 113 59.759 59.759 62.389 -2.630 17865
3788 1 6 . 1 1 88 88 CYS CB C 113 33.835 33.835 25.978 7.857 17865
3789 1 6 . 1 1 88 88 CYS H H 113 7.785 7.785 7.913 -0.128 17865
3790 1 6 . 1 1 89 89 ARG N N 114 118.654 118.654 119.939 -1.285 17865
3791 1 6 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.040 -0.399 17865
3792 1 6 . 1 1 89 89 ARG C C 114 179.018 179.018 178.565 0.453 17865
3793 1 6 . 1 1 89 89 ARG CA C 114 60.193 60.193 58.934 1.259 17865
3794 1 6 . 1 1 89 89 ARG CB C 114 29.713 29.713 29.746 -0.033 17865
3795 1 6 . 1 1 89 89 ARG H H 114 8.142 8.142 8.006 0.136 17865
3796 1 6 . 1 1 90 90 LYS N N 115 120.964 120.964 117.284 3.680 17865
3797 1 6 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.169 -0.139 17865
3798 1 6 . 1 1 90 90 LYS C C 115 180.092 180.092 178.080 2.012 17865
3799 1 6 . 1 1 90 90 LYS CA C 115 59.568 59.568 59.164 0.404 17865
3800 1 6 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.286 -0.065 17865
3801 1 6 . 1 1 90 90 LYS H H 115 7.936 7.936 7.524 0.412 17865
3802 1 6 . 1 1 91 91 ASP N N 116 121.690 121.690 118.275 3.415 17865
3803 1 6 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.690 -0.177 17865
3804 1 6 . 1 1 91 91 ASP C C 116 179.419 179.419 177.773 1.646 17865
3805 1 6 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.982 0.255 17865
3806 1 6 . 1 1 91 91 ASP CB C 116 40.648 40.648 41.864 -1.216 17865
3807 1 6 . 1 1 91 91 ASP H H 116 8.558 8.558 8.388 0.170 17865
3808 1 6 . 1 1 92 92 ALA N N 117 122.784 122.784 121.788 0.996 17865
3809 1 6 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.162 -0.139 17865
3810 1 6 . 1 1 92 92 ALA C C 117 178.789 178.789 179.297 -0.508 17865
3811 1 6 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.133 -0.082 17865
3812 1 6 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.945 0.230 17865
3813 1 6 . 1 1 92 92 ALA H H 117 8.703 8.703 7.750 0.953 17865
3814 1 6 . 1 1 93 93 GLN N N 118 115.510 115.510 115.905 -0.395 17865
3815 1 6 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.164 -0.220 17865
3816 1 6 . 1 1 93 93 GLN C C 118 178.745 178.745 177.393 1.352 17865
3817 1 6 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.917 0.565 17865
3818 1 6 . 1 1 93 93 GLN CB C 118 28.397 28.397 27.602 0.795 17865
3819 1 6 . 1 1 93 93 GLN H H 118 7.664 7.664 8.494 -0.830 17865
3820 1 6 . 1 1 94 94 THR N N 119 110.110 110.110 109.912 0.198 17865
3821 1 6 . 1 1 94 94 THR HA H 119 4.237 4.237 4.317 -0.080 17865
3822 1 6 . 1 1 94 94 THR C C 119 175.861 175.861 176.308 -0.447 17865
3823 1 6 . 1 1 94 94 THR CA C 119 64.604 64.604 63.571 1.033 17865
3824 1 6 . 1 1 94 94 THR CB C 119 69.716 69.716 69.171 0.545 17865
3825 1 6 . 1 1 94 94 THR H H 119 7.726 7.726 7.790 -0.064 17865
3826 1 6 . 1 1 95 95 CYS N N 120 118.523 118.523 123.640 -5.117 17865
3827 1 6 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.393 0.340 17865
3828 1 6 . 1 1 95 95 CYS C C 120 175.165 175.165 175.342 -0.177 17865
3829 1 6 . 1 1 95 95 CYS CA C 120 52.973 52.973 59.881 -6.908 17865
3830 1 6 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.791 11.941 17865
3831 1 6 . 1 1 95 95 CYS H H 120 7.756 7.756 8.097 -0.341 17865
3832 1 6 . 1 1 96 96 ASP N N 121 119.081 119.081 122.628 -3.547 17865
3833 1 6 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.351 0.327 17865
3834 1 6 . 1 1 96 96 ASP CA C 121 56.224 56.224 56.901 -0.677 17865
3835 1 6 . 1 1 96 96 ASP CB C 121 42.731 42.731 40.826 1.905 17865
3836 1 6 . 1 1 96 96 ASP H H 121 7.354 7.354 8.763 -1.409 17865
3837 1 6 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.484 -0.909 17865
3838 1 6 . 1 1 97 97 LYS C C 122 175.510 175.510 176.716 -1.206 17865
3839 1 6 . 1 1 97 97 LYS CA C 122 57.839 57.839 56.636 1.204 17865
3840 1 6 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.463 -3.713 17865
3841 1 6 . 1 1 98 98 LYS N N 123 119.980 119.980 117.120 2.860 17865
3842 1 6 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.611 -0.317 17865
3843 1 6 . 1 1 98 98 LYS C C 123 176.968 176.968 177.420 -0.452 17865
3844 1 6 . 1 1 98 98 LYS CA C 123 55.904 55.904 56.366 -0.462 17865
3845 1 6 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.206 0.026 17865
3846 1 6 . 1 1 98 98 LYS H H 123 7.799 7.799 8.386 -0.587 17865
3847 1 6 . 1 1 99 99 TYR N N 124 122.378 122.378 122.299 0.079 17865
3848 1 6 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.145 -0.250 17865
3849 1 6 . 1 1 99 99 TYR C C 124 177.126 177.126 177.997 -0.871 17865
3850 1 6 . 1 1 99 99 TYR CA C 124 60.211 60.211 61.260 -1.049 17865
3851 1 6 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.698 -0.427 17865
3852 1 6 . 1 1 99 99 TYR H H 124 8.536 8.536 8.305 0.231 17865
3853 1 6 . 1 1 100 100 GLU N N 125 118.610 118.610 116.806 1.804 17865
3854 1 6 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.189 0.079 17865
3855 1 6 . 1 1 100 100 GLU C C 125 177.387 177.387 178.057 -0.670 17865
3856 1 6 . 1 1 100 100 GLU CA C 125 55.759 55.759 56.133 -0.374 17865
3857 1 6 . 1 1 100 100 GLU CB C 125 27.321 27.321 28.972 -1.651 17865
3858 1 6 . 1 1 100 100 GLU H H 125 8.385 8.385 8.425 -0.040 17865
3859 1 6 . 1 1 101 101 SER N N 126 115.949 115.949 116.363 -0.414 17865
3860 1 6 . 1 1 101 101 SER HA H 126 3.959 3.959 4.261 -0.302 17865
3861 1 6 . 1 1 101 101 SER C C 126 176.047 176.047 176.004 0.043 17865
3862 1 6 . 1 1 101 101 SER CA C 126 62.439 62.439 60.844 1.595 17865
3863 1 6 . 1 1 101 101 SER CB C 126 63.299 63.299 62.933 0.366 17865
3864 1 6 . 1 1 101 101 SER H H 126 7.823 7.823 7.594 0.229 17865
3865 1 6 . 1 1 102 102 ASP N N 127 120.920 120.920 121.518 -0.598 17865
3866 1 6 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.279 0.128 17865
3867 1 6 . 1 1 102 102 ASP C C 127 178.234 178.234 178.019 0.215 17865
3868 1 6 . 1 1 102 102 ASP CA C 127 57.411 57.411 58.022 -0.611 17865
3869 1 6 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.702 -0.986 17865
3870 1 6 . 1 1 102 102 ASP H H 127 8.683 8.683 7.738 0.945 17865
3871 1 6 . 1 1 103 103 LYS N N 128 121.753 121.753 118.267 3.486 17865
3872 1 6 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.013 -0.009 17865
3873 1 6 . 1 1 103 103 LYS C C 128 179.395 179.395 178.746 0.649 17865
3874 1 6 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.775 0.696 17865
3875 1 6 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.695 0.706 17865
3876 1 6 . 1 1 103 103 LYS H H 128 7.771 7.771 8.223 -0.452 17865
3877 1 6 . 1 1 104 104 CYS N N 129 120.109 120.109 120.270 -0.161 17865
3878 1 6 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.333 -0.139 17865
3879 1 6 . 1 1 104 104 CYS C C 129 176.779 176.779 177.440 -0.661 17865
3880 1 6 . 1 1 104 104 CYS CA C 129 59.790 59.790 61.956 -2.166 17865
3881 1 6 . 1 1 104 104 CYS CB C 129 36.879 36.879 25.901 10.977 17865
3882 1 6 . 1 1 104 104 CYS H H 129 7.973 7.973 7.796 0.177 17865
3883 1 6 . 1 1 105 105 LEU N N 130 121.804 121.804 120.087 1.717 17865
3884 1 6 . 1 1 105 105 LEU HA H 130 4.090 4.090 4.010 0.080 17865
3885 1 6 . 1 1 105 105 LEU C C 130 179.373 179.373 178.958 0.415 17865
3886 1 6 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.356 -0.988 17865
3887 1 6 . 1 1 105 105 LEU CB C 130 42.098 42.098 40.812 1.286 17865
3888 1 6 . 1 1 105 105 LEU H H 130 8.666 8.666 8.656 0.010 17865
3889 1 6 . 1 1 106 106 ASN N N 131 118.535 118.535 117.838 0.697 17865
3890 1 6 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.338 -0.100 17865
3891 1 6 . 1 1 106 106 ASN C C 131 177.830 177.830 177.531 0.299 17865
3892 1 6 . 1 1 106 106 ASN CA C 131 56.256 56.256 56.900 -0.644 17865
3893 1 6 . 1 1 106 106 ASN CB C 131 37.817 37.817 38.359 -0.542 17865
3894 1 6 . 1 1 106 106 ASN H H 131 8.438 8.438 8.038 0.400 17865
3895 1 6 . 1 1 107 107 ALA N N 132 121.485 121.485 123.284 -1.799 17865
3896 1 6 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.212 0.007 17865
3897 1 6 . 1 1 107 107 ALA C C 132 180.726 180.726 179.685 1.041 17865
3898 1 6 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.725 0.238 17865
3899 1 6 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.869 -1.048 17865
3900 1 6 . 1 1 107 107 ALA H H 132 7.541 7.541 7.508 0.033 17865
3901 1 6 . 1 1 108 108 ILE N N 133 120.979 120.979 118.743 2.236 17865
3902 1 6 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.740 0.191 17865
3903 1 6 . 1 1 108 108 ILE C C 133 178.114 178.114 178.172 -0.058 17865
3904 1 6 . 1 1 108 108 ILE CA C 133 63.353 63.353 63.992 -0.639 17865
3905 1 6 . 1 1 108 108 ILE CB C 133 36.454 36.454 36.873 -0.419 17865
3906 1 6 . 1 1 108 108 ILE H H 133 7.551 7.551 8.543 -0.992 17865
3907 1 6 . 1 1 109 109 LYS N N 134 121.415 121.415 118.080 3.335 17865
3908 1 6 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.216 -0.628 17865
3909 1 6 . 1 1 109 109 LYS C C 134 179.561 179.561 178.939 0.622 17865
3910 1 6 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.292 0.816 17865
3911 1 6 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.092 0.069 17865
3912 1 6 . 1 1 109 109 LYS H H 134 8.414 8.414 8.292 0.122 17865
3913 1 6 . 1 1 110 110 GLU N N 135 116.099 116.099 119.232 -3.133 17865
3914 1 6 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.271 -0.342 17865
3915 1 6 . 1 1 110 110 GLU C C 135 178.239 178.239 178.806 -0.567 17865
3916 1 6 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.480 0.166 17865
3917 1 6 . 1 1 110 110 GLU CB C 135 29.638 29.638 28.486 1.152 17865
3918 1 6 . 1 1 110 110 GLU H H 135 7.473 7.473 7.974 -0.501 17865
3919 1 6 . 1 1 111 111 LYS N N 136 119.805 119.805 119.976 -0.171 17865
3920 1 6 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.045 -0.139 17865
3921 1 6 . 1 1 111 111 LYS C C 136 177.600 177.600 177.195 0.405 17865
3922 1 6 . 1 1 111 111 LYS CA C 136 58.749 58.749 57.903 0.846 17865
3923 1 6 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.253 0.985 17865
3924 1 6 . 1 1 111 111 LYS H H 136 7.540 7.540 7.761 -0.221 17865
3925 1 6 . 1 1 112 112 TYR N N 137 114.768 114.768 117.157 -2.389 17865
3926 1 6 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.587 -0.064 17865
3927 1 6 . 1 1 112 112 TYR C C 137 174.690 174.690 174.364 0.326 17865
3928 1 6 . 1 1 112 112 TYR CA C 137 58.359 58.359 56.179 2.180 17865
3929 1 6 . 1 1 112 112 TYR CB C 137 38.328 38.328 37.410 0.918 17865
3930 1 6 . 1 1 112 112 TYR H H 137 7.488 7.488 7.403 0.085 17865
3931 1 6 . 1 1 113 113 LYS N N 138 123.694 123.694 122.037 1.657 17865
3932 1 6 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.345 0.156 17865
3933 1 6 . 1 1 113 113 LYS CA C 138 55.282 55.282 55.123 0.159 17865
3934 1 6 . 1 1 113 113 LYS CB C 138 32.124 32.124 31.748 0.376 17865
3935 1 6 . 1 1 113 113 LYS H H 138 7.217 7.217 7.161 0.056 17865
3936 1 6 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.425 0.027 17865
3937 1 6 . 1 1 114 114 PRO C C 139 176.974 176.974 177.167 -0.193 17865
3938 1 6 . 1 1 114 114 PRO CA C 139 63.189 63.189 62.915 0.274 17865
3939 1 6 . 1 1 114 114 PRO CB C 139 32.251 32.251 31.090 1.161 17865
3940 1 6 . 1 1 115 115 VAL N N 140 121.098 121.098 121.543 -0.445 17865
3941 1 6 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.244 -0.142 17865
3942 1 6 . 1 1 115 115 VAL C C 140 176.207 176.207 175.471 0.736 17865
3943 1 6 . 1 1 115 115 VAL CA C 140 62.356 62.356 61.499 0.857 17865
3944 1 6 . 1 1 115 115 VAL CB C 140 33.256 33.256 30.621 2.635 17865
3945 1 6 . 1 1 115 115 VAL H H 140 8.272 8.272 8.107 0.165 17865
3946 1 6 . 1 1 116 116 VAL N N 141 124.167 124.167 121.893 2.274 17865
3947 1 6 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.048 0.074 17865
3948 1 6 . 1 1 116 116 VAL C C 141 175.415 175.415 176.242 -0.827 17865
3949 1 6 . 1 1 116 116 VAL CA C 141 61.731 61.731 62.832 -1.101 17865
3950 1 6 . 1 1 116 116 VAL CB C 141 33.145 33.145 33.270 -0.125 17865
3951 1 6 . 1 1 116 116 VAL H H 141 8.142 8.142 7.612 0.530 17865
3952 1 6 . 1 1 117 117 ASP N N 142 126.737 126.737 127.558 -0.821 17865
3953 1 6 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.738 0.074 17865
3954 1 6 . 1 1 117 117 ASP CA C 142 52.217 52.217 52.120 0.097 17865
3955 1 6 . 1 1 117 117 ASP CB C 142 41.368 41.368 40.544 0.824 17865
3956 1 6 . 1 1 117 117 ASP H H 142 8.419 8.419 8.245 0.174 17865
3957 1 6 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.408 0.003 17865
3958 1 6 . 1 1 118 118 PRO C C 143 176.662 176.662 176.075 0.587 17865
3959 1 6 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.023 0.224 17865
3960 1 6 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.415 -0.105 17865
3961 1 6 . 1 1 119 119 ASN N N 144 119.287 119.287 123.143 -3.856 17865
3962 1 6 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.644 0.303 17865
3963 1 6 . 1 1 119 119 ASN CA C 144 51.633 51.633 51.573 0.060 17865
3964 1 6 . 1 1 119 119 ASN CB C 144 38.859 38.859 38.151 0.708 17865
3965 1 6 . 1 1 119 119 ASN H H 144 8.432 8.432 8.286 0.146 17865
3966 1 6 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.574 0.106 17865
3967 1 6 . 1 1 120 120 PRO CA C 145 61.640 61.640 62.024 -0.384 17865
3968 1 6 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.113 -0.195 17865
3969 1 6 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.235 0.142 17865
3970 1 6 . 1 1 121 121 PRO C C 146 175.876 175.876 175.983 -0.107 17865
3971 1 6 . 1 1 121 121 PRO CA C 146 63.174 63.174 63.536 -0.362 17865
3972 1 6 . 1 1 121 121 PRO CB C 146 31.939 31.939 31.447 0.492 17865
3973 1 7 . 1 1 2 2 ASP N N 27 121.041 121.041 120.331 0.710 17865
3974 1 7 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.986 -0.348 17865
3975 1 7 . 1 1 2 2 ASP C C 27 175.878 175.878 174.916 0.962 17865
3976 1 7 . 1 1 2 2 ASP CA C 27 54.382 54.382 53.755 0.627 17865
3977 1 7 . 1 1 2 2 ASP CB C 27 41.729 41.729 43.029 -1.300 17865
3978 1 7 . 1 1 2 2 ASP H H 27 8.639 8.639 8.879 -0.240 17865
3979 1 7 . 1 1 3 3 VAL N N 28 119.901 119.901 120.591 -0.690 17865
3980 1 7 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.318 -0.285 17865
3981 1 7 . 1 1 3 3 VAL C C 28 175.521 175.521 174.574 0.947 17865
3982 1 7 . 1 1 3 3 VAL CA C 28 62.216 62.216 61.483 0.733 17865
3983 1 7 . 1 1 3 3 VAL CB C 28 33.003 33.003 31.846 1.157 17865
3984 1 7 . 1 1 3 3 VAL H H 28 8.113 8.113 7.780 0.333 17865
3985 1 7 . 1 1 4 4 PHE N N 29 123.707 123.707 120.710 2.997 17865
3986 1 7 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.659 -0.003 17865
3987 1 7 . 1 1 4 4 PHE C C 29 174.874 174.874 175.530 -0.656 17865
3988 1 7 . 1 1 4 4 PHE CA C 29 57.159 57.159 57.064 0.095 17865
3989 1 7 . 1 1 4 4 PHE CB C 29 39.795 39.795 39.747 0.048 17865
3990 1 7 . 1 1 4 4 PHE H H 29 8.255 8.255 7.999 0.256 17865
3991 1 7 . 1 1 5 5 ASP N N 30 124.203 124.203 121.165 3.038 17865
3992 1 7 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.596 0.242 17865
3993 1 7 . 1 1 5 5 ASP CA C 30 52.385 52.385 53.285 -0.900 17865
3994 1 7 . 1 1 5 5 ASP CB C 30 40.801 40.801 41.420 -0.619 17865
3995 1 7 . 1 1 5 5 ASP H H 30 8.226 8.226 8.430 -0.204 17865
3996 1 7 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.497 0.040 17865
3997 1 7 . 1 1 6 6 PRO CA C 31 61.664 61.664 61.709 -0.045 17865
3998 1 7 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.783 -0.957 17865
3999 1 7 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.453 -0.027 17865
4000 1 7 . 1 1 7 7 PRO C C 32 177.226 177.226 176.115 1.111 17865
4001 1 7 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.605 -0.436 17865
4002 1 7 . 1 1 7 7 PRO CB C 32 31.948 31.948 31.937 0.011 17865
4003 1 7 . 1 1 8 8 THR N N 33 114.158 114.158 114.013 0.145 17865
4004 1 7 . 1 1 8 8 THR HA H 33 4.195 4.195 4.470 -0.275 17865
4005 1 7 . 1 1 8 8 THR C C 33 174.468 174.468 173.561 0.907 17865
4006 1 7 . 1 1 8 8 THR CA C 33 62.110 62.110 61.229 0.881 17865
4007 1 7 . 1 1 8 8 THR CB C 33 69.975 69.975 69.376 0.599 17865
4008 1 7 . 1 1 8 8 THR H H 33 8.096 8.096 7.329 0.767 17865
4009 1 7 . 1 1 9 9 GLN N N 34 122.411 122.411 124.934 -2.523 17865
4010 1 7 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.262 0.001 17865
4011 1 7 . 1 1 9 9 GLN C C 34 175.445 175.445 174.331 1.114 17865
4012 1 7 . 1 1 9 9 GLN CA C 34 55.763 55.763 55.022 0.741 17865
4013 1 7 . 1 1 9 9 GLN CB C 34 29.691 29.691 28.482 1.209 17865
4014 1 7 . 1 1 9 9 GLN H H 34 8.278 8.278 8.121 0.157 17865
4015 1 7 . 1 1 10 10 TYR N N 35 121.048 121.048 118.731 2.317 17865
4016 1 7 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.533 -0.013 17865
4017 1 7 . 1 1 10 10 TYR C C 35 176.314 176.314 175.324 0.990 17865
4018 1 7 . 1 1 10 10 TYR CA C 35 57.972 57.972 57.026 0.946 17865
4019 1 7 . 1 1 10 10 TYR CB C 35 38.936 38.936 39.933 -0.997 17865
4020 1 7 . 1 1 10 10 TYR H H 35 8.227 8.227 7.134 1.093 17865
4021 1 7 . 1 1 11 11 GLY N N 36 109.711 109.711 106.022 3.689 17865
4022 1 7 . 1 1 11 11 GLY C C 36 174.128 174.128 174.065 0.063 17865
4023 1 7 . 1 1 11 11 GLY CA C 36 45.212 45.212 45.554 -0.342 17865
4024 1 7 . 1 1 11 11 GLY H H 36 8.247 8.247 8.444 -0.197 17865
4025 1 7 . 1 1 12 12 TYR N N 37 120.302 120.302 116.007 4.295 17865
4026 1 7 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.758 -0.276 17865
4027 1 7 . 1 1 12 12 TYR C C 37 175.864 175.864 174.686 1.178 17865
4028 1 7 . 1 1 12 12 TYR CA C 37 58.541 58.541 57.810 0.731 17865
4029 1 7 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.427 -0.712 17865
4030 1 7 . 1 1 12 12 TYR H H 37 8.101 8.101 7.548 0.552 17865
4031 1 7 . 1 1 13 13 ASP N N 38 121.883 121.883 118.827 3.056 17865
4032 1 7 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.385 0.101 17865
4033 1 7 . 1 1 13 13 ASP C C 38 176.538 176.538 176.626 -0.088 17865
4034 1 7 . 1 1 13 13 ASP CA C 38 54.223 54.223 54.379 -0.156 17865
4035 1 7 . 1 1 13 13 ASP CB C 38 40.988 40.988 41.428 -0.440 17865
4036 1 7 . 1 1 13 13 ASP H H 38 8.266 8.266 6.954 1.312 17865
4037 1 7 . 1 1 14 14 GLY N N 39 107.705 107.705 108.086 -0.381 17865
4038 1 7 . 1 1 14 14 GLY C C 39 173.822 173.822 173.967 -0.145 17865
4039 1 7 . 1 1 14 14 GLY CA C 39 45.404 45.404 46.041 -0.637 17865
4040 1 7 . 1 1 14 14 GLY H H 39 7.647 7.647 7.552 0.095 17865
4041 1 7 . 1 1 15 15 LYS N N 40 121.621 121.621 119.223 2.398 17865
4042 1 7 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.760 -0.185 17865
4043 1 7 . 1 1 15 15 LYS CA C 40 54.100 54.100 53.188 0.912 17865
4044 1 7 . 1 1 15 15 LYS CB C 40 32.510 32.510 33.865 -1.355 17865
4045 1 7 . 1 1 15 15 LYS H H 40 7.908 7.908 7.299 0.609 17865
4046 1 7 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.280 0.072 17865
4047 1 7 . 1 1 16 16 PRO C C 41 176.806 176.806 176.091 0.715 17865
4048 1 7 . 1 1 16 16 PRO CA C 41 62.758 62.758 65.422 -2.664 17865
4049 1 7 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.325 -0.011 17865
4050 1 7 . 1 1 17 17 LEU N N 42 123.488 123.488 117.104 6.384 17865
4051 1 7 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.694 -0.645 17865
4052 1 7 . 1 1 17 17 LEU C C 42 174.973 174.973 174.156 0.817 17865
4053 1 7 . 1 1 17 17 LEU CA C 42 55.436 55.436 54.554 0.882 17865
4054 1 7 . 1 1 17 17 LEU CB C 42 42.093 42.093 43.303 -1.210 17865
4055 1 7 . 1 1 17 17 LEU H H 42 8.499 8.499 7.858 0.641 17865
4056 1 7 . 1 1 18 18 ASP N N 43 123.354 123.354 124.245 -0.891 17865
4057 1 7 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.945 -0.447 17865
4058 1 7 . 1 1 18 18 ASP C C 43 175.947 175.947 176.168 -0.221 17865
4059 1 7 . 1 1 18 18 ASP CA C 43 52.858 52.858 53.229 -0.371 17865
4060 1 7 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.281 -2.060 17865
4061 1 7 . 1 1 18 18 ASP H H 43 7.789 7.789 8.379 -0.590 17865
4062 1 7 . 1 1 19 19 ALA N N 44 120.147 120.147 127.145 -6.998 17865
4063 1 7 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.278 -0.292 17865
4064 1 7 . 1 1 19 19 ALA C C 44 179.476 179.476 179.254 0.222 17865
4065 1 7 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.029 1.134 17865
4066 1 7 . 1 1 19 19 ALA CB C 44 18.387 18.387 19.057 -0.670 17865
4067 1 7 . 1 1 19 19 ALA H H 44 8.561 8.561 8.743 -0.182 17865
4068 1 7 . 1 1 20 20 SER N N 45 115.037 115.037 116.241 -1.204 17865
4069 1 7 . 1 1 20 20 SER HA H 45 4.151 4.151 4.213 -0.062 17865
4070 1 7 . 1 1 20 20 SER C C 45 177.191 177.191 176.488 0.703 17865
4071 1 7 . 1 1 20 20 SER CA C 45 61.629 61.629 61.842 -0.213 17865
4072 1 7 . 1 1 20 20 SER CB C 45 62.804 62.804 63.090 -0.286 17865
4073 1 7 . 1 1 20 20 SER H H 45 8.466 8.466 9.225 -0.759 17865
4074 1 7 . 1 1 21 21 PHE N N 46 125.030 125.030 124.020 1.010 17865
4075 1 7 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.365 -0.134 17865
4076 1 7 . 1 1 21 21 PHE C C 46 176.850 176.850 175.959 0.891 17865
4077 1 7 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.708 0.098 17865
4078 1 7 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.156 0.725 17865
4079 1 7 . 1 1 21 21 PHE H H 46 8.034 8.034 7.834 0.200 17865
4080 1 7 . 1 1 22 22 CYS N N 47 113.943 113.943 116.949 -3.006 17865
4081 1 7 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.169 0.082 17865
4082 1 7 . 1 1 22 22 CYS C C 47 176.449 176.449 176.255 0.194 17865
4083 1 7 . 1 1 22 22 CYS CA C 47 53.600 53.600 59.365 -5.765 17865
4084 1 7 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.471 10.920 17865
4085 1 7 . 1 1 22 22 CYS H H 47 7.691 7.691 7.985 -0.294 17865
4086 1 7 . 1 1 23 23 ARG N N 48 119.958 119.958 119.610 0.348 17865
4087 1 7 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.466 -0.386 17865
4088 1 7 . 1 1 23 23 ARG C C 48 177.904 177.904 177.655 0.249 17865
4089 1 7 . 1 1 23 23 ARG CA C 48 58.907 58.907 58.394 0.513 17865
4090 1 7 . 1 1 23 23 ARG CB C 48 30.171 30.171 30.061 0.111 17865
4091 1 7 . 1 1 23 23 ARG H H 48 7.628 7.628 7.412 0.216 17865
4092 1 7 . 1 1 24 24 THR N N 49 106.445 106.445 109.280 -2.835 17865
4093 1 7 . 1 1 24 24 THR HA H 49 4.385 4.385 4.291 0.094 17865
4094 1 7 . 1 1 24 24 THR C C 49 174.758 174.758 174.577 0.181 17865
4095 1 7 . 1 1 24 24 THR CA C 49 61.573 61.573 63.041 -1.468 17865
4096 1 7 . 1 1 24 24 THR CB C 49 68.794 68.794 69.124 -0.330 17865
4097 1 7 . 1 1 24 24 THR H H 49 7.307 7.307 7.448 -0.141 17865
4098 1 7 . 1 1 25 25 ALA N N 50 122.242 122.242 123.441 -1.199 17865
4099 1 7 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.313 0.091 17865
4100 1 7 . 1 1 25 25 ALA C C 50 178.554 178.554 178.789 -0.235 17865
4101 1 7 . 1 1 25 25 ALA CA C 50 52.381 52.381 52.756 -0.375 17865
4102 1 7 . 1 1 25 25 ALA CB C 50 18.395 18.395 20.029 -1.634 17865
4103 1 7 . 1 1 25 25 ALA H H 50 7.401 7.401 7.548 -0.147 17865
4104 1 7 . 1 1 26 26 GLY N N 51 110.604 110.604 106.872 3.732 17865
4105 1 7 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.442 0.580 17865
4106 1 7 . 1 1 26 26 GLY H H 51 8.285 8.285 8.089 0.196 17865
4107 1 7 . 1 1 27 27 SER HA H 52 4.382 4.382 4.244 0.138 17865
4108 1 7 . 1 1 27 27 SER C C 52 175.774 175.774 175.991 -0.217 17865
4109 1 7 . 1 1 27 27 SER CA C 52 60.803 60.803 60.745 0.058 17865
4110 1 7 . 1 1 27 27 SER CB C 52 62.827 62.827 63.280 -0.453 17865
4111 1 7 . 1 1 28 28 ARG N N 53 119.682 119.682 120.062 -0.380 17865
4112 1 7 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.475 0.405 17865
4113 1 7 . 1 1 28 28 ARG C C 53 175.796 175.796 177.211 -1.415 17865
4114 1 7 . 1 1 28 28 ARG CA C 53 55.738 55.738 55.289 0.449 17865
4115 1 7 . 1 1 28 28 ARG CB C 53 30.237 30.237 28.442 1.795 17865
4116 1 7 . 1 1 28 28 ARG H H 53 7.894 7.894 8.528 -0.634 17865
4117 1 7 . 1 1 29 29 GLU N N 54 122.318 122.318 121.374 0.944 17865
4118 1 7 . 1 1 29 29 GLU HA H 54 3.595 3.595 4.060 -0.465 17865
4119 1 7 . 1 1 29 29 GLU C C 54 177.523 177.523 177.730 -0.207 17865
4120 1 7 . 1 1 29 29 GLU CA C 54 61.223 61.223 60.107 1.116 17865
4121 1 7 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.529 -0.592 17865
4122 1 7 . 1 1 29 29 GLU H H 54 7.730 7.730 7.686 0.044 17865
4123 1 7 . 1 1 30 30 LYS N N 55 118.377 118.377 117.759 0.618 17865
4124 1 7 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.043 -0.215 17865
4125 1 7 . 1 1 30 30 LYS C C 55 179.205 179.205 178.634 0.571 17865
4126 1 7 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.336 1.091 17865
4127 1 7 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.150 -0.549 17865
4128 1 7 . 1 1 30 30 LYS H H 55 8.659 8.659 8.136 0.523 17865
4129 1 7 . 1 1 31 31 ASP N N 56 121.614 121.614 118.695 2.919 17865
4130 1 7 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.650 -0.339 17865
4131 1 7 . 1 1 31 31 ASP C C 56 177.393 177.393 177.783 -0.390 17865
4132 1 7 . 1 1 31 31 ASP CA C 56 57.316 57.316 56.388 0.928 17865
4133 1 7 . 1 1 31 31 ASP CB C 56 40.423 40.423 41.268 -0.845 17865
4134 1 7 . 1 1 31 31 ASP H H 56 7.646 7.646 7.912 -0.266 17865
4135 1 7 . 1 1 32 32 CYS N N 57 120.345 120.345 120.037 0.308 17865
4136 1 7 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.495 0.106 17865
4137 1 7 . 1 1 32 32 CYS C C 57 175.772 175.772 176.377 -0.605 17865
4138 1 7 . 1 1 32 32 CYS CA C 57 60.197 60.197 61.599 -1.402 17865
4139 1 7 . 1 1 32 32 CYS CB C 57 33.966 33.966 26.076 7.890 17865
4140 1 7 . 1 1 32 32 CYS H H 57 8.042 8.042 8.306 -0.264 17865
4141 1 7 . 1 1 33 33 ARG N N 58 120.293 120.293 118.860 1.433 17865
4142 1 7 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.990 -0.314 17865
4143 1 7 . 1 1 33 33 ARG C C 58 179.633 179.633 178.548 1.085 17865
4144 1 7 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.169 1.217 17865
4145 1 7 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.419 0.422 17865
4146 1 7 . 1 1 33 33 ARG H H 58 8.531 8.531 7.852 0.679 17865
4147 1 7 . 1 1 34 34 LYS N N 59 121.166 121.166 119.622 1.544 17865
4148 1 7 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.142 -0.106 17865
4149 1 7 . 1 1 34 34 LYS C C 59 179.220 179.220 178.602 0.618 17865
4150 1 7 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.731 0.799 17865
4151 1 7 . 1 1 34 34 LYS CB C 59 32.110 32.110 31.992 0.118 17865
4152 1 7 . 1 1 34 34 LYS H H 59 7.633 7.633 7.604 0.029 17865
4153 1 7 . 1 1 35 35 ASP N N 60 122.166 122.166 119.903 2.263 17865
4154 1 7 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.418 0.013 17865
4155 1 7 . 1 1 35 35 ASP C C 60 179.709 179.709 178.070 1.639 17865
4156 1 7 . 1 1 35 35 ASP CA C 60 57.703 57.703 56.649 1.054 17865
4157 1 7 . 1 1 35 35 ASP CB C 60 40.672 40.672 40.773 -0.101 17865
4158 1 7 . 1 1 35 35 ASP H H 60 8.221 8.221 7.958 0.263 17865
4159 1 7 . 1 1 36 36 VAL N N 61 121.312 121.312 117.659 3.653 17865
4160 1 7 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.699 -0.298 17865
4161 1 7 . 1 1 36 36 VAL C C 61 178.339 178.339 178.151 0.188 17865
4162 1 7 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.373 1.760 17865
4163 1 7 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.908 -0.251 17865
4164 1 7 . 1 1 36 36 VAL H H 61 8.916 8.916 7.839 1.077 17865
4165 1 7 . 1 1 37 37 GLN N N 62 119.166 119.166 119.278 -0.112 17865
4166 1 7 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.032 -0.090 17865
4167 1 7 . 1 1 37 37 GLN C C 62 177.293 177.293 177.942 -0.649 17865
4168 1 7 . 1 1 37 37 GLN CA C 62 58.280 58.280 58.575 -0.295 17865
4169 1 7 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.677 -0.306 17865
4170 1 7 . 1 1 37 37 GLN H H 62 7.697 7.697 7.613 0.084 17865
4171 1 7 . 1 1 38 38 ALA N N 63 118.964 118.964 119.822 -0.858 17865
4172 1 7 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.310 -0.068 17865
4173 1 7 . 1 1 38 38 ALA C C 63 177.221 177.221 177.497 -0.276 17865
4174 1 7 . 1 1 38 38 ALA CA C 63 53.137 53.137 52.636 0.501 17865
4175 1 7 . 1 1 38 38 ALA CB C 63 18.897 18.897 18.839 0.058 17865
4176 1 7 . 1 1 38 38 ALA H H 63 7.508 7.508 7.749 -0.241 17865
4177 1 7 . 1 1 39 39 CYS N N 64 119.081 119.081 119.370 -0.289 17865
4178 1 7 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.786 0.167 17865
4179 1 7 . 1 1 39 39 CYS C C 64 172.052 172.052 174.719 -2.667 17865
4180 1 7 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.156 -6.276 17865
4181 1 7 . 1 1 39 39 CYS CB C 64 34.328 34.328 27.064 7.264 17865
4182 1 7 . 1 1 39 39 CYS H H 64 7.354 7.354 7.610 -0.256 17865
4183 1 7 . 1 1 40 40 ASP N N 65 124.167 124.167 123.390 0.777 17865
4184 1 7 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.423 -0.098 17865
4185 1 7 . 1 1 40 40 ASP C C 65 176.496 176.496 177.124 -0.628 17865
4186 1 7 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.634 0.090 17865
4187 1 7 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.325 -0.012 17865
4188 1 7 . 1 1 40 40 ASP H H 65 8.142 8.142 8.483 -0.341 17865
4189 1 7 . 1 1 41 41 LYS N N 66 118.844 118.844 119.427 -0.583 17865
4190 1 7 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.043 0.481 17865
4191 1 7 . 1 1 41 41 LYS C C 66 175.586 175.586 177.523 -1.937 17865
4192 1 7 . 1 1 41 41 LYS CA C 66 55.275 55.275 58.148 -2.873 17865
4193 1 7 . 1 1 41 41 LYS CB C 66 32.598 32.598 32.424 0.174 17865
4194 1 7 . 1 1 41 41 LYS H H 66 7.858 7.858 8.599 -0.741 17865
4195 1 7 . 1 1 42 42 LYS N N 67 126.081 126.081 115.271 10.810 17865
4196 1 7 . 1 1 42 42 LYS HA H 67 3.915 3.915 3.813 0.102 17865
4197 1 7 . 1 1 42 42 LYS C C 67 174.665 174.665 175.842 -1.177 17865
4198 1 7 . 1 1 42 42 LYS CA C 67 57.827 57.827 58.721 -0.895 17865
4199 1 7 . 1 1 42 42 LYS CB C 67 34.059 34.059 31.695 2.365 17865
4200 1 7 . 1 1 42 42 LYS H H 67 8.790 8.790 8.121 0.669 17865
4201 1 7 . 1 1 43 43 TYR N N 68 114.138 114.138 116.911 -2.773 17865
4202 1 7 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.687 0.572 17865
4203 1 7 . 1 1 43 43 TYR C C 68 175.767 175.767 175.383 0.384 17865
4204 1 7 . 1 1 43 43 TYR CA C 68 55.880 55.880 57.959 -2.079 17865
4205 1 7 . 1 1 43 43 TYR CB C 68 42.363 42.363 41.733 0.630 17865
4206 1 7 . 1 1 43 43 TYR H H 68 7.294 7.294 8.171 -0.877 17865
4207 1 7 . 1 1 44 44 ASP N N 69 121.807 121.807 121.800 0.007 17865
4208 1 7 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.694 -0.054 17865
4209 1 7 . 1 1 44 44 ASP C C 69 177.812 177.812 177.355 0.457 17865
4210 1 7 . 1 1 44 44 ASP CA C 69 52.110 52.110 53.881 -1.771 17865
4211 1 7 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.719 -2.279 17865
4212 1 7 . 1 1 44 44 ASP H H 69 8.995 8.995 8.948 0.047 17865
4213 1 7 . 1 1 45 45 ASP N N 70 116.686 116.686 122.780 -6.094 17865
4214 1 7 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.363 0.061 17865
4215 1 7 . 1 1 45 45 ASP C C 70 177.054 177.054 176.831 0.223 17865
4216 1 7 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.465 -0.084 17865
4217 1 7 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.994 -0.746 17865
4218 1 7 . 1 1 45 45 ASP H H 70 8.369 8.369 8.824 -0.455 17865
4219 1 7 . 1 1 46 46 GLN N N 71 117.949 117.949 116.246 1.703 17865
4220 1 7 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.323 0.133 17865
4221 1 7 . 1 1 46 46 GLN C C 71 176.273 176.273 176.519 -0.246 17865
4222 1 7 . 1 1 46 46 GLN CA C 71 55.367 55.367 56.015 -0.648 17865
4223 1 7 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.429 -0.099 17865
4224 1 7 . 1 1 46 46 GLN H H 71 8.274 8.274 8.592 -0.318 17865
4225 1 7 . 1 1 47 47 GLY N N 72 108.369 108.369 107.931 0.438 17865
4226 1 7 . 1 1 47 47 GLY C C 72 174.145 174.145 174.225 -0.080 17865
4227 1 7 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.127 0.697 17865
4228 1 7 . 1 1 47 47 GLY H H 72 8.174 8.174 8.277 -0.103 17865
4229 1 7 . 1 1 48 48 ARG N N 73 121.554 121.554 119.279 2.275 17865
4230 1 7 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.642 -0.157 17865
4231 1 7 . 1 1 48 48 ARG C C 73 176.855 176.855 175.261 1.594 17865
4232 1 7 . 1 1 48 48 ARG CA C 73 55.289 55.289 53.851 1.438 17865
4233 1 7 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.803 -1.245 17865
4234 1 7 . 1 1 48 48 ARG H H 73 8.462 8.462 7.859 0.603 17865
4235 1 7 . 1 1 49 49 GLU N N 74 122.784 122.784 120.518 2.266 17865
4236 1 7 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.504 -0.021 17865
4237 1 7 . 1 1 49 49 GLU C C 74 178.098 178.098 176.470 1.628 17865
4238 1 7 . 1 1 49 49 GLU CA C 74 57.184 57.184 55.989 1.195 17865
4239 1 7 . 1 1 49 49 GLU CB C 74 30.777 30.777 30.082 0.695 17865
4240 1 7 . 1 1 49 49 GLU H H 74 8.703 8.703 8.588 0.115 17865
4241 1 7 . 1 1 50 50 THR N N 75 114.563 114.563 113.590 0.973 17865
4242 1 7 . 1 1 50 50 THR HA H 75 4.212 4.212 4.461 -0.249 17865
4243 1 7 . 1 1 50 50 THR C C 75 175.170 175.170 175.862 -0.692 17865
4244 1 7 . 1 1 50 50 THR CA C 75 60.589 60.589 60.229 0.360 17865
4245 1 7 . 1 1 50 50 THR CB C 75 70.952 70.952 70.396 0.556 17865
4246 1 7 . 1 1 50 50 THR H H 75 7.717 7.717 8.083 -0.366 17865
4247 1 7 . 1 1 51 51 ALA N N 76 122.097 122.097 122.645 -0.548 17865
4248 1 7 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.046 -0.008 17865
4249 1 7 . 1 1 51 51 ALA C C 76 181.906 181.906 179.741 2.165 17865
4250 1 7 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.094 0.560 17865
4251 1 7 . 1 1 51 51 ALA CB C 76 17.993 17.993 17.715 0.278 17865
4252 1 7 . 1 1 51 51 ALA H H 76 8.734 8.734 8.587 0.147 17865
4253 1 7 . 1 1 52 52 CYS N N 77 115.347 115.347 117.957 -2.610 17865
4254 1 7 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.254 0.226 17865
4255 1 7 . 1 1 52 52 CYS C C 77 176.299 176.299 176.914 -0.615 17865
4256 1 7 . 1 1 52 52 CYS CA C 77 57.701 57.701 60.669 -2.968 17865
4257 1 7 . 1 1 52 52 CYS CB C 77 35.631 35.631 26.090 9.541 17865
4258 1 7 . 1 1 52 52 CYS H H 77 9.073 9.073 8.231 0.842 17865
4259 1 7 . 1 1 53 53 ALA N N 78 128.517 128.517 122.853 5.664 17865
4260 1 7 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.780 0.075 17865
4261 1 7 . 1 1 53 53 ALA C C 78 178.736 178.736 179.179 -0.443 17865
4262 1 7 . 1 1 53 53 ALA CA C 78 55.633 55.633 54.979 0.654 17865
4263 1 7 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.776 1.415 17865
4264 1 7 . 1 1 53 53 ALA H H 78 7.174 7.174 8.201 -1.027 17865
4265 1 7 . 1 1 54 54 LYS N N 79 118.706 118.706 119.019 -0.313 17865
4266 1 7 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.176 -0.373 17865
4267 1 7 . 1 1 54 54 LYS C C 79 179.611 179.611 178.781 0.830 17865
4268 1 7 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.829 0.896 17865
4269 1 7 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.560 0.093 17865
4270 1 7 . 1 1 54 54 LYS H H 79 8.313 8.313 8.221 0.092 17865
4271 1 7 . 1 1 55 55 GLY N N 80 104.822 104.822 107.654 -2.832 17865
4272 1 7 . 1 1 55 55 GLY C C 80 176.504 176.504 176.107 0.397 17865
4273 1 7 . 1 1 55 55 GLY CA C 80 46.839 46.839 47.127 -0.288 17865
4274 1 7 . 1 1 55 55 GLY H H 80 8.175 8.175 7.773 0.402 17865
4275 1 7 . 1 1 56 56 ILE N N 81 123.697 123.697 123.223 0.474 17865
4276 1 7 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.910 -0.115 17865
4277 1 7 . 1 1 56 56 ILE C C 81 177.334 177.334 178.240 -0.906 17865
4278 1 7 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.539 0.742 17865
4279 1 7 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.745 0.590 17865
4280 1 7 . 1 1 56 56 ILE H H 81 7.590 7.590 7.606 -0.016 17865
4281 1 7 . 1 1 57 57 ARG N N 82 118.161 118.161 119.674 -1.513 17865
4282 1 7 . 1 1 57 57 ARG HA H 82 3.935 3.935 3.914 0.021 17865
4283 1 7 . 1 1 57 57 ARG C C 82 178.662 178.662 178.509 0.153 17865
4284 1 7 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.940 -0.238 17865
4285 1 7 . 1 1 57 57 ARG CB C 82 29.899 29.899 30.075 -0.176 17865
4286 1 7 . 1 1 57 57 ARG H H 82 7.569 7.569 7.663 -0.094 17865
4287 1 7 . 1 1 58 58 GLU N N 83 115.085 115.085 118.121 -3.036 17865
4288 1 7 . 1 1 58 58 GLU HA H 83 4.031 4.031 3.749 0.282 17865
4289 1 7 . 1 1 58 58 GLU C C 83 178.224 178.224 179.390 -1.166 17865
4290 1 7 . 1 1 58 58 GLU CA C 83 58.304 58.304 58.788 -0.484 17865
4291 1 7 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.431 0.600 17865
4292 1 7 . 1 1 58 58 GLU H H 83 7.786 7.786 8.018 -0.232 17865
4293 1 7 . 1 1 59 59 LYS N N 84 119.183 119.183 120.723 -1.540 17865
4294 1 7 . 1 1 59 59 LYS HA H 84 3.830 3.830 4.003 -0.173 17865
4295 1 7 . 1 1 59 59 LYS C C 84 177.933 177.933 179.104 -1.171 17865
4296 1 7 . 1 1 59 59 LYS CA C 84 59.043 59.043 59.275 -0.232 17865
4297 1 7 . 1 1 59 59 LYS CB C 84 33.650 33.650 33.075 0.575 17865
4298 1 7 . 1 1 59 59 LYS H H 84 7.968 7.968 8.128 -0.160 17865
4299 1 7 . 1 1 60 60 TYR N N 85 113.663 113.663 116.147 -2.484 17865
4300 1 7 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.568 0.135 17865
4301 1 7 . 1 1 60 60 TYR C C 85 174.729 174.729 174.663 0.066 17865
4302 1 7 . 1 1 60 60 TYR CA C 85 57.202 57.202 57.114 0.088 17865
4303 1 7 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.390 0.512 17865
4304 1 7 . 1 1 60 60 TYR H H 85 7.562 7.562 8.274 -0.713 17865
4305 1 7 . 1 1 61 61 LYS N N 86 121.862 121.862 122.474 -0.612 17865
4306 1 7 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.443 0.069 17865
4307 1 7 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.569 -0.627 17865
4308 1 7 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.058 0.044 17865
4309 1 7 . 1 1 61 61 LYS H H 86 7.222 7.222 7.233 -0.011 17865
4310 1 7 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.501 -0.178 17865
4311 1 7 . 1 1 62 62 PRO C C 87 176.576 176.576 176.103 0.473 17865
4312 1 7 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.645 0.374 17865
4313 1 7 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.477 -0.237 17865
4314 1 7 . 1 1 63 63 ALA N N 88 125.029 125.029 123.854 1.175 17865
4315 1 7 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.366 -0.112 17865
4316 1 7 . 1 1 63 63 ALA C C 88 177.301 177.301 176.451 0.850 17865
4317 1 7 . 1 1 63 63 ALA CA C 88 52.281 52.281 51.999 0.282 17865
4318 1 7 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.688 1.514 17865
4319 1 7 . 1 1 63 63 ALA H H 88 8.329 8.329 8.275 0.054 17865
4320 1 7 . 1 1 64 64 VAL N N 89 121.843 121.843 120.703 1.140 17865
4321 1 7 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.402 -0.458 17865
4322 1 7 . 1 1 64 64 VAL C C 89 174.791 174.791 174.572 0.219 17865
4323 1 7 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.382 1.599 17865
4324 1 7 . 1 1 64 64 VAL CB C 89 33.485 33.485 35.249 -1.764 17865
4325 1 7 . 1 1 64 64 VAL H H 89 8.075 8.075 7.876 0.199 17865
4326 1 7 . 1 1 65 65 VAL N N 90 125.399 125.399 117.988 7.411 17865
4327 1 7 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.366 -0.228 17865
4328 1 7 . 1 1 65 65 VAL C C 90 174.340 174.340 174.773 -0.433 17865
4329 1 7 . 1 1 65 65 VAL CA C 90 61.162 61.162 61.464 -0.302 17865
4330 1 7 . 1 1 65 65 VAL CB C 90 33.866 33.866 30.529 3.337 17865
4331 1 7 . 1 1 65 65 VAL H H 90 8.229 8.229 8.202 0.027 17865
4332 1 7 . 1 1 66 66 TYR N N 91 124.848 124.848 127.967 -3.119 17865
4333 1 7 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.604 0.167 17865
4334 1 7 . 1 1 66 66 TYR C C 91 176.658 176.658 176.043 0.615 17865
4335 1 7 . 1 1 66 66 TYR CA C 91 58.084 58.084 58.284 -0.200 17865
4336 1 7 . 1 1 66 66 TYR CB C 91 41.535 41.535 40.373 1.162 17865
4337 1 7 . 1 1 66 66 TYR H H 91 9.145 9.145 8.060 1.085 17865
4338 1 7 . 1 1 67 67 GLY N N 92 106.185 106.185 108.507 -2.322 17865
4339 1 7 . 1 1 67 67 GLY C C 92 175.681 175.681 175.198 0.483 17865
4340 1 7 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.867 0.108 17865
4341 1 7 . 1 1 67 67 GLY H H 92 8.730 8.730 8.738 -0.008 17865
4342 1 7 . 1 1 68 68 TYR N N 93 121.815 121.815 118.336 3.479 17865
4343 1 7 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.359 -0.384 17865
4344 1 7 . 1 1 68 68 TYR C C 93 176.035 176.035 176.168 -0.133 17865
4345 1 7 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.427 1.619 17865
4346 1 7 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.155 0.270 17865
4347 1 7 . 1 1 68 68 TYR H H 93 8.711 8.711 8.800 -0.089 17865
4348 1 7 . 1 1 69 69 ASP N N 94 115.507 115.507 119.008 -3.501 17865
4349 1 7 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.298 -0.010 17865
4350 1 7 . 1 1 69 69 ASP C C 94 177.063 177.063 177.433 -0.370 17865
4351 1 7 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.601 -0.590 17865
4352 1 7 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.781 -0.614 17865
4353 1 7 . 1 1 69 69 ASP H H 94 8.010 8.010 7.754 0.256 17865
4354 1 7 . 1 1 70 70 GLY N N 95 107.196 107.196 107.729 -0.533 17865
4355 1 7 . 1 1 70 70 GLY C C 95 173.936 173.936 173.198 0.738 17865
4356 1 7 . 1 1 70 70 GLY CA C 95 45.392 45.392 45.192 0.200 17865
4357 1 7 . 1 1 70 70 GLY H H 95 7.986 7.986 8.060 -0.074 17865
4358 1 7 . 1 1 71 71 LYS N N 96 121.258 121.258 119.336 1.922 17865
4359 1 7 . 1 1 71 71 LYS HA H 96 4.784 4.784 5.013 -0.229 17865
4360 1 7 . 1 1 71 71 LYS CA C 96 54.114 54.114 52.658 1.456 17865
4361 1 7 . 1 1 71 71 LYS CB C 96 31.762 31.762 33.264 -1.502 17865
4362 1 7 . 1 1 71 71 LYS H H 96 7.877 7.877 7.425 0.452 17865
4363 1 7 . 1 1 72 72 PRO C C 97 177.170 177.170 175.973 1.197 17865
4364 1 7 . 1 1 72 72 PRO CA C 97 63.137 63.137 62.582 0.555 17865
4365 1 7 . 1 1 72 72 PRO CB C 97 32.240 32.240 31.289 0.951 17865
4366 1 7 . 1 1 73 73 LEU N N 98 123.503 123.503 121.818 1.685 17865
4367 1 7 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.775 -0.415 17865
4368 1 7 . 1 1 73 73 LEU C C 98 176.354 176.354 175.175 1.179 17865
4369 1 7 . 1 1 73 73 LEU CA C 98 53.927 53.927 52.940 0.987 17865
4370 1 7 . 1 1 73 73 LEU CB C 98 42.272 42.272 45.072 -2.800 17865
4371 1 7 . 1 1 73 73 LEU H H 98 8.850 8.850 7.791 1.059 17865
4372 1 7 . 1 1 74 74 ASP N N 99 122.212 122.212 121.077 1.135 17865
4373 1 7 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.782 -0.185 17865
4374 1 7 . 1 1 74 74 ASP C C 99 175.819 175.819 176.323 -0.504 17865
4375 1 7 . 1 1 74 74 ASP CA C 99 53.856 53.856 54.147 -0.291 17865
4376 1 7 . 1 1 74 74 ASP CB C 99 40.989 40.989 41.246 -0.257 17865
4377 1 7 . 1 1 74 74 ASP H H 99 8.517 8.517 8.524 -0.007 17865
4378 1 7 . 1 1 75 75 LEU N N 100 125.874 125.874 122.798 3.076 17865
4379 1 7 . 1 1 75 75 LEU HA H 100 4.366 4.366 3.987 0.379 17865
4380 1 7 . 1 1 75 75 LEU C C 100 178.426 178.426 177.490 0.936 17865
4381 1 7 . 1 1 75 75 LEU CA C 100 53.631 53.631 54.766 -1.135 17865
4382 1 7 . 1 1 75 75 LEU CB C 100 40.676 40.676 39.617 1.058 17865
4383 1 7 . 1 1 75 75 LEU H H 100 8.281 8.281 8.738 -0.457 17865
4384 1 7 . 1 1 76 76 GLY N N 101 110.604 110.604 109.617 0.987 17865
4385 1 7 . 1 1 76 76 GLY C C 101 176.936 176.936 175.133 1.803 17865
4386 1 7 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.161 0.666 17865
4387 1 7 . 1 1 76 76 GLY H H 101 8.914 8.914 8.559 0.355 17865
4388 1 7 . 1 1 77 77 PHE N N 102 117.639 117.639 118.848 -1.209 17865
4389 1 7 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.824 -0.443 17865
4390 1 7 . 1 1 77 77 PHE C C 102 177.878 177.878 174.408 3.470 17865
4391 1 7 . 1 1 77 77 PHE CA C 102 59.139 59.139 56.608 2.531 17865
4392 1 7 . 1 1 77 77 PHE CB C 102 36.935 36.935 39.321 -2.386 17865
4393 1 7 . 1 1 77 77 PHE H H 102 7.992 7.992 8.368 -0.376 17865
4394 1 7 . 1 1 78 78 CYS N N 103 121.136 121.136 117.470 3.666 17865
4395 1 7 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.555 -0.170 17865
4396 1 7 . 1 1 78 78 CYS C C 103 172.780 172.780 176.238 -3.458 17865
4397 1 7 . 1 1 78 78 CYS CA C 103 53.696 53.696 58.215 -4.519 17865
4398 1 7 . 1 1 78 78 CYS CB C 103 34.237 34.237 28.821 5.416 17865
4399 1 7 . 1 1 78 78 CYS H H 103 7.362 7.362 7.740 -0.378 17865
4400 1 7 . 1 1 79 79 THR N N 104 114.773 114.773 115.391 -0.618 17865
4401 1 7 . 1 1 79 79 THR HA H 104 3.984 3.984 4.233 -0.249 17865
4402 1 7 . 1 1 79 79 THR C C 104 176.624 176.624 175.386 1.238 17865
4403 1 7 . 1 1 79 79 THR CA C 104 65.180 65.180 64.775 0.405 17865
4404 1 7 . 1 1 79 79 THR CB C 104 69.062 69.062 68.985 0.077 17865
4405 1 7 . 1 1 79 79 THR H H 104 7.864 7.864 7.915 -0.051 17865
4406 1 7 . 1 1 80 80 LEU N N 105 119.785 119.785 115.901 3.884 17865
4407 1 7 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.697 -0.366 17865
4408 1 7 . 1 1 80 80 LEU C C 105 177.208 177.208 175.599 1.609 17865
4409 1 7 . 1 1 80 80 LEU CA C 105 55.453 55.453 54.374 1.079 17865
4410 1 7 . 1 1 80 80 LEU CB C 105 41.293 41.293 40.482 0.811 17865
4411 1 7 . 1 1 80 80 LEU H H 105 7.238 7.238 7.782 -0.544 17865
4412 1 7 . 1 1 81 81 ALA N N 106 119.309 119.309 121.520 -2.211 17865
4413 1 7 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.488 0.039 17865
4414 1 7 . 1 1 81 81 ALA C C 106 178.769 178.769 176.694 2.075 17865
4415 1 7 . 1 1 81 81 ALA CA C 106 52.049 52.049 51.840 0.208 17865
4416 1 7 . 1 1 81 81 ALA CB C 106 18.820 18.820 21.093 -2.273 17865
4417 1 7 . 1 1 81 81 ALA H H 106 7.432 7.432 7.249 0.183 17865
4418 1 7 . 1 1 82 82 GLY N N 107 109.793 109.793 110.044 -0.251 17865
4419 1 7 . 1 1 82 82 GLY CA C 107 47.119 47.119 46.530 0.589 17865
4420 1 7 . 1 1 82 82 GLY H H 107 7.918 7.918 8.571 -0.653 17865
4421 1 7 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.841 0.424 17865
4422 1 7 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.529 -0.266 17865
4423 1 7 . 1 1 83 83 ILE CB C 108 38.261 38.261 38.150 0.111 17865
4424 1 7 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.420 0.335 17865
4425 1 7 . 1 1 84 84 ARG C C 109 181.344 181.344 176.927 4.417 17865
4426 1 7 . 1 1 84 84 ARG CA C 109 55.939 55.939 56.864 -0.925 17865
4427 1 7 . 1 1 84 84 ARG CB C 109 30.283 30.283 30.034 0.249 17865
4428 1 7 . 1 1 85 85 GLU N N 110 122.944 122.944 120.644 2.300 17865
4429 1 7 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.230 -0.613 17865
4430 1 7 . 1 1 85 85 GLU C C 110 177.797 177.797 178.242 -0.445 17865
4431 1 7 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.058 1.670 17865
4432 1 7 . 1 1 85 85 GLU CB C 110 28.871 28.871 30.184 -1.313 17865
4433 1 7 . 1 1 85 85 GLU H H 110 8.003 8.003 7.624 0.379 17865
4434 1 7 . 1 1 86 86 VAL N N 111 117.101 117.101 118.137 -1.036 17865
4435 1 7 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.767 -0.256 17865
4436 1 7 . 1 1 86 86 VAL C C 111 177.710 177.710 178.490 -0.780 17865
4437 1 7 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.224 0.206 17865
4438 1 7 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.279 -0.066 17865
4439 1 7 . 1 1 86 86 VAL H H 111 8.106 8.106 7.437 0.669 17865
4440 1 7 . 1 1 87 87 ASP N N 112 122.242 122.242 118.456 3.786 17865
4441 1 7 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.427 -0.123 17865
4442 1 7 . 1 1 87 87 ASP C C 112 176.912 176.912 177.788 -0.876 17865
4443 1 7 . 1 1 87 87 ASP CA C 112 57.417 57.417 57.300 0.117 17865
4444 1 7 . 1 1 87 87 ASP CB C 112 40.476 40.476 40.566 -0.090 17865
4445 1 7 . 1 1 87 87 ASP H H 112 7.401 7.401 8.377 -0.976 17865
4446 1 7 . 1 1 88 88 CYS N N 113 120.819 120.819 118.429 2.390 17865
4447 1 7 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.221 -0.912 17865
4448 1 7 . 1 1 88 88 CYS C C 113 175.270 175.270 177.200 -1.930 17865
4449 1 7 . 1 1 88 88 CYS CA C 113 59.759 59.759 61.507 -1.748 17865
4450 1 7 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.720 7.115 17865
4451 1 7 . 1 1 88 88 CYS H H 113 7.785 7.785 7.533 0.252 17865
4452 1 7 . 1 1 89 89 ARG N N 114 118.654 118.654 118.256 0.398 17865
4453 1 7 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.119 -0.478 17865
4454 1 7 . 1 1 89 89 ARG C C 114 179.018 179.018 178.724 0.294 17865
4455 1 7 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.203 0.990 17865
4456 1 7 . 1 1 89 89 ARG CB C 114 29.713 29.713 30.151 -0.438 17865
4457 1 7 . 1 1 89 89 ARG H H 114 8.142 8.142 7.921 0.221 17865
4458 1 7 . 1 1 90 90 LYS N N 115 120.964 120.964 118.824 2.140 17865
4459 1 7 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.193 -0.163 17865
4460 1 7 . 1 1 90 90 LYS C C 115 180.092 180.092 178.072 2.020 17865
4461 1 7 . 1 1 90 90 LYS CA C 115 59.568 59.568 58.845 0.723 17865
4462 1 7 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.427 -0.206 17865
4463 1 7 . 1 1 90 90 LYS H H 115 7.936 7.936 7.616 0.320 17865
4464 1 7 . 1 1 91 91 ASP N N 116 121.690 121.690 118.955 2.735 17865
4465 1 7 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.600 -0.087 17865
4466 1 7 . 1 1 91 91 ASP C C 116 179.419 179.419 178.267 1.152 17865
4467 1 7 . 1 1 91 91 ASP CA C 116 57.237 57.237 57.348 -0.111 17865
4468 1 7 . 1 1 91 91 ASP CB C 116 40.648 40.648 41.114 -0.466 17865
4469 1 7 . 1 1 91 91 ASP H H 116 8.558 8.558 8.083 0.475 17865
4470 1 7 . 1 1 92 92 ALA N N 117 122.784 122.784 122.135 0.649 17865
4471 1 7 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.111 -0.088 17865
4472 1 7 . 1 1 92 92 ALA C C 117 178.789 178.789 179.543 -0.754 17865
4473 1 7 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.130 -0.079 17865
4474 1 7 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.640 0.535 17865
4475 1 7 . 1 1 92 92 ALA H H 117 8.703 8.703 7.731 0.972 17865
4476 1 7 . 1 1 93 93 GLN N N 118 115.510 115.510 116.136 -0.626 17865
4477 1 7 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.215 -0.271 17865
4478 1 7 . 1 1 93 93 GLN C C 118 178.745 178.745 177.531 1.214 17865
4479 1 7 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.878 0.604 17865
4480 1 7 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.330 0.067 17865
4481 1 7 . 1 1 93 93 GLN H H 118 7.664 7.664 8.691 -1.027 17865
4482 1 7 . 1 1 94 94 THR N N 119 110.110 110.110 108.234 1.876 17865
4483 1 7 . 1 1 94 94 THR HA H 119 4.237 4.237 4.530 -0.293 17865
4484 1 7 . 1 1 94 94 THR C C 119 175.861 175.861 174.886 0.975 17865
4485 1 7 . 1 1 94 94 THR CA C 119 64.604 64.604 62.687 1.917 17865
4486 1 7 . 1 1 94 94 THR CB C 119 69.716 69.716 69.771 -0.055 17865
4487 1 7 . 1 1 94 94 THR H H 119 7.726 7.726 7.811 -0.085 17865
4488 1 7 . 1 1 95 95 CYS N N 120 118.523 118.523 120.932 -2.409 17865
4489 1 7 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.381 0.352 17865
4490 1 7 . 1 1 95 95 CYS C C 120 175.165 175.165 175.514 -0.349 17865
4491 1 7 . 1 1 95 95 CYS CA C 120 52.973 52.973 60.737 -7.764 17865
4492 1 7 . 1 1 95 95 CYS CB C 120 36.731 36.731 26.431 10.300 17865
4493 1 7 . 1 1 95 95 CYS H H 120 7.756 7.756 7.781 -0.025 17865
4494 1 7 . 1 1 96 96 ASP N N 121 119.081 119.081 120.894 -1.813 17865
4495 1 7 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.571 0.107 17865
4496 1 7 . 1 1 96 96 ASP CA C 121 56.224 56.224 56.936 -0.712 17865
4497 1 7 . 1 1 96 96 ASP CB C 121 42.731 42.731 40.734 1.996 17865
4498 1 7 . 1 1 96 96 ASP H H 121 7.354 7.354 8.638 -1.284 17865
4499 1 7 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.477 -0.902 17865
4500 1 7 . 1 1 97 97 LYS C C 122 175.510 175.510 176.960 -1.450 17865
4501 1 7 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.103 0.736 17865
4502 1 7 . 1 1 97 97 LYS CB C 122 30.750 30.750 33.932 -3.182 17865
4503 1 7 . 1 1 98 98 LYS N N 123 119.980 119.980 118.764 1.216 17865
4504 1 7 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.431 -0.137 17865
4505 1 7 . 1 1 98 98 LYS C C 123 176.968 176.968 179.176 -2.208 17865
4506 1 7 . 1 1 98 98 LYS CA C 123 55.904 55.904 57.092 -1.188 17865
4507 1 7 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.756 -0.524 17865
4508 1 7 . 1 1 98 98 LYS H H 123 7.799 7.799 8.082 -0.283 17865
4509 1 7 . 1 1 99 99 TYR N N 124 122.378 122.378 122.086 0.292 17865
4510 1 7 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.305 -0.410 17865
4511 1 7 . 1 1 99 99 TYR C C 124 177.126 177.126 176.803 0.323 17865
4512 1 7 . 1 1 99 99 TYR CA C 124 60.211 60.211 60.324 -0.113 17865
4513 1 7 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.901 -0.630 17865
4514 1 7 . 1 1 99 99 TYR H H 124 8.536 8.536 8.434 0.102 17865
4515 1 7 . 1 1 100 100 GLU N N 125 118.610 118.610 116.722 1.888 17865
4516 1 7 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.489 -0.221 17865
4517 1 7 . 1 1 100 100 GLU C C 125 177.387 177.387 176.312 1.075 17865
4518 1 7 . 1 1 100 100 GLU CA C 125 55.759 55.759 55.722 0.037 17865
4519 1 7 . 1 1 100 100 GLU CB C 125 27.321 27.321 29.490 -2.169 17865
4520 1 7 . 1 1 100 100 GLU H H 125 8.385 8.385 8.772 -0.387 17865
4521 1 7 . 1 1 101 101 SER N N 126 115.949 115.949 116.952 -1.003 17865
4522 1 7 . 1 1 101 101 SER HA H 126 3.959 3.959 4.167 -0.208 17865
4523 1 7 . 1 1 101 101 SER C C 126 176.047 176.047 175.845 0.202 17865
4524 1 7 . 1 1 101 101 SER CA C 126 62.439 62.439 62.281 0.158 17865
4525 1 7 . 1 1 101 101 SER CB C 126 63.299 63.299 63.313 -0.014 17865
4526 1 7 . 1 1 101 101 SER H H 126 7.823 7.823 7.702 0.121 17865
4527 1 7 . 1 1 102 102 ASP N N 127 120.920 120.920 120.476 0.444 17865
4528 1 7 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.359 0.048 17865
4529 1 7 . 1 1 102 102 ASP C C 127 178.234 178.234 178.200 0.034 17865
4530 1 7 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.462 -0.051 17865
4531 1 7 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.686 -0.970 17865
4532 1 7 . 1 1 102 102 ASP H H 127 8.683 8.683 8.685 -0.002 17865
4533 1 7 . 1 1 103 103 LYS N N 128 121.753 121.753 119.314 2.439 17865
4534 1 7 . 1 1 103 103 LYS HA H 128 4.004 4.004 3.943 0.061 17865
4535 1 7 . 1 1 103 103 LYS C C 128 179.395 179.395 178.859 0.536 17865
4536 1 7 . 1 1 103 103 LYS CA C 128 59.471 59.471 59.088 0.383 17865
4537 1 7 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.862 0.539 17865
4538 1 7 . 1 1 103 103 LYS H H 128 7.771 7.771 8.158 -0.387 17865
4539 1 7 . 1 1 104 104 CYS N N 129 120.109 120.109 120.169 -0.060 17865
4540 1 7 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.249 -0.055 17865
4541 1 7 . 1 1 104 104 CYS C C 129 176.779 176.779 176.992 -0.213 17865
4542 1 7 . 1 1 104 104 CYS CA C 129 59.790 59.790 62.039 -2.249 17865
4543 1 7 . 1 1 104 104 CYS CB C 129 36.879 36.879 25.922 10.957 17865
4544 1 7 . 1 1 104 104 CYS H H 129 7.973 7.973 8.435 -0.462 17865
4545 1 7 . 1 1 105 105 LEU N N 130 121.804 121.804 121.893 -0.089 17865
4546 1 7 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.988 0.102 17865
4547 1 7 . 1 1 105 105 LEU C C 130 179.373 179.373 178.946 0.427 17865
4548 1 7 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.272 -0.904 17865
4549 1 7 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.198 0.900 17865
4550 1 7 . 1 1 105 105 LEU H H 130 8.666 8.666 8.067 0.599 17865
4551 1 7 . 1 1 106 106 ASN N N 131 118.535 118.535 116.922 1.613 17865
4552 1 7 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.358 -0.120 17865
4553 1 7 . 1 1 106 106 ASN C C 131 177.830 177.830 177.447 0.383 17865
4554 1 7 . 1 1 106 106 ASN CA C 131 56.256 56.256 56.588 -0.332 17865
4555 1 7 . 1 1 106 106 ASN CB C 131 37.817 37.817 38.555 -0.738 17865
4556 1 7 . 1 1 106 106 ASN H H 131 8.438 8.438 8.510 -0.072 17865
4557 1 7 . 1 1 107 107 ALA N N 132 121.485 121.485 122.642 -1.157 17865
4558 1 7 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.224 -0.005 17865
4559 1 7 . 1 1 107 107 ALA C C 132 180.726 180.726 179.496 1.230 17865
4560 1 7 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.683 0.280 17865
4561 1 7 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.799 -0.978 17865
4562 1 7 . 1 1 107 107 ALA H H 132 7.541 7.541 7.580 -0.039 17865
4563 1 7 . 1 1 108 108 ILE N N 133 120.979 120.979 118.686 2.293 17865
4564 1 7 . 1 1 108 108 ILE HA H 133 3.931 3.931 4.003 -0.072 17865
4565 1 7 . 1 1 108 108 ILE C C 133 178.114 178.114 177.663 0.451 17865
4566 1 7 . 1 1 108 108 ILE CA C 133 63.353 63.353 63.157 0.196 17865
4567 1 7 . 1 1 108 108 ILE CB C 133 36.454 36.454 37.348 -0.894 17865
4568 1 7 . 1 1 108 108 ILE H H 133 7.551 7.551 8.299 -0.748 17865
4569 1 7 . 1 1 109 109 LYS N N 134 121.415 121.415 119.965 1.450 17865
4570 1 7 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.218 -0.630 17865
4571 1 7 . 1 1 109 109 LYS C C 134 179.561 179.561 177.944 1.617 17865
4572 1 7 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.119 0.989 17865
4573 1 7 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.112 0.049 17865
4574 1 7 . 1 1 109 109 LYS H H 134 8.414 8.414 7.904 0.510 17865
4575 1 7 . 1 1 110 110 GLU N N 135 116.099 116.099 119.105 -3.006 17865
4576 1 7 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.212 -0.283 17865
4577 1 7 . 1 1 110 110 GLU C C 135 178.239 178.239 178.881 -0.642 17865
4578 1 7 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.246 0.400 17865
4579 1 7 . 1 1 110 110 GLU CB C 135 29.638 29.638 29.590 0.048 17865
4580 1 7 . 1 1 110 110 GLU H H 135 7.473 7.473 7.944 -0.471 17865
4581 1 7 . 1 1 111 111 LYS N N 136 119.805 119.805 120.086 -0.281 17865
4582 1 7 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.063 -0.157 17865
4583 1 7 . 1 1 111 111 LYS C C 136 177.600 177.600 177.739 -0.139 17865
4584 1 7 . 1 1 111 111 LYS CA C 136 58.749 58.749 58.308 0.441 17865
4585 1 7 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.747 0.491 17865
4586 1 7 . 1 1 111 111 LYS H H 136 7.540 7.540 7.396 0.144 17865
4587 1 7 . 1 1 112 112 TYR N N 137 114.768 114.768 116.323 -1.555 17865
4588 1 7 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.563 -0.040 17865
4589 1 7 . 1 1 112 112 TYR C C 137 174.690 174.690 175.461 -0.771 17865
4590 1 7 . 1 1 112 112 TYR CA C 137 58.359 58.359 57.763 0.596 17865
4591 1 7 . 1 1 112 112 TYR CB C 137 38.328 38.328 37.834 0.494 17865
4592 1 7 . 1 1 112 112 TYR H H 137 7.488 7.488 7.623 -0.135 17865
4593 1 7 . 1 1 113 113 LYS N N 138 123.694 123.694 123.063 0.631 17865
4594 1 7 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.658 -0.157 17865
4595 1 7 . 1 1 113 113 LYS CA C 138 55.282 55.282 53.914 1.367 17865
4596 1 7 . 1 1 113 113 LYS CB C 138 32.124 32.124 32.875 -0.751 17865
4597 1 7 . 1 1 113 113 LYS H H 138 7.217 7.217 7.661 -0.444 17865
4598 1 7 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.670 -0.218 17865
4599 1 7 . 1 1 114 114 PRO C C 139 176.974 176.974 175.459 1.515 17865
4600 1 7 . 1 1 114 114 PRO CA C 139 63.189 63.189 62.135 1.054 17865
4601 1 7 . 1 1 114 114 PRO CB C 139 32.251 32.251 30.607 1.644 17865
4602 1 7 . 1 1 115 115 VAL N N 140 121.098 121.098 122.463 -1.365 17865
4603 1 7 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.127 -0.025 17865
4604 1 7 . 1 1 115 115 VAL C C 140 176.207 176.207 175.536 0.671 17865
4605 1 7 . 1 1 115 115 VAL CA C 140 62.356 62.356 62.428 -0.072 17865
4606 1 7 . 1 1 115 115 VAL CB C 140 33.256 33.256 30.934 2.321 17865
4607 1 7 . 1 1 115 115 VAL H H 140 8.272 8.272 7.657 0.615 17865
4608 1 7 . 1 1 116 116 VAL N N 141 124.167 124.167 127.818 -3.651 17865
4609 1 7 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.371 -0.249 17865
4610 1 7 . 1 1 116 116 VAL C C 141 175.415 175.415 175.522 -0.107 17865
4611 1 7 . 1 1 116 116 VAL CA C 141 61.731 61.731 61.005 0.726 17865
4612 1 7 . 1 1 116 116 VAL CB C 141 33.145 33.145 34.259 -1.114 17865
4613 1 7 . 1 1 116 116 VAL H H 141 8.142 8.142 8.066 0.076 17865
4614 1 7 . 1 1 117 117 ASP N N 142 126.737 126.737 123.603 3.134 17865
4615 1 7 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.695 0.117 17865
4616 1 7 . 1 1 117 117 ASP CA C 142 52.217 52.217 53.389 -1.172 17865
4617 1 7 . 1 1 117 117 ASP CB C 142 41.368 41.368 41.405 -0.037 17865
4618 1 7 . 1 1 117 117 ASP H H 142 8.419 8.419 8.564 -0.145 17865
4619 1 7 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.642 -0.231 17865
4620 1 7 . 1 1 118 118 PRO C C 143 176.662 176.662 175.836 0.826 17865
4621 1 7 . 1 1 118 118 PRO CA C 143 63.247 63.247 62.066 1.181 17865
4622 1 7 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.873 -0.563 17865
4623 1 7 . 1 1 119 119 ASN N N 144 119.287 119.287 117.832 1.455 17865
4624 1 7 . 1 1 119 119 ASN HA H 144 4.947 4.947 5.057 -0.110 17865
4625 1 7 . 1 1 119 119 ASN CA C 144 51.633 51.633 52.038 -0.405 17865
4626 1 7 . 1 1 119 119 ASN CB C 144 38.859 38.859 38.414 0.445 17865
4627 1 7 . 1 1 119 119 ASN H H 144 8.432 8.432 8.324 0.108 17865
4628 1 7 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.698 -0.018 17865
4629 1 7 . 1 1 120 120 PRO CA C 145 61.640 61.640 62.100 -0.460 17865
4630 1 7 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.634 -0.716 17865
4631 1 7 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.581 -0.204 17865
4632 1 7 . 1 1 121 121 PRO C C 146 175.876 175.876 175.956 -0.080 17865
4633 1 7 . 1 1 121 121 PRO CA C 146 63.174 63.174 62.636 0.538 17865
4634 1 7 . 1 1 121 121 PRO CB C 146 31.939 31.939 32.630 -0.691 17865
4635 1 8 . 1 1 2 2 ASP N N 27 121.041 121.041 123.945 -2.904 17865
4636 1 8 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.892 -0.254 17865
4637 1 8 . 1 1 2 2 ASP C C 27 175.878 175.878 175.261 0.617 17865
4638 1 8 . 1 1 2 2 ASP CA C 27 54.382 54.382 54.586 -0.204 17865
4639 1 8 . 1 1 2 2 ASP CB C 27 41.729 41.729 40.376 1.353 17865
4640 1 8 . 1 1 2 2 ASP H H 27 8.639 8.639 8.533 0.106 17865
4641 1 8 . 1 1 3 3 VAL N N 28 119.901 119.901 124.098 -4.197 17865
4642 1 8 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.261 -0.228 17865
4643 1 8 . 1 1 3 3 VAL C C 28 175.521 175.521 174.433 1.088 17865
4644 1 8 . 1 1 3 3 VAL CA C 28 62.216 62.216 61.807 0.409 17865
4645 1 8 . 1 1 3 3 VAL CB C 28 33.003 33.003 33.410 -0.407 17865
4646 1 8 . 1 1 3 3 VAL H H 28 8.113 8.113 7.912 0.201 17865
4647 1 8 . 1 1 4 4 PHE N N 29 123.707 123.707 129.182 -5.475 17865
4648 1 8 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.666 -0.010 17865
4649 1 8 . 1 1 4 4 PHE C C 29 174.874 174.874 174.432 0.442 17865
4650 1 8 . 1 1 4 4 PHE CA C 29 57.159 57.159 57.755 -0.596 17865
4651 1 8 . 1 1 4 4 PHE CB C 29 39.795 39.795 39.430 0.365 17865
4652 1 8 . 1 1 4 4 PHE H H 29 8.255 8.255 8.733 -0.478 17865
4653 1 8 . 1 1 5 5 ASP N N 30 124.203 124.203 128.762 -4.559 17865
4654 1 8 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.621 0.217 17865
4655 1 8 . 1 1 5 5 ASP CA C 30 52.385 52.385 52.508 -0.123 17865
4656 1 8 . 1 1 5 5 ASP CB C 30 40.801 40.801 42.227 -1.426 17865
4657 1 8 . 1 1 5 5 ASP H H 30 8.226 8.226 8.084 0.142 17865
4658 1 8 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.524 0.013 17865
4659 1 8 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.396 -0.732 17865
4660 1 8 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.519 -0.693 17865
4661 1 8 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.518 -0.092 17865
4662 1 8 . 1 1 7 7 PRO C C 32 177.226 177.226 175.797 1.429 17865
4663 1 8 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.451 -0.282 17865
4664 1 8 . 1 1 7 7 PRO CB C 32 31.948 31.948 30.762 1.186 17865
4665 1 8 . 1 1 8 8 THR N N 33 114.158 114.158 118.988 -4.830 17865
4666 1 8 . 1 1 8 8 THR HA H 33 4.195 4.195 4.420 -0.225 17865
4667 1 8 . 1 1 8 8 THR C C 33 174.468 174.468 173.682 0.786 17865
4668 1 8 . 1 1 8 8 THR CA C 33 62.110 62.110 61.516 0.594 17865
4669 1 8 . 1 1 8 8 THR CB C 33 69.975 69.975 69.936 0.039 17865
4670 1 8 . 1 1 8 8 THR H H 33 8.096 8.096 8.203 -0.107 17865
4671 1 8 . 1 1 9 9 GLN N N 34 122.411 122.411 125.821 -3.410 17865
4672 1 8 . 1 1 9 9 GLN HA H 34 4.263 4.263 3.681 0.582 17865
4673 1 8 . 1 1 9 9 GLN C C 34 175.445 175.445 174.505 0.940 17865
4674 1 8 . 1 1 9 9 GLN CA C 34 55.763 55.763 56.216 -0.453 17865
4675 1 8 . 1 1 9 9 GLN CB C 34 29.691 29.691 28.266 1.425 17865
4676 1 8 . 1 1 9 9 GLN H H 34 8.278 8.278 8.488 -0.210 17865
4677 1 8 . 1 1 10 10 TYR N N 35 121.048 121.048 118.784 2.264 17865
4678 1 8 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.348 0.172 17865
4679 1 8 . 1 1 10 10 TYR C C 35 176.314 176.314 176.339 -0.025 17865
4680 1 8 . 1 1 10 10 TYR CA C 35 57.972 57.972 57.811 0.161 17865
4681 1 8 . 1 1 10 10 TYR CB C 35 38.936 38.936 38.399 0.537 17865
4682 1 8 . 1 1 10 10 TYR H H 35 8.227 8.227 7.091 1.136 17865
4683 1 8 . 1 1 11 11 GLY N N 36 109.711 109.711 110.177 -0.466 17865
4684 1 8 . 1 1 11 11 GLY C C 36 174.128 174.128 174.423 -0.295 17865
4685 1 8 . 1 1 11 11 GLY CA C 36 45.212 45.212 45.995 -0.783 17865
4686 1 8 . 1 1 11 11 GLY H H 36 8.247 8.247 8.053 0.194 17865
4687 1 8 . 1 1 12 12 TYR N N 37 120.302 120.302 119.903 0.399 17865
4688 1 8 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.730 -0.248 17865
4689 1 8 . 1 1 12 12 TYR C C 37 175.864 175.864 174.673 1.191 17865
4690 1 8 . 1 1 12 12 TYR CA C 37 58.541 58.541 54.411 4.130 17865
4691 1 8 . 1 1 12 12 TYR CB C 37 38.715 38.715 38.491 0.224 17865
4692 1 8 . 1 1 12 12 TYR H H 37 8.101 8.101 6.783 1.318 17865
4693 1 8 . 1 1 13 13 ASP N N 38 121.883 121.883 120.172 1.711 17865
4694 1 8 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.602 -0.116 17865
4695 1 8 . 1 1 13 13 ASP C C 38 176.538 176.538 176.562 -0.024 17865
4696 1 8 . 1 1 13 13 ASP CA C 38 54.223 54.223 54.413 -0.190 17865
4697 1 8 . 1 1 13 13 ASP CB C 38 40.988 40.988 41.249 -0.262 17865
4698 1 8 . 1 1 13 13 ASP H H 38 8.266 8.266 8.252 0.014 17865
4699 1 8 . 1 1 14 14 GLY N N 39 107.705 107.705 113.849 -6.144 17865
4700 1 8 . 1 1 14 14 GLY C C 39 173.822 173.822 173.503 0.319 17865
4701 1 8 . 1 1 14 14 GLY CA C 39 45.404 45.404 45.189 0.215 17865
4702 1 8 . 1 1 14 14 GLY H H 39 7.647 7.647 7.970 -0.323 17865
4703 1 8 . 1 1 15 15 LYS N N 40 121.621 121.621 121.452 0.169 17865
4704 1 8 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.923 -0.348 17865
4705 1 8 . 1 1 15 15 LYS CA C 40 54.100 54.100 54.053 0.047 17865
4706 1 8 . 1 1 15 15 LYS CB C 40 32.510 32.510 34.516 -2.006 17865
4707 1 8 . 1 1 15 15 LYS H H 40 7.908 7.908 7.825 0.083 17865
4708 1 8 . 1 1 16 16 PRO HA H 41 4.352 4.352 3.874 0.478 17865
4709 1 8 . 1 1 16 16 PRO C C 41 176.806 176.806 176.427 0.379 17865
4710 1 8 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.104 0.654 17865
4711 1 8 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.393 -0.079 17865
4712 1 8 . 1 1 17 17 LEU N N 42 123.488 123.488 121.985 1.503 17865
4713 1 8 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.153 -0.104 17865
4714 1 8 . 1 1 17 17 LEU C C 42 174.973 174.973 176.051 -1.078 17865
4715 1 8 . 1 1 17 17 LEU CA C 42 55.436 55.436 55.633 -0.197 17865
4716 1 8 . 1 1 17 17 LEU CB C 42 42.093 42.093 41.633 0.460 17865
4717 1 8 . 1 1 17 17 LEU H H 42 8.499 8.499 8.129 0.370 17865
4718 1 8 . 1 1 18 18 ASP N N 43 123.354 123.354 125.372 -2.018 17865
4719 1 8 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.678 -0.180 17865
4720 1 8 . 1 1 18 18 ASP C C 43 175.947 175.947 176.059 -0.112 17865
4721 1 8 . 1 1 18 18 ASP CA C 43 52.858 52.858 53.175 -0.317 17865
4722 1 8 . 1 1 18 18 ASP CB C 43 42.221 42.221 42.654 -0.433 17865
4723 1 8 . 1 1 18 18 ASP H H 43 7.789 7.789 7.972 -0.183 17865
4724 1 8 . 1 1 19 19 ALA N N 44 120.147 120.147 120.127 0.020 17865
4725 1 8 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.161 -0.175 17865
4726 1 8 . 1 1 19 19 ALA C C 44 179.476 179.476 178.956 0.520 17865
4727 1 8 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.577 0.586 17865
4728 1 8 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.746 -0.359 17865
4729 1 8 . 1 1 19 19 ALA H H 44 8.561 8.561 8.509 0.052 17865
4730 1 8 . 1 1 20 20 SER N N 45 115.037 115.037 114.696 0.341 17865
4731 1 8 . 1 1 20 20 SER HA H 45 4.151 4.151 4.115 0.036 17865
4732 1 8 . 1 1 20 20 SER C C 45 177.191 177.191 175.795 1.396 17865
4733 1 8 . 1 1 20 20 SER CA C 45 61.629 61.629 61.720 -0.091 17865
4734 1 8 . 1 1 20 20 SER CB C 45 62.804 62.804 62.981 -0.177 17865
4735 1 8 . 1 1 20 20 SER H H 45 8.466 8.466 8.546 -0.080 17865
4736 1 8 . 1 1 21 21 PHE N N 46 125.030 125.030 121.796 3.234 17865
4737 1 8 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.382 -0.151 17865
4738 1 8 . 1 1 21 21 PHE C C 46 176.850 176.850 176.687 0.163 17865
4739 1 8 . 1 1 21 21 PHE CA C 46 60.806 60.806 61.140 -0.334 17865
4740 1 8 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.513 0.368 17865
4741 1 8 . 1 1 21 21 PHE H H 46 8.034 8.034 7.866 0.168 17865
4742 1 8 . 1 1 22 22 CYS N N 47 113.943 113.943 117.702 -3.759 17865
4743 1 8 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.274 -0.023 17865
4744 1 8 . 1 1 22 22 CYS C C 47 176.449 176.449 175.919 0.530 17865
4745 1 8 . 1 1 22 22 CYS CA C 47 53.600 53.600 58.858 -5.258 17865
4746 1 8 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.941 10.450 17865
4747 1 8 . 1 1 22 22 CYS H H 47 7.691 7.691 7.781 -0.090 17865
4748 1 8 . 1 1 23 23 ARG N N 48 119.958 119.958 120.188 -0.230 17865
4749 1 8 . 1 1 23 23 ARG HA H 48 4.080 4.080 3.991 0.089 17865
4750 1 8 . 1 1 23 23 ARG C C 48 177.904 177.904 177.295 0.609 17865
4751 1 8 . 1 1 23 23 ARG CA C 48 58.907 58.907 58.833 0.074 17865
4752 1 8 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.326 0.845 17865
4753 1 8 . 1 1 23 23 ARG H H 48 7.628 7.628 7.715 -0.087 17865
4754 1 8 . 1 1 24 24 THR N N 49 106.445 106.445 112.710 -6.265 17865
4755 1 8 . 1 1 24 24 THR HA H 49 4.385 4.385 4.301 0.084 17865
4756 1 8 . 1 1 24 24 THR C C 49 174.758 174.758 174.600 0.158 17865
4757 1 8 . 1 1 24 24 THR CA C 49 61.573 61.573 62.382 -0.809 17865
4758 1 8 . 1 1 24 24 THR CB C 49 68.794 68.794 68.841 -0.047 17865
4759 1 8 . 1 1 24 24 THR H H 49 7.307 7.307 7.439 -0.132 17865
4760 1 8 . 1 1 25 25 ALA N N 50 122.242 122.242 122.171 0.071 17865
4761 1 8 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.247 0.157 17865
4762 1 8 . 1 1 25 25 ALA C C 50 178.554 178.554 178.028 0.526 17865
4763 1 8 . 1 1 25 25 ALA CA C 50 52.381 52.381 53.137 -0.756 17865
4764 1 8 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.646 -1.251 17865
4765 1 8 . 1 1 25 25 ALA H H 50 7.401 7.401 7.508 -0.107 17865
4766 1 8 . 1 1 26 26 GLY N N 51 110.604 110.604 106.929 3.675 17865
4767 1 8 . 1 1 26 26 GLY CA C 51 47.022 47.022 45.856 1.166 17865
4768 1 8 . 1 1 26 26 GLY H H 51 8.285 8.285 7.741 0.544 17865
4769 1 8 . 1 1 27 27 SER HA H 52 4.382 4.382 4.323 0.059 17865
4770 1 8 . 1 1 27 27 SER C C 52 175.774 175.774 175.680 0.094 17865
4771 1 8 . 1 1 27 27 SER CA C 52 60.803 60.803 60.879 -0.076 17865
4772 1 8 . 1 1 27 27 SER CB C 52 62.827 62.827 63.022 -0.195 17865
4773 1 8 . 1 1 28 28 ARG N N 53 119.682 119.682 119.254 0.428 17865
4774 1 8 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.747 0.133 17865
4775 1 8 . 1 1 28 28 ARG C C 53 175.796 175.796 177.600 -1.804 17865
4776 1 8 . 1 1 28 28 ARG CA C 53 55.738 55.738 55.656 0.082 17865
4777 1 8 . 1 1 28 28 ARG CB C 53 30.237 30.237 29.809 0.428 17865
4778 1 8 . 1 1 28 28 ARG H H 53 7.894 7.894 7.836 0.058 17865
4779 1 8 . 1 1 29 29 GLU N N 54 122.318 122.318 120.667 1.651 17865
4780 1 8 . 1 1 29 29 GLU HA H 54 3.595 3.595 3.949 -0.354 17865
4781 1 8 . 1 1 29 29 GLU C C 54 177.523 177.523 177.693 -0.170 17865
4782 1 8 . 1 1 29 29 GLU CA C 54 61.223 61.223 59.848 1.375 17865
4783 1 8 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.435 -0.498 17865
4784 1 8 . 1 1 29 29 GLU H H 54 7.730 7.730 8.004 -0.274 17865
4785 1 8 . 1 1 30 30 LYS N N 55 118.377 118.377 118.063 0.314 17865
4786 1 8 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.061 -0.233 17865
4787 1 8 . 1 1 30 30 LYS C C 55 179.205 179.205 178.724 0.481 17865
4788 1 8 . 1 1 30 30 LYS CA C 55 60.427 60.427 58.993 1.434 17865
4789 1 8 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.328 -0.727 17865
4790 1 8 . 1 1 30 30 LYS H H 55 8.659 8.659 7.505 1.154 17865
4791 1 8 . 1 1 31 31 ASP N N 56 121.614 121.614 119.088 2.526 17865
4792 1 8 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.583 -0.272 17865
4793 1 8 . 1 1 31 31 ASP C C 56 177.393 177.393 178.547 -1.154 17865
4794 1 8 . 1 1 31 31 ASP CA C 56 57.316 57.316 56.583 0.734 17865
4795 1 8 . 1 1 31 31 ASP CB C 56 40.423 40.423 40.975 -0.552 17865
4796 1 8 . 1 1 31 31 ASP H H 56 7.646 7.646 8.191 -0.545 17865
4797 1 8 . 1 1 32 32 CYS N N 57 120.345 120.345 119.483 0.862 17865
4798 1 8 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.407 0.194 17865
4799 1 8 . 1 1 32 32 CYS C C 57 175.772 175.772 176.194 -0.422 17865
4800 1 8 . 1 1 32 32 CYS CA C 57 60.197 60.197 61.151 -0.954 17865
4801 1 8 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.681 8.284 17865
4802 1 8 . 1 1 32 32 CYS H H 57 8.042 8.042 7.970 0.072 17865
4803 1 8 . 1 1 33 33 ARG N N 58 120.293 120.293 118.487 1.806 17865
4804 1 8 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.978 -0.302 17865
4805 1 8 . 1 1 33 33 ARG C C 58 179.633 179.633 178.810 0.823 17865
4806 1 8 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.421 0.965 17865
4807 1 8 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.931 -0.090 17865
4808 1 8 . 1 1 33 33 ARG H H 58 8.531 8.531 7.827 0.704 17865
4809 1 8 . 1 1 34 34 LYS N N 59 121.166 121.166 119.471 1.695 17865
4810 1 8 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.177 -0.141 17865
4811 1 8 . 1 1 34 34 LYS C C 59 179.220 179.220 179.013 0.207 17865
4812 1 8 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.575 0.955 17865
4813 1 8 . 1 1 34 34 LYS CB C 59 32.110 32.110 32.120 -0.009 17865
4814 1 8 . 1 1 34 34 LYS H H 59 7.633 7.633 7.593 0.040 17865
4815 1 8 . 1 1 35 35 ASP N N 60 122.166 122.166 120.675 1.491 17865
4816 1 8 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.519 -0.088 17865
4817 1 8 . 1 1 35 35 ASP C C 60 179.709 179.709 178.737 0.972 17865
4818 1 8 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.647 0.056 17865
4819 1 8 . 1 1 35 35 ASP CB C 60 40.672 40.672 40.915 -0.243 17865
4820 1 8 . 1 1 35 35 ASP H H 60 8.221 8.221 7.724 0.497 17865
4821 1 8 . 1 1 36 36 VAL N N 61 121.312 121.312 119.193 2.119 17865
4822 1 8 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.713 -0.312 17865
4823 1 8 . 1 1 36 36 VAL C C 61 178.339 178.339 178.399 -0.060 17865
4824 1 8 . 1 1 36 36 VAL CA C 61 67.133 67.133 66.419 0.714 17865
4825 1 8 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.765 -0.108 17865
4826 1 8 . 1 1 36 36 VAL H H 61 8.916 8.916 8.380 0.536 17865
4827 1 8 . 1 1 37 37 GLN N N 62 119.166 119.166 118.403 0.763 17865
4828 1 8 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.156 -0.214 17865
4829 1 8 . 1 1 37 37 GLN C C 62 177.293 177.293 177.058 0.235 17865
4830 1 8 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.360 0.920 17865
4831 1 8 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.122 0.249 17865
4832 1 8 . 1 1 37 37 GLN H H 62 7.697 7.697 7.639 0.057 17865
4833 1 8 . 1 1 38 38 ALA N N 63 118.964 118.964 121.317 -2.353 17865
4834 1 8 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.238 0.004 17865
4835 1 8 . 1 1 38 38 ALA C C 63 177.221 177.221 177.021 0.200 17865
4836 1 8 . 1 1 38 38 ALA CA C 63 53.137 53.137 52.602 0.534 17865
4837 1 8 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.318 -0.421 17865
4838 1 8 . 1 1 38 38 ALA H H 63 7.508 7.508 7.818 -0.310 17865
4839 1 8 . 1 1 39 39 CYS N N 64 119.081 119.081 118.677 0.404 17865
4840 1 8 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.555 0.398 17865
4841 1 8 . 1 1 39 39 CYS C C 64 172.052 172.052 174.401 -2.349 17865
4842 1 8 . 1 1 39 39 CYS CA C 64 51.880 51.880 57.770 -5.890 17865
4843 1 8 . 1 1 39 39 CYS CB C 64 34.328 34.328 26.293 8.035 17865
4844 1 8 . 1 1 39 39 CYS H H 64 7.354 7.354 7.538 -0.184 17865
4845 1 8 . 1 1 40 40 ASP N N 65 124.167 124.167 128.700 -4.533 17865
4846 1 8 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.382 -0.057 17865
4847 1 8 . 1 1 40 40 ASP C C 65 176.496 176.496 177.424 -0.928 17865
4848 1 8 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.994 -0.270 17865
4849 1 8 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.486 -0.173 17865
4850 1 8 . 1 1 40 40 ASP H H 65 8.142 8.142 8.772 -0.630 17865
4851 1 8 . 1 1 41 41 LYS N N 66 118.844 118.844 119.922 -1.078 17865
4852 1 8 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.097 0.427 17865
4853 1 8 . 1 1 41 41 LYS C C 66 175.586 175.586 178.416 -2.830 17865
4854 1 8 . 1 1 41 41 LYS CA C 66 55.275 55.275 58.480 -3.204 17865
4855 1 8 . 1 1 41 41 LYS CB C 66 32.598 32.598 32.681 -0.083 17865
4856 1 8 . 1 1 41 41 LYS H H 66 7.858 7.858 8.433 -0.575 17865
4857 1 8 . 1 1 42 42 LYS N N 67 126.081 126.081 112.931 13.150 17865
4858 1 8 . 1 1 42 42 LYS HA H 67 3.915 3.915 3.732 0.183 17865
4859 1 8 . 1 1 42 42 LYS C C 67 174.665 174.665 175.792 -1.127 17865
4860 1 8 . 1 1 42 42 LYS CA C 67 57.827 57.827 58.295 -0.468 17865
4861 1 8 . 1 1 42 42 LYS CB C 67 34.059 34.059 31.404 2.655 17865
4862 1 8 . 1 1 42 42 LYS H H 67 8.790 8.790 8.632 0.158 17865
4863 1 8 . 1 1 43 43 TYR N N 68 114.138 114.138 118.141 -4.003 17865
4864 1 8 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.991 0.268 17865
4865 1 8 . 1 1 43 43 TYR C C 68 175.767 175.767 175.841 -0.074 17865
4866 1 8 . 1 1 43 43 TYR CA C 68 55.880 55.880 57.226 -1.346 17865
4867 1 8 . 1 1 43 43 TYR CB C 68 42.363 42.363 40.787 1.576 17865
4868 1 8 . 1 1 43 43 TYR H H 68 7.294 7.294 7.542 -0.248 17865
4869 1 8 . 1 1 44 44 ASP N N 69 121.807 121.807 122.477 -0.670 17865
4870 1 8 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.620 0.020 17865
4871 1 8 . 1 1 44 44 ASP C C 69 177.812 177.812 177.848 -0.036 17865
4872 1 8 . 1 1 44 44 ASP CA C 69 52.110 52.110 54.213 -2.103 17865
4873 1 8 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.251 -1.811 17865
4874 1 8 . 1 1 44 44 ASP H H 69 8.995 8.995 9.053 -0.058 17865
4875 1 8 . 1 1 45 45 ASP N N 70 116.686 116.686 121.483 -4.797 17865
4876 1 8 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.447 -0.023 17865
4877 1 8 . 1 1 45 45 ASP C C 70 177.054 177.054 177.242 -0.188 17865
4878 1 8 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.494 -0.113 17865
4879 1 8 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.910 -0.662 17865
4880 1 8 . 1 1 45 45 ASP H H 70 8.369 8.369 8.782 -0.413 17865
4881 1 8 . 1 1 46 46 GLN N N 71 117.949 117.949 116.854 1.095 17865
4882 1 8 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.439 0.017 17865
4883 1 8 . 1 1 46 46 GLN C C 71 176.273 176.273 176.488 -0.215 17865
4884 1 8 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.307 0.060 17865
4885 1 8 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.349 -0.018 17865
4886 1 8 . 1 1 46 46 GLN H H 71 8.274 8.274 8.471 -0.197 17865
4887 1 8 . 1 1 47 47 GLY N N 72 108.369 108.369 106.074 2.295 17865
4888 1 8 . 1 1 47 47 GLY C C 72 174.145 174.145 174.456 -0.311 17865
4889 1 8 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.012 0.811 17865
4890 1 8 . 1 1 47 47 GLY H H 72 8.174 8.174 7.945 0.229 17865
4891 1 8 . 1 1 48 48 ARG N N 73 121.554 121.554 119.810 1.744 17865
4892 1 8 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.604 -0.119 17865
4893 1 8 . 1 1 48 48 ARG C C 73 176.855 176.855 175.544 1.311 17865
4894 1 8 . 1 1 48 48 ARG CA C 73 55.289 55.289 53.639 1.650 17865
4895 1 8 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.487 -0.929 17865
4896 1 8 . 1 1 48 48 ARG H H 73 8.462 8.462 8.089 0.373 17865
4897 1 8 . 1 1 49 49 GLU N N 74 122.784 122.784 120.596 2.188 17865
4898 1 8 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.548 -0.065 17865
4899 1 8 . 1 1 49 49 GLU C C 74 178.098 178.098 177.088 1.010 17865
4900 1 8 . 1 1 49 49 GLU CA C 74 57.184 57.184 56.779 0.405 17865
4901 1 8 . 1 1 49 49 GLU CB C 74 30.777 30.777 30.587 0.190 17865
4902 1 8 . 1 1 49 49 GLU H H 74 8.703 8.703 8.654 0.049 17865
4903 1 8 . 1 1 50 50 THR N N 75 114.563 114.563 114.426 0.137 17865
4904 1 8 . 1 1 50 50 THR HA H 75 4.212 4.212 4.476 -0.264 17865
4905 1 8 . 1 1 50 50 THR C C 75 175.170 175.170 175.536 -0.366 17865
4906 1 8 . 1 1 50 50 THR CA C 75 60.589 60.589 60.741 -0.152 17865
4907 1 8 . 1 1 50 50 THR CB C 75 70.952 70.952 70.319 0.633 17865
4908 1 8 . 1 1 50 50 THR H H 75 7.717 7.717 8.137 -0.420 17865
4909 1 8 . 1 1 51 51 ALA N N 76 122.097 122.097 122.777 -0.680 17865
4910 1 8 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.016 0.022 17865
4911 1 8 . 1 1 51 51 ALA C C 76 181.906 181.906 179.495 2.411 17865
4912 1 8 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.214 0.440 17865
4913 1 8 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.222 -0.229 17865
4914 1 8 . 1 1 51 51 ALA H H 76 8.734 8.734 8.686 0.048 17865
4915 1 8 . 1 1 52 52 CYS N N 77 115.347 115.347 115.361 -0.014 17865
4916 1 8 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.126 0.354 17865
4917 1 8 . 1 1 52 52 CYS C C 77 176.299 176.299 176.788 -0.489 17865
4918 1 8 . 1 1 52 52 CYS CA C 77 57.701 57.701 59.771 -2.070 17865
4919 1 8 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.571 10.060 17865
4920 1 8 . 1 1 52 52 CYS H H 77 9.073 9.073 8.269 0.804 17865
4921 1 8 . 1 1 53 53 ALA N N 78 128.517 128.517 123.811 4.706 17865
4922 1 8 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.878 -0.023 17865
4923 1 8 . 1 1 53 53 ALA C C 78 178.736 178.736 179.133 -0.397 17865
4924 1 8 . 1 1 53 53 ALA CA C 78 55.633 55.633 54.814 0.819 17865
4925 1 8 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.956 1.235 17865
4926 1 8 . 1 1 53 53 ALA H H 78 7.174 7.174 7.604 -0.430 17865
4927 1 8 . 1 1 54 54 LYS N N 79 118.706 118.706 119.210 -0.504 17865
4928 1 8 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.154 -0.351 17865
4929 1 8 . 1 1 54 54 LYS C C 79 179.611 179.611 178.810 0.801 17865
4930 1 8 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.553 1.172 17865
4931 1 8 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.595 0.058 17865
4932 1 8 . 1 1 54 54 LYS H H 79 8.313 8.313 8.386 -0.073 17865
4933 1 8 . 1 1 55 55 GLY N N 80 104.822 104.822 107.792 -2.970 17865
4934 1 8 . 1 1 55 55 GLY C C 80 176.504 176.504 176.020 0.484 17865
4935 1 8 . 1 1 55 55 GLY CA C 80 46.839 46.839 47.043 -0.204 17865
4936 1 8 . 1 1 55 55 GLY H H 80 8.175 8.175 7.943 0.232 17865
4937 1 8 . 1 1 56 56 ILE N N 81 123.697 123.697 122.634 1.063 17865
4938 1 8 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.888 -0.093 17865
4939 1 8 . 1 1 56 56 ILE C C 81 177.334 177.334 177.993 -0.659 17865
4940 1 8 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.902 0.379 17865
4941 1 8 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.851 0.484 17865
4942 1 8 . 1 1 56 56 ILE H H 81 7.590 7.590 7.518 0.072 17865
4943 1 8 . 1 1 57 57 ARG N N 82 118.161 118.161 118.077 0.084 17865
4944 1 8 . 1 1 57 57 ARG HA H 82 3.935 3.935 4.218 -0.283 17865
4945 1 8 . 1 1 57 57 ARG C C 82 178.662 178.662 179.116 -0.454 17865
4946 1 8 . 1 1 57 57 ARG CA C 82 59.702 59.702 58.614 1.088 17865
4947 1 8 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.064 0.835 17865
4948 1 8 . 1 1 57 57 ARG H H 82 7.569 7.569 7.592 -0.023 17865
4949 1 8 . 1 1 58 58 GLU N N 83 115.085 115.085 119.223 -4.138 17865
4950 1 8 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.078 -0.047 17865
4951 1 8 . 1 1 58 58 GLU C C 83 178.224 178.224 179.030 -0.806 17865
4952 1 8 . 1 1 58 58 GLU CA C 83 58.304 58.304 58.351 -0.047 17865
4953 1 8 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.700 0.331 17865
4954 1 8 . 1 1 58 58 GLU H H 83 7.786 7.786 7.618 0.168 17865
4955 1 8 . 1 1 59 59 LYS N N 84 119.183 119.183 120.195 -1.012 17865
4956 1 8 . 1 1 59 59 LYS HA H 84 3.830 3.830 3.915 -0.085 17865
4957 1 8 . 1 1 59 59 LYS C C 84 177.933 177.933 177.041 0.892 17865
4958 1 8 . 1 1 59 59 LYS CA C 84 59.043 59.043 58.139 0.904 17865
4959 1 8 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.893 0.757 17865
4960 1 8 . 1 1 59 59 LYS H H 84 7.968 7.968 8.209 -0.241 17865
4961 1 8 . 1 1 60 60 TYR N N 85 113.663 113.663 115.490 -1.827 17865
4962 1 8 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.652 0.051 17865
4963 1 8 . 1 1 60 60 TYR C C 85 174.729 174.729 174.615 0.114 17865
4964 1 8 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.195 1.007 17865
4965 1 8 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.784 0.118 17865
4966 1 8 . 1 1 60 60 TYR H H 85 7.562 7.562 7.667 -0.105 17865
4967 1 8 . 1 1 61 61 LYS N N 86 121.862 121.862 124.523 -2.661 17865
4968 1 8 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.447 0.065 17865
4969 1 8 . 1 1 61 61 LYS CA C 86 54.942 54.942 56.027 -1.085 17865
4970 1 8 . 1 1 61 61 LYS CB C 86 32.102 32.102 33.028 -0.926 17865
4971 1 8 . 1 1 61 61 LYS H H 86 7.222 7.222 7.463 -0.241 17865
4972 1 8 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.489 -0.166 17865
4973 1 8 . 1 1 62 62 PRO C C 87 176.576 176.576 176.040 0.536 17865
4974 1 8 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.358 0.662 17865
4975 1 8 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.401 -0.161 17865
4976 1 8 . 1 1 63 63 ALA N N 88 125.029 125.029 123.134 1.895 17865
4977 1 8 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.299 -0.045 17865
4978 1 8 . 1 1 63 63 ALA C C 88 177.301 177.301 176.532 0.769 17865
4979 1 8 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.283 -0.002 17865
4980 1 8 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.018 2.184 17865
4981 1 8 . 1 1 63 63 ALA H H 88 8.329 8.329 8.157 0.172 17865
4982 1 8 . 1 1 64 64 VAL N N 89 121.843 121.843 120.662 1.181 17865
4983 1 8 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.480 -0.536 17865
4984 1 8 . 1 1 64 64 VAL C C 89 174.791 174.791 174.017 0.774 17865
4985 1 8 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.375 1.606 17865
4986 1 8 . 1 1 64 64 VAL CB C 89 33.485 33.485 35.319 -1.834 17865
4987 1 8 . 1 1 64 64 VAL H H 89 8.075 8.075 7.624 0.451 17865
4988 1 8 . 1 1 65 65 VAL N N 90 125.399 125.399 117.023 8.376 17865
4989 1 8 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.517 -0.379 17865
4990 1 8 . 1 1 65 65 VAL C C 90 174.340 174.340 174.118 0.222 17865
4991 1 8 . 1 1 65 65 VAL CA C 90 61.162 61.162 61.463 -0.301 17865
4992 1 8 . 1 1 65 65 VAL CB C 90 33.866 33.866 33.497 0.369 17865
4993 1 8 . 1 1 65 65 VAL H H 90 8.229 8.229 7.898 0.331 17865
4994 1 8 . 1 1 66 66 TYR N N 91 124.848 124.848 125.237 -0.389 17865
4995 1 8 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.952 -0.181 17865
4996 1 8 . 1 1 66 66 TYR C C 91 176.658 176.658 176.545 0.113 17865
4997 1 8 . 1 1 66 66 TYR CA C 91 58.084 58.084 57.522 0.562 17865
4998 1 8 . 1 1 66 66 TYR CB C 91 41.535 41.535 40.894 0.641 17865
4999 1 8 . 1 1 66 66 TYR H H 91 9.145 9.145 8.454 0.691 17865
5000 1 8 . 1 1 67 67 GLY N N 92 106.185 106.185 110.660 -4.475 17865
5001 1 8 . 1 1 67 67 GLY C C 92 175.681 175.681 175.216 0.465 17865
5002 1 8 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.953 0.022 17865
5003 1 8 . 1 1 67 67 GLY H H 92 8.730 8.730 9.214 -0.484 17865
5004 1 8 . 1 1 68 68 TYR N N 93 121.815 121.815 117.321 4.494 17865
5005 1 8 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.479 -0.504 17865
5006 1 8 . 1 1 68 68 TYR C C 93 176.035 176.035 176.103 -0.068 17865
5007 1 8 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.247 1.799 17865
5008 1 8 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.213 0.212 17865
5009 1 8 . 1 1 68 68 TYR H H 93 8.711 8.711 8.979 -0.268 17865
5010 1 8 . 1 1 69 69 ASP N N 94 115.507 115.507 118.907 -3.400 17865
5011 1 8 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.361 -0.073 17865
5012 1 8 . 1 1 69 69 ASP C C 94 177.063 177.063 177.389 -0.326 17865
5013 1 8 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.246 -0.235 17865
5014 1 8 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.851 -0.684 17865
5015 1 8 . 1 1 69 69 ASP H H 94 8.010 8.010 7.786 0.224 17865
5016 1 8 . 1 1 70 70 GLY N N 95 107.196 107.196 107.084 0.112 17865
5017 1 8 . 1 1 70 70 GLY C C 95 173.936 173.936 174.469 -0.533 17865
5018 1 8 . 1 1 70 70 GLY CA C 95 45.392 45.392 44.987 0.404 17865
5019 1 8 . 1 1 70 70 GLY H H 95 7.986 7.986 7.624 0.362 17865
5020 1 8 . 1 1 71 71 LYS N N 96 121.258 121.258 121.684 -0.426 17865
5021 1 8 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.688 0.096 17865
5022 1 8 . 1 1 71 71 LYS CA C 96 54.114 54.114 53.628 0.486 17865
5023 1 8 . 1 1 71 71 LYS CB C 96 31.762 31.762 32.736 -0.974 17865
5024 1 8 . 1 1 71 71 LYS H H 96 7.877 7.877 7.813 0.064 17865
5025 1 8 . 1 1 72 72 PRO C C 97 177.170 177.170 175.485 1.685 17865
5026 1 8 . 1 1 72 72 PRO CA C 97 63.137 63.137 62.431 0.706 17865
5027 1 8 . 1 1 72 72 PRO CB C 97 32.240 32.240 30.663 1.577 17865
5028 1 8 . 1 1 73 73 LEU N N 98 123.503 123.503 122.675 0.828 17865
5029 1 8 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.766 -0.406 17865
5030 1 8 . 1 1 73 73 LEU C C 98 176.354 176.354 175.284 1.070 17865
5031 1 8 . 1 1 73 73 LEU CA C 98 53.927 53.927 52.672 1.256 17865
5032 1 8 . 1 1 73 73 LEU CB C 98 42.272 42.272 44.871 -2.599 17865
5033 1 8 . 1 1 73 73 LEU H H 98 8.850 8.850 7.691 1.159 17865
5034 1 8 . 1 1 74 74 ASP N N 99 122.212 122.212 123.057 -0.845 17865
5035 1 8 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.724 -0.127 17865
5036 1 8 . 1 1 74 74 ASP C C 99 175.819 175.819 176.686 -0.867 17865
5037 1 8 . 1 1 74 74 ASP CA C 99 53.856 53.856 54.742 -0.886 17865
5038 1 8 . 1 1 74 74 ASP CB C 99 40.989 40.989 42.336 -1.347 17865
5039 1 8 . 1 1 74 74 ASP H H 99 8.517 8.517 8.560 -0.043 17865
5040 1 8 . 1 1 75 75 LEU N N 100 125.874 125.874 114.640 11.234 17865
5041 1 8 . 1 1 75 75 LEU HA H 100 4.366 4.366 3.711 0.655 17865
5042 1 8 . 1 1 75 75 LEU C C 100 178.426 178.426 177.881 0.545 17865
5043 1 8 . 1 1 75 75 LEU CA C 100 53.631 53.631 56.422 -2.791 17865
5044 1 8 . 1 1 75 75 LEU CB C 100 40.676 40.676 39.856 0.820 17865
5045 1 8 . 1 1 75 75 LEU H H 100 8.281 8.281 8.344 -0.063 17865
5046 1 8 . 1 1 76 76 GLY N N 101 110.604 110.604 107.882 2.722 17865
5047 1 8 . 1 1 76 76 GLY C C 101 176.936 176.936 175.458 1.478 17865
5048 1 8 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.389 0.438 17865
5049 1 8 . 1 1 76 76 GLY H H 101 8.914 8.914 8.105 0.809 17865
5050 1 8 . 1 1 77 77 PHE N N 102 117.639 117.639 114.945 2.694 17865
5051 1 8 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.996 -0.615 17865
5052 1 8 . 1 1 77 77 PHE C C 102 177.878 177.878 175.557 2.321 17865
5053 1 8 . 1 1 77 77 PHE CA C 102 59.139 59.139 56.500 2.639 17865
5054 1 8 . 1 1 77 77 PHE CB C 102 36.935 36.935 37.938 -1.003 17865
5055 1 8 . 1 1 77 77 PHE H H 102 7.992 7.992 7.861 0.131 17865
5056 1 8 . 1 1 78 78 CYS N N 103 121.136 121.136 117.764 3.372 17865
5057 1 8 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.551 -0.166 17865
5058 1 8 . 1 1 78 78 CYS C C 103 172.780 172.780 176.947 -4.167 17865
5059 1 8 . 1 1 78 78 CYS CA C 103 53.696 53.696 58.593 -4.897 17865
5060 1 8 . 1 1 78 78 CYS CB C 103 34.237 34.237 28.187 6.050 17865
5061 1 8 . 1 1 78 78 CYS H H 103 7.362 7.362 7.953 -0.591 17865
5062 1 8 . 1 1 79 79 THR N N 104 114.773 114.773 119.491 -4.718 17865
5063 1 8 . 1 1 79 79 THR HA H 104 3.984 3.984 4.025 -0.041 17865
5064 1 8 . 1 1 79 79 THR C C 104 176.624 176.624 176.181 0.443 17865
5065 1 8 . 1 1 79 79 THR CA C 104 65.180 65.180 66.337 -1.157 17865
5066 1 8 . 1 1 79 79 THR CB C 104 69.062 69.062 68.782 0.280 17865
5067 1 8 . 1 1 79 79 THR H H 104 7.864 7.864 7.933 -0.069 17865
5068 1 8 . 1 1 80 80 LEU N N 105 119.785 119.785 118.976 0.809 17865
5069 1 8 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.305 0.026 17865
5070 1 8 . 1 1 80 80 LEU C C 105 177.208 177.208 176.819 0.389 17865
5071 1 8 . 1 1 80 80 LEU CA C 105 55.453 55.453 56.175 -0.722 17865
5072 1 8 . 1 1 80 80 LEU CB C 105 41.293 41.293 39.420 1.873 17865
5073 1 8 . 1 1 80 80 LEU H H 105 7.238 7.238 7.986 -0.748 17865
5074 1 8 . 1 1 81 81 ALA N N 106 119.309 119.309 120.070 -0.761 17865
5075 1 8 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.402 0.125 17865
5076 1 8 . 1 1 81 81 ALA C C 106 178.769 178.769 177.412 1.357 17865
5077 1 8 . 1 1 81 81 ALA CA C 106 52.049 52.049 52.070 -0.021 17865
5078 1 8 . 1 1 81 81 ALA CB C 106 18.820 18.820 20.363 -1.543 17865
5079 1 8 . 1 1 81 81 ALA H H 106 7.432 7.432 7.551 -0.119 17865
5080 1 8 . 1 1 82 82 GLY N N 107 109.793 109.793 107.419 2.374 17865
5081 1 8 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.038 2.080 17865
5082 1 8 . 1 1 82 82 GLY H H 107 7.918 7.918 7.815 0.103 17865
5083 1 8 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.799 0.467 17865
5084 1 8 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.252 0.011 17865
5085 1 8 . 1 1 83 83 ILE CB C 108 38.261 38.261 37.995 0.266 17865
5086 1 8 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.373 0.382 17865
5087 1 8 . 1 1 84 84 ARG C C 109 181.344 181.344 178.180 3.164 17865
5088 1 8 . 1 1 84 84 ARG CA C 109 55.939 55.939 56.940 -1.001 17865
5089 1 8 . 1 1 84 84 ARG CB C 109 30.283 30.283 28.745 1.538 17865
5090 1 8 . 1 1 85 85 GLU N N 110 122.944 122.944 120.563 2.381 17865
5091 1 8 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.096 -0.479 17865
5092 1 8 . 1 1 85 85 GLU C C 110 177.797 177.797 178.444 -0.647 17865
5093 1 8 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.574 1.154 17865
5094 1 8 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.367 -0.496 17865
5095 1 8 . 1 1 85 85 GLU H H 110 8.003 8.003 7.908 0.095 17865
5096 1 8 . 1 1 86 86 VAL N N 111 117.101 117.101 117.898 -0.797 17865
5097 1 8 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.646 -0.135 17865
5098 1 8 . 1 1 86 86 VAL C C 111 177.710 177.710 178.145 -0.435 17865
5099 1 8 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.323 0.107 17865
5100 1 8 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.006 0.206 17865
5101 1 8 . 1 1 86 86 VAL H H 111 8.106 8.106 8.069 0.037 17865
5102 1 8 . 1 1 87 87 ASP N N 112 122.242 122.242 118.921 3.321 17865
5103 1 8 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.324 -0.020 17865
5104 1 8 . 1 1 87 87 ASP C C 112 176.912 176.912 177.873 -0.961 17865
5105 1 8 . 1 1 87 87 ASP CA C 112 57.417 57.417 56.849 0.568 17865
5106 1 8 . 1 1 87 87 ASP CB C 112 40.476 40.476 39.953 0.523 17865
5107 1 8 . 1 1 87 87 ASP H H 112 7.401 7.401 8.035 -0.634 17865
5108 1 8 . 1 1 88 88 CYS N N 113 120.819 120.819 120.178 0.641 17865
5109 1 8 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.115 -0.806 17865
5110 1 8 . 1 1 88 88 CYS C C 113 175.270 175.270 176.796 -1.526 17865
5111 1 8 . 1 1 88 88 CYS CA C 113 59.759 59.759 62.015 -2.256 17865
5112 1 8 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.409 7.426 17865
5113 1 8 . 1 1 88 88 CYS H H 113 7.785 7.785 8.055 -0.270 17865
5114 1 8 . 1 1 89 89 ARG N N 114 118.654 118.654 119.327 -0.673 17865
5115 1 8 . 1 1 89 89 ARG HA H 114 3.641 3.641 3.840 -0.199 17865
5116 1 8 . 1 1 89 89 ARG C C 114 179.018 179.018 178.318 0.700 17865
5117 1 8 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.423 0.770 17865
5118 1 8 . 1 1 89 89 ARG CB C 114 29.713 29.713 30.023 -0.310 17865
5119 1 8 . 1 1 89 89 ARG H H 114 8.142 8.142 8.100 0.042 17865
5120 1 8 . 1 1 90 90 LYS N N 115 120.964 120.964 118.122 2.842 17865
5121 1 8 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.141 -0.111 17865
5122 1 8 . 1 1 90 90 LYS C C 115 180.092 180.092 179.306 0.786 17865
5123 1 8 . 1 1 90 90 LYS CA C 115 59.568 59.568 59.046 0.522 17865
5124 1 8 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.505 -0.284 17865
5125 1 8 . 1 1 90 90 LYS H H 115 7.936 7.936 7.546 0.390 17865
5126 1 8 . 1 1 91 91 ASP N N 116 121.690 121.690 119.521 2.169 17865
5127 1 8 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.631 -0.118 17865
5128 1 8 . 1 1 91 91 ASP C C 116 179.419 179.419 178.312 1.107 17865
5129 1 8 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.756 0.481 17865
5130 1 8 . 1 1 91 91 ASP CB C 116 40.648 40.648 40.835 -0.187 17865
5131 1 8 . 1 1 91 91 ASP H H 116 8.558 8.558 7.716 0.842 17865
5132 1 8 . 1 1 92 92 ALA N N 117 122.784 122.784 123.594 -0.810 17865
5133 1 8 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.181 -0.158 17865
5134 1 8 . 1 1 92 92 ALA C C 117 178.789 178.789 179.019 -0.230 17865
5135 1 8 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.117 -0.066 17865
5136 1 8 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.672 0.503 17865
5137 1 8 . 1 1 92 92 ALA H H 117 8.703 8.703 7.970 0.733 17865
5138 1 8 . 1 1 93 93 GLN N N 118 115.510 115.510 116.634 -1.124 17865
5139 1 8 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.207 -0.263 17865
5140 1 8 . 1 1 93 93 GLN C C 118 178.745 178.745 177.371 1.374 17865
5141 1 8 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.449 1.033 17865
5142 1 8 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.509 -0.112 17865
5143 1 8 . 1 1 93 93 GLN H H 118 7.664 7.664 8.515 -0.851 17865
5144 1 8 . 1 1 94 94 THR N N 119 110.110 110.110 115.147 -5.037 17865
5145 1 8 . 1 1 94 94 THR HA H 119 4.237 4.237 4.164 0.073 17865
5146 1 8 . 1 1 94 94 THR C C 119 175.861 175.861 175.768 0.093 17865
5147 1 8 . 1 1 94 94 THR CA C 119 64.604 64.604 65.368 -0.764 17865
5148 1 8 . 1 1 94 94 THR CB C 119 69.716 69.716 69.004 0.712 17865
5149 1 8 . 1 1 94 94 THR H H 119 7.726 7.726 7.483 0.243 17865
5150 1 8 . 1 1 95 95 CYS N N 120 118.523 118.523 120.725 -2.202 17865
5151 1 8 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.425 0.308 17865
5152 1 8 . 1 1 95 95 CYS C C 120 175.165 175.165 175.158 0.007 17865
5153 1 8 . 1 1 95 95 CYS CA C 120 52.973 52.973 59.187 -6.214 17865
5154 1 8 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.704 12.027 17865
5155 1 8 . 1 1 95 95 CYS H H 120 7.756 7.756 7.911 -0.155 17865
5156 1 8 . 1 1 96 96 ASP N N 121 119.081 119.081 122.614 -3.533 17865
5157 1 8 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.488 0.190 17865
5158 1 8 . 1 1 96 96 ASP CA C 121 56.224 56.224 56.218 0.006 17865
5159 1 8 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.121 1.610 17865
5160 1 8 . 1 1 96 96 ASP H H 121 7.354 7.354 8.451 -1.097 17865
5161 1 8 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.540 -0.965 17865
5162 1 8 . 1 1 97 97 LYS C C 122 175.510 175.510 176.265 -0.755 17865
5163 1 8 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.052 0.787 17865
5164 1 8 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.570 -3.820 17865
5165 1 8 . 1 1 98 98 LYS N N 123 119.980 119.980 117.592 2.388 17865
5166 1 8 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.576 -0.282 17865
5167 1 8 . 1 1 98 98 LYS C C 123 176.968 176.968 177.709 -0.741 17865
5168 1 8 . 1 1 98 98 LYS CA C 123 55.904 55.904 56.968 -1.065 17865
5169 1 8 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.912 -0.680 17865
5170 1 8 . 1 1 98 98 LYS H H 123 7.799 7.799 8.337 -0.538 17865
5171 1 8 . 1 1 99 99 TYR N N 124 122.378 122.378 121.984 0.394 17865
5172 1 8 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.222 -0.327 17865
5173 1 8 . 1 1 99 99 TYR C C 124 177.126 177.126 177.710 -0.584 17865
5174 1 8 . 1 1 99 99 TYR CA C 124 60.211 60.211 61.515 -1.304 17865
5175 1 8 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.553 -0.282 17865
5176 1 8 . 1 1 99 99 TYR H H 124 8.536 8.536 8.484 0.052 17865
5177 1 8 . 1 1 100 100 GLU N N 125 118.610 118.610 117.922 0.688 17865
5178 1 8 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.059 0.209 17865
5179 1 8 . 1 1 100 100 GLU C C 125 177.387 177.387 178.526 -1.139 17865
5180 1 8 . 1 1 100 100 GLU CA C 125 55.759 55.759 58.140 -2.381 17865
5181 1 8 . 1 1 100 100 GLU CB C 125 27.321 27.321 28.430 -1.109 17865
5182 1 8 . 1 1 100 100 GLU H H 125 8.385 8.385 8.744 -0.359 17865
5183 1 8 . 1 1 101 101 SER N N 126 115.949 115.949 116.059 -0.110 17865
5184 1 8 . 1 1 101 101 SER HA H 126 3.959 3.959 4.179 -0.220 17865
5185 1 8 . 1 1 101 101 SER C C 126 176.047 176.047 175.852 0.195 17865
5186 1 8 . 1 1 101 101 SER CA C 126 62.439 62.439 61.382 1.057 17865
5187 1 8 . 1 1 101 101 SER CB C 126 63.299 63.299 62.624 0.675 17865
5188 1 8 . 1 1 101 101 SER H H 126 7.823 7.823 8.124 -0.301 17865
5189 1 8 . 1 1 102 102 ASP N N 127 120.920 120.920 121.070 -0.150 17865
5190 1 8 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.300 0.107 17865
5191 1 8 . 1 1 102 102 ASP C C 127 178.234 178.234 178.345 -0.111 17865
5192 1 8 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.456 -0.045 17865
5193 1 8 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.826 -1.110 17865
5194 1 8 . 1 1 102 102 ASP H H 127 8.683 8.683 7.813 0.870 17865
5195 1 8 . 1 1 103 103 LYS N N 128 121.753 121.753 118.541 3.212 17865
5196 1 8 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.022 -0.018 17865
5197 1 8 . 1 1 103 103 LYS C C 128 179.395 179.395 178.915 0.480 17865
5198 1 8 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.596 0.875 17865
5199 1 8 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.782 0.619 17865
5200 1 8 . 1 1 103 103 LYS H H 128 7.771 7.771 7.379 0.392 17865
5201 1 8 . 1 1 104 104 CYS N N 129 120.109 120.109 120.296 -0.187 17865
5202 1 8 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.209 -0.015 17865
5203 1 8 . 1 1 104 104 CYS C C 129 176.779 176.779 176.838 -0.059 17865
5204 1 8 . 1 1 104 104 CYS CA C 129 59.790 59.790 61.688 -1.898 17865
5205 1 8 . 1 1 104 104 CYS CB C 129 36.879 36.879 25.755 11.124 17865
5206 1 8 . 1 1 104 104 CYS H H 129 7.973 7.973 8.195 -0.222 17865
5207 1 8 . 1 1 105 105 LEU N N 130 121.804 121.804 121.738 0.066 17865
5208 1 8 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.955 0.135 17865
5209 1 8 . 1 1 105 105 LEU C C 130 179.373 179.373 178.372 1.001 17865
5210 1 8 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.786 -1.418 17865
5211 1 8 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.904 0.194 17865
5212 1 8 . 1 1 105 105 LEU H H 130 8.666 8.666 8.264 0.402 17865
5213 1 8 . 1 1 106 106 ASN N N 131 118.535 118.535 116.278 2.257 17865
5214 1 8 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.457 -0.219 17865
5215 1 8 . 1 1 106 106 ASN C C 131 177.830 177.830 177.471 0.359 17865
5216 1 8 . 1 1 106 106 ASN CA C 131 56.256 56.256 55.932 0.324 17865
5217 1 8 . 1 1 106 106 ASN CB C 131 37.817 37.817 37.650 0.167 17865
5218 1 8 . 1 1 106 106 ASN H H 131 8.438 8.438 7.783 0.655 17865
5219 1 8 . 1 1 107 107 ALA N N 132 121.485 121.485 122.729 -1.244 17865
5220 1 8 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.231 -0.012 17865
5221 1 8 . 1 1 107 107 ALA C C 132 180.726 180.726 179.271 1.455 17865
5222 1 8 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.550 0.413 17865
5223 1 8 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.651 -0.830 17865
5224 1 8 . 1 1 107 107 ALA H H 132 7.541 7.541 7.580 -0.039 17865
5225 1 8 . 1 1 108 108 ILE N N 133 120.979 120.979 117.586 3.393 17865
5226 1 8 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.913 0.018 17865
5227 1 8 . 1 1 108 108 ILE C C 133 178.114 178.114 177.363 0.751 17865
5228 1 8 . 1 1 108 108 ILE CA C 133 63.353 63.353 62.310 1.043 17865
5229 1 8 . 1 1 108 108 ILE CB C 133 36.454 36.454 37.587 -1.133 17865
5230 1 8 . 1 1 108 108 ILE H H 133 7.551 7.551 7.973 -0.422 17865
5231 1 8 . 1 1 109 109 LYS N N 134 121.415 121.415 119.210 2.205 17865
5232 1 8 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.192 -0.604 17865
5233 1 8 . 1 1 109 109 LYS C C 134 179.561 179.561 178.633 0.928 17865
5234 1 8 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.089 1.019 17865
5235 1 8 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.021 0.140 17865
5236 1 8 . 1 1 109 109 LYS H H 134 8.414 8.414 7.559 0.855 17865
5237 1 8 . 1 1 110 110 GLU N N 135 116.099 116.099 119.218 -3.119 17865
5238 1 8 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.176 -0.247 17865
5239 1 8 . 1 1 110 110 GLU C C 135 178.239 178.239 178.011 0.228 17865
5240 1 8 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.654 -0.008 17865
5241 1 8 . 1 1 110 110 GLU CB C 135 29.638 29.638 28.626 1.012 17865
5242 1 8 . 1 1 110 110 GLU H H 135 7.473 7.473 8.036 -0.563 17865
5243 1 8 . 1 1 111 111 LYS N N 136 119.805 119.805 118.587 1.218 17865
5244 1 8 . 1 1 111 111 LYS HA H 136 3.906 3.906 3.849 0.057 17865
5245 1 8 . 1 1 111 111 LYS C C 136 177.600 177.600 177.440 0.160 17865
5246 1 8 . 1 1 111 111 LYS CA C 136 58.749 58.749 58.254 0.495 17865
5247 1 8 . 1 1 111 111 LYS CB C 136 33.238 33.238 31.803 1.435 17865
5248 1 8 . 1 1 111 111 LYS H H 136 7.540 7.540 7.461 0.079 17865
5249 1 8 . 1 1 112 112 TYR N N 137 114.768 114.768 115.615 -0.847 17865
5250 1 8 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.645 -0.122 17865
5251 1 8 . 1 1 112 112 TYR C C 137 174.690 174.690 174.841 -0.151 17865
5252 1 8 . 1 1 112 112 TYR CA C 137 58.359 58.359 56.086 2.273 17865
5253 1 8 . 1 1 112 112 TYR CB C 137 38.328 38.328 37.719 0.609 17865
5254 1 8 . 1 1 112 112 TYR H H 137 7.488 7.488 7.189 0.299 17865
5255 1 8 . 1 1 113 113 LYS N N 138 123.694 123.694 122.565 1.129 17865
5256 1 8 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.500 0.001 17865
5257 1 8 . 1 1 113 113 LYS CA C 138 55.282 55.282 54.469 0.813 17865
5258 1 8 . 1 1 113 113 LYS CB C 138 32.124 32.124 32.005 0.119 17865
5259 1 8 . 1 1 113 113 LYS H H 138 7.217 7.217 7.244 -0.027 17865
5260 1 8 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.511 -0.059 17865
5261 1 8 . 1 1 114 114 PRO C C 139 176.974 176.974 175.820 1.154 17865
5262 1 8 . 1 1 114 114 PRO CA C 139 63.189 63.189 63.416 -0.227 17865
5263 1 8 . 1 1 114 114 PRO CB C 139 32.251 32.251 30.290 1.961 17865
5264 1 8 . 1 1 115 115 VAL N N 140 121.098 121.098 118.744 2.354 17865
5265 1 8 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.253 -0.151 17865
5266 1 8 . 1 1 115 115 VAL C C 140 176.207 176.207 175.358 0.849 17865
5267 1 8 . 1 1 115 115 VAL CA C 140 62.356 62.356 61.620 0.736 17865
5268 1 8 . 1 1 115 115 VAL CB C 140 33.256 33.256 32.830 0.427 17865
5269 1 8 . 1 1 115 115 VAL H H 140 8.272 8.272 8.062 0.210 17865
5270 1 8 . 1 1 116 116 VAL N N 141 124.167 124.167 122.530 1.637 17865
5271 1 8 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.046 0.076 17865
5272 1 8 . 1 1 116 116 VAL C C 141 175.415 175.415 175.981 -0.566 17865
5273 1 8 . 1 1 116 116 VAL CA C 141 61.731 61.731 62.948 -1.217 17865
5274 1 8 . 1 1 116 116 VAL CB C 141 33.145 33.145 31.414 1.731 17865
5275 1 8 . 1 1 116 116 VAL H H 141 8.142 8.142 7.476 0.666 17865
5276 1 8 . 1 1 117 117 ASP N N 142 126.737 126.737 129.903 -3.166 17865
5277 1 8 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.756 0.056 17865
5278 1 8 . 1 1 117 117 ASP CA C 142 52.217 52.217 52.357 -0.140 17865
5279 1 8 . 1 1 117 117 ASP CB C 142 41.368 41.368 41.846 -0.478 17865
5280 1 8 . 1 1 117 117 ASP H H 142 8.419 8.419 8.468 -0.049 17865
5281 1 8 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.371 0.040 17865
5282 1 8 . 1 1 118 118 PRO C C 143 176.662 176.662 175.661 1.001 17865
5283 1 8 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.413 -0.166 17865
5284 1 8 . 1 1 118 118 PRO CB C 143 32.310 32.310 31.906 0.404 17865
5285 1 8 . 1 1 119 119 ASN N N 144 119.287 119.287 123.681 -4.394 17865
5286 1 8 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.887 0.060 17865
5287 1 8 . 1 1 119 119 ASN CA C 144 51.633 51.633 49.884 1.749 17865
5288 1 8 . 1 1 119 119 ASN CB C 144 38.859 38.859 38.446 0.413 17865
5289 1 8 . 1 1 119 119 ASN H H 144 8.432 8.432 8.204 0.228 17865
5290 1 8 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.624 0.056 17865
5291 1 8 . 1 1 120 120 PRO CA C 145 61.640 61.640 62.335 -0.695 17865
5292 1 8 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.244 -0.326 17865
5293 1 8 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.272 0.105 17865
5294 1 8 . 1 1 121 121 PRO C C 146 175.876 175.876 176.637 -0.761 17865
5295 1 8 . 1 1 121 121 PRO CA C 146 63.174 63.174 63.715 -0.541 17865
5296 1 8 . 1 1 121 121 PRO CB C 146 31.939 31.939 31.774 0.165 17865
5297 1 9 . 1 1 2 2 ASP N N 27 121.041 121.041 126.299 -5.258 17865
5298 1 9 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.797 -0.159 17865
5299 1 9 . 1 1 2 2 ASP C C 27 175.878 175.878 175.429 0.449 17865
5300 1 9 . 1 1 2 2 ASP CA C 27 54.382 54.382 53.869 0.513 17865
5301 1 9 . 1 1 2 2 ASP CB C 27 41.729 41.729 40.716 1.013 17865
5302 1 9 . 1 1 2 2 ASP H H 27 8.639 8.639 8.625 0.014 17865
5303 1 9 . 1 1 3 3 VAL N N 28 119.901 119.901 118.077 1.824 17865
5304 1 9 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.330 -0.297 17865
5305 1 9 . 1 1 3 3 VAL C C 28 175.521 175.521 174.866 0.655 17865
5306 1 9 . 1 1 3 3 VAL CA C 28 62.216 62.216 62.002 0.214 17865
5307 1 9 . 1 1 3 3 VAL CB C 28 33.003 33.003 30.240 2.763 17865
5308 1 9 . 1 1 3 3 VAL H H 28 8.113 8.113 7.462 0.651 17865
5309 1 9 . 1 1 4 4 PHE N N 29 123.707 123.707 126.475 -2.768 17865
5310 1 9 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.719 -0.063 17865
5311 1 9 . 1 1 4 4 PHE C C 29 174.874 174.874 175.466 -0.592 17865
5312 1 9 . 1 1 4 4 PHE CA C 29 57.159 57.159 56.825 0.334 17865
5313 1 9 . 1 1 4 4 PHE CB C 29 39.795 39.795 40.683 -0.888 17865
5314 1 9 . 1 1 4 4 PHE H H 29 8.255 8.255 8.087 0.168 17865
5315 1 9 . 1 1 5 5 ASP N N 30 124.203 124.203 122.013 2.190 17865
5316 1 9 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.768 0.070 17865
5317 1 9 . 1 1 5 5 ASP CA C 30 52.385 52.385 52.877 -0.492 17865
5318 1 9 . 1 1 5 5 ASP CB C 30 40.801 40.801 41.582 -0.781 17865
5319 1 9 . 1 1 5 5 ASP H H 30 8.226 8.226 8.504 -0.278 17865
5320 1 9 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.552 -0.015 17865
5321 1 9 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.264 -0.600 17865
5322 1 9 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.541 -0.715 17865
5323 1 9 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.492 -0.066 17865
5324 1 9 . 1 1 7 7 PRO C C 32 177.226 177.226 176.139 1.087 17865
5325 1 9 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.180 -0.011 17865
5326 1 9 . 1 1 7 7 PRO CB C 32 31.948 31.948 30.188 1.760 17865
5327 1 9 . 1 1 8 8 THR N N 33 114.158 114.158 115.099 -0.941 17865
5328 1 9 . 1 1 8 8 THR HA H 33 4.195 4.195 4.348 -0.153 17865
5329 1 9 . 1 1 8 8 THR C C 33 174.468 174.468 175.083 -0.615 17865
5330 1 9 . 1 1 8 8 THR CA C 33 62.110 62.110 63.324 -1.214 17865
5331 1 9 . 1 1 8 8 THR CB C 33 69.975 69.975 69.200 0.775 17865
5332 1 9 . 1 1 8 8 THR H H 33 8.096 8.096 8.417 -0.321 17865
5333 1 9 . 1 1 9 9 GLN N N 34 122.411 122.411 119.843 2.568 17865
5334 1 9 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.011 0.252 17865
5335 1 9 . 1 1 9 9 GLN C C 34 175.445 175.445 176.936 -1.491 17865
5336 1 9 . 1 1 9 9 GLN CA C 34 55.763 55.763 55.850 -0.087 17865
5337 1 9 . 1 1 9 9 GLN CB C 34 29.691 29.691 28.483 1.208 17865
5338 1 9 . 1 1 9 9 GLN H H 34 8.278 8.278 7.736 0.542 17865
5339 1 9 . 1 1 10 10 TYR N N 35 121.048 121.048 116.771 4.277 17865
5340 1 9 . 1 1 10 10 TYR HA H 35 4.520 4.520 3.895 0.625 17865
5341 1 9 . 1 1 10 10 TYR C C 35 176.314 176.314 176.417 -0.103 17865
5342 1 9 . 1 1 10 10 TYR CA C 35 57.972 57.972 60.528 -2.556 17865
5343 1 9 . 1 1 10 10 TYR CB C 35 38.936 38.936 36.853 2.083 17865
5344 1 9 . 1 1 10 10 TYR H H 35 8.227 8.227 8.488 -0.261 17865
5345 1 9 . 1 1 11 11 GLY N N 36 109.711 109.711 107.177 2.534 17865
5346 1 9 . 1 1 11 11 GLY C C 36 174.128 174.128 173.452 0.676 17865
5347 1 9 . 1 1 11 11 GLY CA C 36 45.212 45.212 45.322 -0.110 17865
5348 1 9 . 1 1 11 11 GLY H H 36 8.247 8.247 8.332 -0.085 17865
5349 1 9 . 1 1 12 12 TYR N N 37 120.302 120.302 120.557 -0.255 17865
5350 1 9 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.916 -0.434 17865
5351 1 9 . 1 1 12 12 TYR C C 37 175.864 175.864 174.948 0.916 17865
5352 1 9 . 1 1 12 12 TYR CA C 37 58.541 58.541 55.234 3.307 17865
5353 1 9 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.679 -0.964 17865
5354 1 9 . 1 1 12 12 TYR H H 37 8.101 8.101 7.183 0.918 17865
5355 1 9 . 1 1 13 13 ASP N N 38 121.883 121.883 121.010 0.873 17865
5356 1 9 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.157 0.329 17865
5357 1 9 . 1 1 13 13 ASP C C 38 176.538 176.538 175.229 1.309 17865
5358 1 9 . 1 1 13 13 ASP CA C 38 54.223 54.223 54.790 -0.567 17865
5359 1 9 . 1 1 13 13 ASP CB C 38 40.988 40.988 40.903 0.085 17865
5360 1 9 . 1 1 13 13 ASP H H 38 8.266 8.266 8.157 0.109 17865
5361 1 9 . 1 1 14 14 GLY N N 39 107.705 107.705 111.017 -3.312 17865
5362 1 9 . 1 1 14 14 GLY C C 39 173.822 173.822 173.100 0.722 17865
5363 1 9 . 1 1 14 14 GLY CA C 39 45.404 45.404 44.624 0.780 17865
5364 1 9 . 1 1 14 14 GLY H H 39 7.647 7.647 7.393 0.254 17865
5365 1 9 . 1 1 15 15 LYS N N 40 121.621 121.621 121.535 0.086 17865
5366 1 9 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.830 -0.255 17865
5367 1 9 . 1 1 15 15 LYS CA C 40 54.100 54.100 52.491 1.609 17865
5368 1 9 . 1 1 15 15 LYS CB C 40 32.510 32.510 33.504 -0.994 17865
5369 1 9 . 1 1 15 15 LYS H H 40 7.908 7.908 7.302 0.606 17865
5370 1 9 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.734 -0.382 17865
5371 1 9 . 1 1 16 16 PRO C C 41 176.806 176.806 176.962 -0.156 17865
5372 1 9 . 1 1 16 16 PRO CA C 41 62.758 62.758 64.231 -1.473 17865
5373 1 9 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.557 -0.243 17865
5374 1 9 . 1 1 17 17 LEU N N 42 123.488 123.488 119.439 4.049 17865
5375 1 9 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.570 -0.521 17865
5376 1 9 . 1 1 17 17 LEU C C 42 174.973 174.973 174.514 0.459 17865
5377 1 9 . 1 1 17 17 LEU CA C 42 55.436 55.436 54.577 0.859 17865
5378 1 9 . 1 1 17 17 LEU CB C 42 42.093 42.093 43.341 -1.248 17865
5379 1 9 . 1 1 17 17 LEU H H 42 8.499 8.499 7.625 0.874 17865
5380 1 9 . 1 1 18 18 ASP N N 43 123.354 123.354 123.724 -0.370 17865
5381 1 9 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.745 -0.247 17865
5382 1 9 . 1 1 18 18 ASP C C 43 175.947 175.947 176.904 -0.957 17865
5383 1 9 . 1 1 18 18 ASP CA C 43 52.858 52.858 52.689 0.169 17865
5384 1 9 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.140 -1.919 17865
5385 1 9 . 1 1 18 18 ASP H H 43 7.789 7.789 8.082 -0.293 17865
5386 1 9 . 1 1 19 19 ALA N N 44 120.147 120.147 122.997 -2.850 17865
5387 1 9 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.128 -0.142 17865
5388 1 9 . 1 1 19 19 ALA C C 44 179.476 179.476 178.757 0.719 17865
5389 1 9 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.313 0.849 17865
5390 1 9 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.869 -0.482 17865
5391 1 9 . 1 1 19 19 ALA H H 44 8.561 8.561 8.629 -0.068 17865
5392 1 9 . 1 1 20 20 SER N N 45 115.037 115.037 114.518 0.519 17865
5393 1 9 . 1 1 20 20 SER HA H 45 4.151 4.151 4.168 -0.017 17865
5394 1 9 . 1 1 20 20 SER C C 45 177.191 177.191 176.256 0.935 17865
5395 1 9 . 1 1 20 20 SER CA C 45 61.629 61.629 61.419 0.210 17865
5396 1 9 . 1 1 20 20 SER CB C 45 62.804 62.804 62.883 -0.079 17865
5397 1 9 . 1 1 20 20 SER H H 45 8.466 8.466 8.196 0.270 17865
5398 1 9 . 1 1 21 21 PHE N N 46 125.030 125.030 121.474 3.556 17865
5399 1 9 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.374 -0.143 17865
5400 1 9 . 1 1 21 21 PHE C C 46 176.850 176.850 177.117 -0.267 17865
5401 1 9 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.788 0.017 17865
5402 1 9 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.473 0.408 17865
5403 1 9 . 1 1 21 21 PHE H H 46 8.034 8.034 7.888 0.146 17865
5404 1 9 . 1 1 22 22 CYS N N 47 113.943 113.943 118.157 -4.214 17865
5405 1 9 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.203 0.048 17865
5406 1 9 . 1 1 22 22 CYS C C 47 176.449 176.449 175.997 0.452 17865
5407 1 9 . 1 1 22 22 CYS CA C 47 53.600 53.600 59.399 -5.799 17865
5408 1 9 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.786 10.605 17865
5409 1 9 . 1 1 22 22 CYS H H 47 7.691 7.691 7.780 -0.089 17865
5410 1 9 . 1 1 23 23 ARG N N 48 119.958 119.958 120.868 -0.910 17865
5411 1 9 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.073 0.007 17865
5412 1 9 . 1 1 23 23 ARG C C 48 177.904 177.904 177.440 0.464 17865
5413 1 9 . 1 1 23 23 ARG CA C 48 58.907 58.907 58.404 0.503 17865
5414 1 9 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.590 0.581 17865
5415 1 9 . 1 1 23 23 ARG H H 48 7.628 7.628 7.616 0.012 17865
5416 1 9 . 1 1 24 24 THR N N 49 106.445 106.445 108.707 -2.262 17865
5417 1 9 . 1 1 24 24 THR HA H 49 4.385 4.385 4.345 0.040 17865
5418 1 9 . 1 1 24 24 THR C C 49 174.758 174.758 174.801 -0.043 17865
5419 1 9 . 1 1 24 24 THR CA C 49 61.573 61.573 62.442 -0.869 17865
5420 1 9 . 1 1 24 24 THR CB C 49 68.794 68.794 68.739 0.055 17865
5421 1 9 . 1 1 24 24 THR H H 49 7.307 7.307 7.370 -0.063 17865
5422 1 9 . 1 1 25 25 ALA N N 50 122.242 122.242 122.493 -0.251 17865
5423 1 9 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.341 0.063 17865
5424 1 9 . 1 1 25 25 ALA C C 50 178.554 178.554 178.474 0.080 17865
5425 1 9 . 1 1 25 25 ALA CA C 50 52.381 52.381 53.330 -0.949 17865
5426 1 9 . 1 1 25 25 ALA CB C 50 18.395 18.395 20.173 -1.778 17865
5427 1 9 . 1 1 25 25 ALA H H 50 7.401 7.401 7.431 -0.030 17865
5428 1 9 . 1 1 26 26 GLY N N 51 110.604 110.604 106.848 3.756 17865
5429 1 9 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.550 0.472 17865
5430 1 9 . 1 1 26 26 GLY H H 51 8.285 8.285 7.868 0.417 17865
5431 1 9 . 1 1 27 27 SER HA H 52 4.382 4.382 4.199 0.183 17865
5432 1 9 . 1 1 27 27 SER C C 52 175.774 175.774 175.428 0.346 17865
5433 1 9 . 1 1 27 27 SER CA C 52 60.803 60.803 60.834 -0.031 17865
5434 1 9 . 1 1 27 27 SER CB C 52 62.827 62.827 63.137 -0.310 17865
5435 1 9 . 1 1 28 28 ARG N N 53 119.682 119.682 120.286 -0.604 17865
5436 1 9 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.710 0.170 17865
5437 1 9 . 1 1 28 28 ARG C C 53 175.796 175.796 176.138 -0.342 17865
5438 1 9 . 1 1 28 28 ARG CA C 53 55.738 55.738 55.042 0.696 17865
5439 1 9 . 1 1 28 28 ARG CB C 53 30.237 30.237 30.005 0.232 17865
5440 1 9 . 1 1 28 28 ARG H H 53 7.894 7.894 8.164 -0.270 17865
5441 1 9 . 1 1 29 29 GLU N N 54 122.318 122.318 121.997 0.321 17865
5442 1 9 . 1 1 29 29 GLU HA H 54 3.595 3.595 4.066 -0.471 17865
5443 1 9 . 1 1 29 29 GLU C C 54 177.523 177.523 177.848 -0.325 17865
5444 1 9 . 1 1 29 29 GLU CA C 54 61.223 61.223 59.812 1.411 17865
5445 1 9 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.600 -0.663 17865
5446 1 9 . 1 1 29 29 GLU H H 54 7.730 7.730 7.708 0.022 17865
5447 1 9 . 1 1 30 30 LYS N N 55 118.377 118.377 117.570 0.807 17865
5448 1 9 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.069 -0.241 17865
5449 1 9 . 1 1 30 30 LYS C C 55 179.205 179.205 178.758 0.447 17865
5450 1 9 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.314 1.113 17865
5451 1 9 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.094 -0.493 17865
5452 1 9 . 1 1 30 30 LYS H H 55 8.659 8.659 8.471 0.188 17865
5453 1 9 . 1 1 31 31 ASP N N 56 121.614 121.614 119.287 2.327 17865
5454 1 9 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.580 -0.269 17865
5455 1 9 . 1 1 31 31 ASP C C 56 177.393 177.393 177.725 -0.332 17865
5456 1 9 . 1 1 31 31 ASP CA C 56 57.316 57.316 56.806 0.510 17865
5457 1 9 . 1 1 31 31 ASP CB C 56 40.423 40.423 41.059 -0.636 17865
5458 1 9 . 1 1 31 31 ASP H H 56 7.646 7.646 8.084 -0.438 17865
5459 1 9 . 1 1 32 32 CYS N N 57 120.345 120.345 119.501 0.844 17865
5460 1 9 . 1 1 32 32 CYS HA H 57 3.601 3.601 4.262 -0.661 17865
5461 1 9 . 1 1 32 32 CYS C C 57 175.772 175.772 176.555 -0.783 17865
5462 1 9 . 1 1 32 32 CYS CA C 57 60.197 60.197 59.982 0.215 17865
5463 1 9 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.939 8.027 17865
5464 1 9 . 1 1 32 32 CYS H H 57 8.042 8.042 7.912 0.130 17865
5465 1 9 . 1 1 33 33 ARG N N 58 120.293 120.293 119.988 0.305 17865
5466 1 9 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.921 -0.245 17865
5467 1 9 . 1 1 33 33 ARG C C 58 179.633 179.633 178.608 1.025 17865
5468 1 9 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.359 1.027 17865
5469 1 9 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.329 0.512 17865
5470 1 9 . 1 1 33 33 ARG H H 58 8.531 8.531 8.486 0.045 17865
5471 1 9 . 1 1 34 34 LYS N N 59 121.166 121.166 119.034 2.132 17865
5472 1 9 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.075 -0.039 17865
5473 1 9 . 1 1 34 34 LYS C C 59 179.220 179.220 178.472 0.748 17865
5474 1 9 . 1 1 34 34 LYS CA C 59 59.530 59.530 59.440 0.090 17865
5475 1 9 . 1 1 34 34 LYS CB C 59 32.110 32.110 32.126 -0.016 17865
5476 1 9 . 1 1 34 34 LYS H H 59 7.633 7.633 7.668 -0.035 17865
5477 1 9 . 1 1 35 35 ASP N N 60 122.166 122.166 120.123 2.043 17865
5478 1 9 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.521 -0.090 17865
5479 1 9 . 1 1 35 35 ASP C C 60 179.709 179.709 178.519 1.190 17865
5480 1 9 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.032 0.670 17865
5481 1 9 . 1 1 35 35 ASP CB C 60 40.672 40.672 41.151 -0.479 17865
5482 1 9 . 1 1 35 35 ASP H H 60 8.221 8.221 7.770 0.451 17865
5483 1 9 . 1 1 36 36 VAL N N 61 121.312 121.312 118.904 2.408 17865
5484 1 9 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.784 -0.383 17865
5485 1 9 . 1 1 36 36 VAL C C 61 178.339 178.339 176.511 1.828 17865
5486 1 9 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.242 1.891 17865
5487 1 9 . 1 1 36 36 VAL CB C 61 31.657 31.657 32.015 -0.358 17865
5488 1 9 . 1 1 36 36 VAL H H 61 8.916 8.916 8.054 0.862 17865
5489 1 9 . 1 1 37 37 GLN N N 62 119.166 119.166 117.508 1.658 17865
5490 1 9 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.171 -0.229 17865
5491 1 9 . 1 1 37 37 GLN C C 62 177.293 177.293 177.447 -0.154 17865
5492 1 9 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.774 0.506 17865
5493 1 9 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.469 -0.098 17865
5494 1 9 . 1 1 37 37 GLN H H 62 7.697 7.697 7.548 0.149 17865
5495 1 9 . 1 1 38 38 ALA N N 63 118.964 118.964 120.794 -1.830 17865
5496 1 9 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.312 -0.070 17865
5497 1 9 . 1 1 38 38 ALA C C 63 177.221 177.221 177.644 -0.423 17865
5498 1 9 . 1 1 38 38 ALA CA C 63 53.137 53.137 53.007 0.130 17865
5499 1 9 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.266 -0.369 17865
5500 1 9 . 1 1 38 38 ALA H H 63 7.508 7.508 7.994 -0.486 17865
5501 1 9 . 1 1 39 39 CYS N N 64 119.081 119.081 118.206 0.875 17865
5502 1 9 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.450 0.503 17865
5503 1 9 . 1 1 39 39 CYS C C 64 172.052 172.052 175.131 -3.079 17865
5504 1 9 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.704 -6.824 17865
5505 1 9 . 1 1 39 39 CYS CB C 64 34.328 34.328 25.242 9.086 17865
5506 1 9 . 1 1 39 39 CYS H H 64 7.354 7.354 7.729 -0.375 17865
5507 1 9 . 1 1 40 40 ASP N N 65 124.167 124.167 126.274 -2.107 17865
5508 1 9 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.460 -0.135 17865
5509 1 9 . 1 1 40 40 ASP C C 65 176.496 176.496 175.875 0.621 17865
5510 1 9 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.647 0.077 17865
5511 1 9 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.797 -0.484 17865
5512 1 9 . 1 1 40 40 ASP H H 65 8.142 8.142 8.483 -0.341 17865
5513 1 9 . 1 1 41 41 LYS N N 66 118.844 118.844 118.416 0.428 17865
5514 1 9 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.791 -0.267 17865
5515 1 9 . 1 1 41 41 LYS C C 66 175.586 175.586 176.309 -0.723 17865
5516 1 9 . 1 1 41 41 LYS CA C 66 55.275 55.275 55.323 -0.048 17865
5517 1 9 . 1 1 41 41 LYS CB C 66 32.598 32.598 33.097 -0.499 17865
5518 1 9 . 1 1 41 41 LYS H H 66 7.858 7.858 8.230 -0.372 17865
5519 1 9 . 1 1 42 42 LYS N N 67 126.081 126.081 122.439 3.642 17865
5520 1 9 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.271 -0.356 17865
5521 1 9 . 1 1 42 42 LYS C C 67 174.665 174.665 175.650 -0.985 17865
5522 1 9 . 1 1 42 42 LYS CA C 67 57.827 57.827 56.422 1.405 17865
5523 1 9 . 1 1 42 42 LYS CB C 67 34.059 34.059 32.867 1.192 17865
5524 1 9 . 1 1 42 42 LYS H H 67 8.790 8.790 8.932 -0.142 17865
5525 1 9 . 1 1 43 43 TYR N N 68 114.138 114.138 116.107 -1.969 17865
5526 1 9 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.815 0.444 17865
5527 1 9 . 1 1 43 43 TYR C C 68 175.767 175.767 175.425 0.342 17865
5528 1 9 . 1 1 43 43 TYR CA C 68 55.880 55.880 56.851 -0.971 17865
5529 1 9 . 1 1 43 43 TYR CB C 68 42.363 42.363 41.383 0.980 17865
5530 1 9 . 1 1 43 43 TYR H H 68 7.294 7.294 7.479 -0.185 17865
5531 1 9 . 1 1 44 44 ASP N N 69 121.807 121.807 122.134 -0.327 17865
5532 1 9 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.818 -0.178 17865
5533 1 9 . 1 1 44 44 ASP C C 69 177.812 177.812 177.392 0.420 17865
5534 1 9 . 1 1 44 44 ASP CA C 69 52.110 52.110 53.333 -1.223 17865
5535 1 9 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.833 -2.393 17865
5536 1 9 . 1 1 44 44 ASP H H 69 8.995 8.995 9.128 -0.133 17865
5537 1 9 . 1 1 45 45 ASP N N 70 116.686 116.686 120.411 -3.725 17865
5538 1 9 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.489 -0.065 17865
5539 1 9 . 1 1 45 45 ASP C C 70 177.054 177.054 176.763 0.291 17865
5540 1 9 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.654 -0.273 17865
5541 1 9 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.785 -0.537 17865
5542 1 9 . 1 1 45 45 ASP H H 70 8.369 8.369 8.894 -0.525 17865
5543 1 9 . 1 1 46 46 GLN N N 71 117.949 117.949 117.081 0.868 17865
5544 1 9 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.479 -0.023 17865
5545 1 9 . 1 1 46 46 GLN C C 71 176.273 176.273 176.930 -0.657 17865
5546 1 9 . 1 1 46 46 GLN CA C 71 55.367 55.367 54.971 0.396 17865
5547 1 9 . 1 1 46 46 GLN CB C 71 29.330 29.330 28.731 0.599 17865
5548 1 9 . 1 1 46 46 GLN H H 71 8.274 8.274 7.995 0.279 17865
5549 1 9 . 1 1 47 47 GLY N N 72 108.369 108.369 107.105 1.264 17865
5550 1 9 . 1 1 47 47 GLY C C 72 174.145 174.145 174.163 -0.018 17865
5551 1 9 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.415 0.408 17865
5552 1 9 . 1 1 47 47 GLY H H 72 8.174 8.174 8.075 0.099 17865
5553 1 9 . 1 1 48 48 ARG N N 73 121.554 121.554 118.218 3.336 17865
5554 1 9 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.759 -0.274 17865
5555 1 9 . 1 1 48 48 ARG C C 73 176.855 176.855 175.573 1.282 17865
5556 1 9 . 1 1 48 48 ARG CA C 73 55.289 55.289 52.967 2.322 17865
5557 1 9 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.582 -1.024 17865
5558 1 9 . 1 1 48 48 ARG H H 73 8.462 8.462 8.103 0.359 17865
5559 1 9 . 1 1 49 49 GLU N N 74 122.784 122.784 121.271 1.513 17865
5560 1 9 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.249 0.234 17865
5561 1 9 . 1 1 49 49 GLU C C 74 178.098 178.098 177.311 0.787 17865
5562 1 9 . 1 1 49 49 GLU CA C 74 57.184 57.184 56.371 0.813 17865
5563 1 9 . 1 1 49 49 GLU CB C 74 30.777 30.777 29.867 0.910 17865
5564 1 9 . 1 1 49 49 GLU H H 74 8.703 8.703 8.578 0.125 17865
5565 1 9 . 1 1 50 50 THR N N 75 114.563 114.563 114.037 0.526 17865
5566 1 9 . 1 1 50 50 THR HA H 75 4.212 4.212 4.357 -0.145 17865
5567 1 9 . 1 1 50 50 THR C C 75 175.170 175.170 175.714 -0.544 17865
5568 1 9 . 1 1 50 50 THR CA C 75 60.589 60.589 60.321 0.268 17865
5569 1 9 . 1 1 50 50 THR CB C 75 70.952 70.952 70.983 -0.031 17865
5570 1 9 . 1 1 50 50 THR H H 75 7.717 7.717 8.041 -0.324 17865
5571 1 9 . 1 1 51 51 ALA N N 76 122.097 122.097 122.522 -0.425 17865
5572 1 9 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.003 0.035 17865
5573 1 9 . 1 1 51 51 ALA C C 76 181.906 181.906 179.289 2.617 17865
5574 1 9 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.211 0.443 17865
5575 1 9 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.291 -0.298 17865
5576 1 9 . 1 1 51 51 ALA H H 76 8.734 8.734 8.798 -0.064 17865
5577 1 9 . 1 1 52 52 CYS N N 77 115.347 115.347 115.888 -0.541 17865
5578 1 9 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.188 0.292 17865
5579 1 9 . 1 1 52 52 CYS C C 77 176.299 176.299 176.999 -0.700 17865
5580 1 9 . 1 1 52 52 CYS CA C 77 57.701 57.701 59.507 -1.806 17865
5581 1 9 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.548 10.083 17865
5582 1 9 . 1 1 52 52 CYS H H 77 9.073 9.073 8.076 0.997 17865
5583 1 9 . 1 1 53 53 ALA N N 78 128.517 128.517 124.035 4.482 17865
5584 1 9 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.916 -0.061 17865
5585 1 9 . 1 1 53 53 ALA C C 78 178.736 178.736 179.090 -0.354 17865
5586 1 9 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.099 0.534 17865
5587 1 9 . 1 1 53 53 ALA CB C 78 19.191 19.191 18.006 1.185 17865
5588 1 9 . 1 1 53 53 ALA H H 78 7.174 7.174 8.108 -0.934 17865
5589 1 9 . 1 1 54 54 LYS N N 79 118.706 118.706 119.160 -0.454 17865
5590 1 9 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.157 -0.354 17865
5591 1 9 . 1 1 54 54 LYS C C 79 179.611 179.611 178.665 0.946 17865
5592 1 9 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.000 1.725 17865
5593 1 9 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.070 0.583 17865
5594 1 9 . 1 1 54 54 LYS H H 79 8.313 8.313 7.777 0.536 17865
5595 1 9 . 1 1 55 55 GLY N N 80 104.822 104.822 108.427 -3.605 17865
5596 1 9 . 1 1 55 55 GLY C C 80 176.504 176.504 176.124 0.380 17865
5597 1 9 . 1 1 55 55 GLY CA C 80 46.839 46.839 47.112 -0.273 17865
5598 1 9 . 1 1 55 55 GLY H H 80 8.175 8.175 7.733 0.442 17865
5599 1 9 . 1 1 56 56 ILE N N 81 123.697 123.697 122.548 1.149 17865
5600 1 9 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.742 0.053 17865
5601 1 9 . 1 1 56 56 ILE C C 81 177.334 177.334 177.894 -0.560 17865
5602 1 9 . 1 1 56 56 ILE CA C 81 65.281 65.281 65.272 0.009 17865
5603 1 9 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.837 0.498 17865
5604 1 9 . 1 1 56 56 ILE H H 81 7.590 7.590 8.315 -0.725 17865
5605 1 9 . 1 1 57 57 ARG N N 82 118.161 118.161 119.323 -1.162 17865
5606 1 9 . 1 1 57 57 ARG HA H 82 3.935 3.935 3.910 0.025 17865
5607 1 9 . 1 1 57 57 ARG C C 82 178.662 178.662 178.004 0.658 17865
5608 1 9 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.674 0.028 17865
5609 1 9 . 1 1 57 57 ARG CB C 82 29.899 29.899 30.112 -0.213 17865
5610 1 9 . 1 1 57 57 ARG H H 82 7.569 7.569 7.477 0.092 17865
5611 1 9 . 1 1 58 58 GLU N N 83 115.085 115.085 116.366 -1.281 17865
5612 1 9 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.078 -0.047 17865
5613 1 9 . 1 1 58 58 GLU C C 83 178.224 178.224 179.275 -1.051 17865
5614 1 9 . 1 1 58 58 GLU CA C 83 58.304 58.304 57.576 0.728 17865
5615 1 9 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.293 0.738 17865
5616 1 9 . 1 1 58 58 GLU H H 83 7.786 7.786 7.695 0.091 17865
5617 1 9 . 1 1 59 59 LYS N N 84 119.183 119.183 120.922 -1.739 17865
5618 1 9 . 1 1 59 59 LYS HA H 84 3.830 3.830 3.833 -0.003 17865
5619 1 9 . 1 1 59 59 LYS C C 84 177.933 177.933 178.637 -0.704 17865
5620 1 9 . 1 1 59 59 LYS CA C 84 59.043 59.043 59.110 -0.067 17865
5621 1 9 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.416 1.234 17865
5622 1 9 . 1 1 59 59 LYS H H 84 7.968 7.968 8.196 -0.228 17865
5623 1 9 . 1 1 60 60 TYR N N 85 113.663 113.663 113.913 -0.250 17865
5624 1 9 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.730 -0.027 17865
5625 1 9 . 1 1 60 60 TYR C C 85 174.729 174.729 175.197 -0.468 17865
5626 1 9 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.936 0.266 17865
5627 1 9 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.271 0.631 17865
5628 1 9 . 1 1 60 60 TYR H H 85 7.562 7.562 7.785 -0.223 17865
5629 1 9 . 1 1 61 61 LYS N N 86 121.862 121.862 123.442 -1.580 17865
5630 1 9 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.529 -0.017 17865
5631 1 9 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.208 -0.266 17865
5632 1 9 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.919 -0.817 17865
5633 1 9 . 1 1 61 61 LYS H H 86 7.222 7.222 7.470 -0.248 17865
5634 1 9 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.519 -0.196 17865
5635 1 9 . 1 1 62 62 PRO C C 87 176.576 176.576 176.303 0.273 17865
5636 1 9 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.664 0.356 17865
5637 1 9 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.468 -0.227 17865
5638 1 9 . 1 1 63 63 ALA N N 88 125.029 125.029 124.485 0.544 17865
5639 1 9 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.434 -0.180 17865
5640 1 9 . 1 1 63 63 ALA C C 88 177.301 177.301 176.298 1.003 17865
5641 1 9 . 1 1 63 63 ALA CA C 88 52.281 52.281 51.886 0.395 17865
5642 1 9 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.715 1.487 17865
5643 1 9 . 1 1 63 63 ALA H H 88 8.329 8.329 8.377 -0.048 17865
5644 1 9 . 1 1 64 64 VAL N N 89 121.843 121.843 120.805 1.038 17865
5645 1 9 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.490 -0.546 17865
5646 1 9 . 1 1 64 64 VAL C C 89 174.791 174.791 174.798 -0.007 17865
5647 1 9 . 1 1 64 64 VAL CA C 89 61.981 61.981 59.742 2.239 17865
5648 1 9 . 1 1 64 64 VAL CB C 89 33.485 33.485 34.652 -1.167 17865
5649 1 9 . 1 1 64 64 VAL H H 89 8.075 8.075 7.616 0.459 17865
5650 1 9 . 1 1 65 65 VAL N N 90 125.399 125.399 117.808 7.591 17865
5651 1 9 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.169 -0.031 17865
5652 1 9 . 1 1 65 65 VAL C C 90 174.340 174.340 175.168 -0.828 17865
5653 1 9 . 1 1 65 65 VAL CA C 90 61.162 61.162 62.326 -1.164 17865
5654 1 9 . 1 1 65 65 VAL CB C 90 33.866 33.866 31.150 2.716 17865
5655 1 9 . 1 1 65 65 VAL H H 90 8.229 8.229 8.230 -0.001 17865
5656 1 9 . 1 1 66 66 TYR N N 91 124.848 124.848 127.345 -2.497 17865
5657 1 9 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.740 0.031 17865
5658 1 9 . 1 1 66 66 TYR C C 91 176.658 176.658 176.619 0.039 17865
5659 1 9 . 1 1 66 66 TYR CA C 91 58.084 58.084 57.705 0.379 17865
5660 1 9 . 1 1 66 66 TYR CB C 91 41.535 41.535 40.763 0.772 17865
5661 1 9 . 1 1 66 66 TYR H H 91 9.145 9.145 7.992 1.153 17865
5662 1 9 . 1 1 67 67 GLY N N 92 106.185 106.185 107.353 -1.168 17865
5663 1 9 . 1 1 67 67 GLY C C 92 175.681 175.681 174.755 0.926 17865
5664 1 9 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.130 0.845 17865
5665 1 9 . 1 1 67 67 GLY H H 92 8.730 8.730 8.860 -0.130 17865
5666 1 9 . 1 1 68 68 TYR N N 93 121.815 121.815 117.179 4.636 17865
5667 1 9 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.377 -0.402 17865
5668 1 9 . 1 1 68 68 TYR C C 93 176.035 176.035 176.191 -0.156 17865
5669 1 9 . 1 1 68 68 TYR CA C 93 61.046 61.046 58.743 2.303 17865
5670 1 9 . 1 1 68 68 TYR CB C 93 38.425 38.425 37.932 0.493 17865
5671 1 9 . 1 1 68 68 TYR H H 93 8.711 8.711 8.017 0.694 17865
5672 1 9 . 1 1 69 69 ASP N N 94 115.507 115.507 119.510 -4.003 17865
5673 1 9 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.709 -0.421 17865
5674 1 9 . 1 1 69 69 ASP C C 94 177.063 177.063 177.572 -0.509 17865
5675 1 9 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.768 -0.757 17865
5676 1 9 . 1 1 69 69 ASP CB C 94 40.167 40.167 41.151 -0.984 17865
5677 1 9 . 1 1 69 69 ASP H H 94 8.010 8.010 7.983 0.027 17865
5678 1 9 . 1 1 70 70 GLY N N 95 107.196 107.196 107.274 -0.078 17865
5679 1 9 . 1 1 70 70 GLY C C 95 173.936 173.936 172.826 1.110 17865
5680 1 9 . 1 1 70 70 GLY CA C 95 45.392 45.392 45.203 0.189 17865
5681 1 9 . 1 1 70 70 GLY H H 95 7.986 7.986 8.067 -0.081 17865
5682 1 9 . 1 1 71 71 LYS N N 96 121.258 121.258 120.243 1.015 17865
5683 1 9 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.772 0.012 17865
5684 1 9 . 1 1 71 71 LYS CA C 96 54.114 54.114 53.258 0.856 17865
5685 1 9 . 1 1 71 71 LYS CB C 96 31.762 31.762 33.006 -1.244 17865
5686 1 9 . 1 1 71 71 LYS H H 96 7.877 7.877 7.722 0.155 17865
5687 1 9 . 1 1 72 72 PRO C C 97 177.170 177.170 175.696 1.474 17865
5688 1 9 . 1 1 72 72 PRO CA C 97 63.137 63.137 63.645 -0.508 17865
5689 1 9 . 1 1 72 72 PRO CB C 97 32.240 32.240 31.036 1.204 17865
5690 1 9 . 1 1 73 73 LEU N N 98 123.503 123.503 127.922 -4.419 17865
5691 1 9 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.592 -0.232 17865
5692 1 9 . 1 1 73 73 LEU C C 98 176.354 176.354 174.702 1.652 17865
5693 1 9 . 1 1 73 73 LEU CA C 98 53.927 53.927 54.042 -0.115 17865
5694 1 9 . 1 1 73 73 LEU CB C 98 42.272 42.272 44.826 -2.554 17865
5695 1 9 . 1 1 73 73 LEU H H 98 8.850 8.850 7.858 0.992 17865
5696 1 9 . 1 1 74 74 ASP N N 99 122.212 122.212 124.490 -2.278 17865
5697 1 9 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.544 0.053 17865
5698 1 9 . 1 1 74 74 ASP C C 99 175.819 175.819 176.357 -0.538 17865
5699 1 9 . 1 1 74 74 ASP CA C 99 53.856 53.856 54.407 -0.551 17865
5700 1 9 . 1 1 74 74 ASP CB C 99 40.989 40.989 41.371 -0.382 17865
5701 1 9 . 1 1 74 74 ASP H H 99 8.517 8.517 8.406 0.111 17865
5702 1 9 . 1 1 75 75 LEU N N 100 125.874 125.874 117.587 8.287 17865
5703 1 9 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.029 0.337 17865
5704 1 9 . 1 1 75 75 LEU C C 100 178.426 178.426 177.626 0.800 17865
5705 1 9 . 1 1 75 75 LEU CA C 100 53.631 53.631 55.023 -1.392 17865
5706 1 9 . 1 1 75 75 LEU CB C 100 40.676 40.676 40.379 0.297 17865
5707 1 9 . 1 1 75 75 LEU H H 100 8.281 8.281 8.657 -0.376 17865
5708 1 9 . 1 1 76 76 GLY N N 101 110.604 110.604 108.538 2.066 17865
5709 1 9 . 1 1 76 76 GLY C C 101 176.936 176.936 174.709 2.227 17865
5710 1 9 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.427 0.400 17865
5711 1 9 . 1 1 76 76 GLY H H 101 8.914 8.914 7.962 0.952 17865
5712 1 9 . 1 1 77 77 PHE N N 102 117.639 117.639 118.887 -1.248 17865
5713 1 9 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.599 -0.218 17865
5714 1 9 . 1 1 77 77 PHE C C 102 177.878 177.878 177.395 0.483 17865
5715 1 9 . 1 1 77 77 PHE CA C 102 59.139 59.139 60.057 -0.918 17865
5716 1 9 . 1 1 77 77 PHE CB C 102 36.935 36.935 39.422 -2.487 17865
5717 1 9 . 1 1 77 77 PHE H H 102 7.992 7.992 8.100 -0.108 17865
5718 1 9 . 1 1 78 78 CYS N N 103 121.136 121.136 118.183 2.953 17865
5719 1 9 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.339 0.046 17865
5720 1 9 . 1 1 78 78 CYS C C 103 172.780 172.780 177.089 -4.309 17865
5721 1 9 . 1 1 78 78 CYS CA C 103 53.696 53.696 60.778 -7.082 17865
5722 1 9 . 1 1 78 78 CYS CB C 103 34.237 34.237 26.072 8.165 17865
5723 1 9 . 1 1 78 78 CYS H H 103 7.362 7.362 8.370 -1.008 17865
5724 1 9 . 1 1 79 79 THR N N 104 114.773 114.773 115.877 -1.104 17865
5725 1 9 . 1 1 79 79 THR HA H 104 3.984 3.984 4.130 -0.146 17865
5726 1 9 . 1 1 79 79 THR C C 104 176.624 176.624 175.226 1.398 17865
5727 1 9 . 1 1 79 79 THR CA C 104 65.180 65.180 64.884 0.296 17865
5728 1 9 . 1 1 79 79 THR CB C 104 69.062 69.062 68.194 0.868 17865
5729 1 9 . 1 1 79 79 THR H H 104 7.864 7.864 8.415 -0.551 17865
5730 1 9 . 1 1 80 80 LEU N N 105 119.785 119.785 120.013 -0.228 17865
5731 1 9 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.214 0.117 17865
5732 1 9 . 1 1 80 80 LEU C C 105 177.208 177.208 176.561 0.647 17865
5733 1 9 . 1 1 80 80 LEU CA C 105 55.453 55.453 55.199 0.254 17865
5734 1 9 . 1 1 80 80 LEU CB C 105 41.293 41.293 41.893 -0.600 17865
5735 1 9 . 1 1 80 80 LEU H H 105 7.238 7.238 7.149 0.089 17865
5736 1 9 . 1 1 81 81 ALA N N 106 119.309 119.309 121.114 -1.805 17865
5737 1 9 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.653 -0.126 17865
5738 1 9 . 1 1 81 81 ALA C C 106 178.769 178.769 176.606 2.163 17865
5739 1 9 . 1 1 81 81 ALA CA C 106 52.049 52.049 50.885 1.164 17865
5740 1 9 . 1 1 81 81 ALA CB C 106 18.820 18.820 21.345 -2.525 17865
5741 1 9 . 1 1 81 81 ALA H H 106 7.432 7.432 7.495 -0.063 17865
5742 1 9 . 1 1 82 82 GLY N N 107 109.793 109.793 107.371 2.422 17865
5743 1 9 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.531 1.588 17865
5744 1 9 . 1 1 82 82 GLY H H 107 7.918 7.918 8.295 -0.377 17865
5745 1 9 . 1 1 83 83 ILE HA H 108 4.266 4.266 4.102 0.164 17865
5746 1 9 . 1 1 83 83 ILE CA C 108 63.263 63.263 62.743 0.520 17865
5747 1 9 . 1 1 83 83 ILE CB C 108 38.261 38.261 38.094 0.167 17865
5748 1 9 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.194 0.561 17865
5749 1 9 . 1 1 84 84 ARG C C 109 181.344 181.344 177.368 3.976 17865
5750 1 9 . 1 1 84 84 ARG CA C 109 55.939 55.939 57.479 -1.540 17865
5751 1 9 . 1 1 84 84 ARG CB C 109 30.283 30.283 28.856 1.427 17865
5752 1 9 . 1 1 85 85 GLU N N 110 122.944 122.944 121.623 1.321 17865
5753 1 9 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.119 -0.502 17865
5754 1 9 . 1 1 85 85 GLU C C 110 177.797 177.797 177.626 0.171 17865
5755 1 9 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.508 1.220 17865
5756 1 9 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.735 -0.864 17865
5757 1 9 . 1 1 85 85 GLU H H 110 8.003 8.003 7.561 0.443 17865
5758 1 9 . 1 1 86 86 VAL N N 111 117.101 117.101 118.654 -1.553 17865
5759 1 9 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.625 -0.114 17865
5760 1 9 . 1 1 86 86 VAL C C 111 177.710 177.710 178.211 -0.501 17865
5761 1 9 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.016 0.414 17865
5762 1 9 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.625 -0.412 17865
5763 1 9 . 1 1 86 86 VAL H H 111 8.106 8.106 7.505 0.601 17865
5764 1 9 . 1 1 87 87 ASP N N 112 122.242 122.242 119.234 3.008 17865
5765 1 9 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.408 -0.104 17865
5766 1 9 . 1 1 87 87 ASP C C 112 176.912 176.912 177.842 -0.930 17865
5767 1 9 . 1 1 87 87 ASP CA C 112 57.417 57.417 57.957 -0.540 17865
5768 1 9 . 1 1 87 87 ASP CB C 112 40.476 40.476 40.600 -0.124 17865
5769 1 9 . 1 1 87 87 ASP H H 112 7.401 7.401 7.929 -0.528 17865
5770 1 9 . 1 1 88 88 CYS N N 113 120.819 120.819 119.512 1.307 17865
5771 1 9 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.125 -0.816 17865
5772 1 9 . 1 1 88 88 CYS C C 113 175.270 175.270 176.671 -1.401 17865
5773 1 9 . 1 1 88 88 CYS CA C 113 59.759 59.759 62.295 -2.536 17865
5774 1 9 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.739 7.096 17865
5775 1 9 . 1 1 88 88 CYS H H 113 7.785 7.785 8.286 -0.501 17865
5776 1 9 . 1 1 89 89 ARG N N 114 118.654 118.654 118.981 -0.327 17865
5777 1 9 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.170 -0.529 17865
5778 1 9 . 1 1 89 89 ARG C C 114 179.018 179.018 178.604 0.414 17865
5779 1 9 . 1 1 89 89 ARG CA C 114 60.193 60.193 58.679 1.514 17865
5780 1 9 . 1 1 89 89 ARG CB C 114 29.713 29.713 28.986 0.727 17865
5781 1 9 . 1 1 89 89 ARG H H 114 8.142 8.142 8.184 -0.042 17865
5782 1 9 . 1 1 90 90 LYS N N 115 120.964 120.964 119.659 1.305 17865
5783 1 9 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.085 -0.055 17865
5784 1 9 . 1 1 90 90 LYS C C 115 180.092 180.092 177.933 2.159 17865
5785 1 9 . 1 1 90 90 LYS CA C 115 59.568 59.568 59.214 0.354 17865
5786 1 9 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.078 0.143 17865
5787 1 9 . 1 1 90 90 LYS H H 115 7.936 7.936 7.437 0.499 17865
5788 1 9 . 1 1 91 91 ASP N N 116 121.690 121.690 118.593 3.097 17865
5789 1 9 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.590 -0.077 17865
5790 1 9 . 1 1 91 91 ASP C C 116 179.419 179.419 178.281 1.138 17865
5791 1 9 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.818 0.419 17865
5792 1 9 . 1 1 91 91 ASP CB C 116 40.648 40.648 41.519 -0.871 17865
5793 1 9 . 1 1 91 91 ASP H H 116 8.558 8.558 7.815 0.743 17865
5794 1 9 . 1 1 92 92 ALA N N 117 122.784 122.784 123.743 -0.959 17865
5795 1 9 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.037 -0.014 17865
5796 1 9 . 1 1 92 92 ALA C C 117 178.789 178.789 179.138 -0.349 17865
5797 1 9 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.224 -0.173 17865
5798 1 9 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.319 0.856 17865
5799 1 9 . 1 1 92 92 ALA H H 117 8.703 8.703 8.109 0.594 17865
5800 1 9 . 1 1 93 93 GLN N N 118 115.510 115.510 115.956 -0.446 17865
5801 1 9 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.090 -0.146 17865
5802 1 9 . 1 1 93 93 GLN C C 118 178.745 178.745 176.999 1.746 17865
5803 1 9 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.339 1.143 17865
5804 1 9 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.552 -0.155 17865
5805 1 9 . 1 1 93 93 GLN H H 118 7.664 7.664 8.537 -0.873 17865
5806 1 9 . 1 1 94 94 THR N N 119 110.110 110.110 114.532 -4.422 17865
5807 1 9 . 1 1 94 94 THR HA H 119 4.237 4.237 4.111 0.126 17865
5808 1 9 . 1 1 94 94 THR C C 119 175.861 175.861 176.136 -0.275 17865
5809 1 9 . 1 1 94 94 THR CA C 119 64.604 64.604 65.600 -0.996 17865
5810 1 9 . 1 1 94 94 THR CB C 119 69.716 69.716 68.599 1.117 17865
5811 1 9 . 1 1 94 94 THR H H 119 7.726 7.726 7.544 0.182 17865
5812 1 9 . 1 1 95 95 CYS N N 120 118.523 118.523 121.185 -2.662 17865
5813 1 9 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.268 0.465 17865
5814 1 9 . 1 1 95 95 CYS C C 120 175.165 175.165 174.819 0.346 17865
5815 1 9 . 1 1 95 95 CYS CA C 120 52.973 52.973 59.914 -6.941 17865
5816 1 9 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.273 12.458 17865
5817 1 9 . 1 1 95 95 CYS H H 120 7.756 7.756 7.908 -0.152 17865
5818 1 9 . 1 1 96 96 ASP N N 121 119.081 119.081 122.685 -3.604 17865
5819 1 9 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.364 0.314 17865
5820 1 9 . 1 1 96 96 ASP CA C 121 56.224 56.224 56.862 -0.638 17865
5821 1 9 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.644 1.087 17865
5822 1 9 . 1 1 96 96 ASP H H 121 7.354 7.354 8.580 -1.226 17865
5823 1 9 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.408 -0.833 17865
5824 1 9 . 1 1 97 97 LYS C C 122 175.510 175.510 177.778 -2.268 17865
5825 1 9 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.593 0.246 17865
5826 1 9 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.120 -3.370 17865
5827 1 9 . 1 1 98 98 LYS N N 123 119.980 119.980 119.720 0.260 17865
5828 1 9 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.489 -0.195 17865
5829 1 9 . 1 1 98 98 LYS C C 123 176.968 176.968 177.689 -0.721 17865
5830 1 9 . 1 1 98 98 LYS CA C 123 55.904 55.904 57.760 -1.856 17865
5831 1 9 . 1 1 98 98 LYS CB C 123 33.232 33.232 32.861 0.371 17865
5832 1 9 . 1 1 98 98 LYS H H 123 7.799 7.799 8.400 -0.601 17865
5833 1 9 . 1 1 99 99 TYR N N 124 122.378 122.378 121.300 1.078 17865
5834 1 9 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.176 -0.281 17865
5835 1 9 . 1 1 99 99 TYR C C 124 177.126 177.126 177.608 -0.482 17865
5836 1 9 . 1 1 99 99 TYR CA C 124 60.211 60.211 61.532 -1.321 17865
5837 1 9 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.498 -0.227 17865
5838 1 9 . 1 1 99 99 TYR H H 124 8.536 8.536 8.674 -0.138 17865
5839 1 9 . 1 1 100 100 GLU N N 125 118.610 118.610 117.032 1.578 17865
5840 1 9 . 1 1 100 100 GLU HA H 125 4.268 4.268 3.943 0.325 17865
5841 1 9 . 1 1 100 100 GLU C C 125 177.387 177.387 178.090 -0.703 17865
5842 1 9 . 1 1 100 100 GLU CA C 125 55.759 55.759 57.853 -2.094 17865
5843 1 9 . 1 1 100 100 GLU CB C 125 27.321 27.321 28.957 -1.636 17865
5844 1 9 . 1 1 100 100 GLU H H 125 8.385 8.385 8.762 -0.377 17865
5845 1 9 . 1 1 101 101 SER N N 126 115.949 115.949 116.944 -0.995 17865
5846 1 9 . 1 1 101 101 SER HA H 126 3.959 3.959 4.071 -0.112 17865
5847 1 9 . 1 1 101 101 SER C C 126 176.047 176.047 175.814 0.233 17865
5848 1 9 . 1 1 101 101 SER CA C 126 62.439 62.439 62.069 0.370 17865
5849 1 9 . 1 1 101 101 SER CB C 126 63.299 63.299 63.025 0.274 17865
5850 1 9 . 1 1 101 101 SER H H 126 7.823 7.823 7.781 0.042 17865
5851 1 9 . 1 1 102 102 ASP N N 127 120.920 120.920 121.173 -0.253 17865
5852 1 9 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.215 0.192 17865
5853 1 9 . 1 1 102 102 ASP C C 127 178.234 178.234 178.174 0.060 17865
5854 1 9 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.725 -0.314 17865
5855 1 9 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.400 -0.684 17865
5856 1 9 . 1 1 102 102 ASP H H 127 8.683 8.683 7.808 0.875 17865
5857 1 9 . 1 1 103 103 LYS N N 128 121.753 121.753 118.278 3.475 17865
5858 1 9 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.126 -0.122 17865
5859 1 9 . 1 1 103 103 LYS C C 128 179.395 179.395 178.378 1.017 17865
5860 1 9 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.281 1.190 17865
5861 1 9 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.775 0.626 17865
5862 1 9 . 1 1 103 103 LYS H H 128 7.771 7.771 7.620 0.151 17865
5863 1 9 . 1 1 104 104 CYS N N 129 120.109 120.109 119.539 0.570 17865
5864 1 9 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.359 -0.165 17865
5865 1 9 . 1 1 104 104 CYS C C 129 176.779 176.779 176.595 0.184 17865
5866 1 9 . 1 1 104 104 CYS CA C 129 59.790 59.790 60.967 -1.177 17865
5867 1 9 . 1 1 104 104 CYS CB C 129 36.879 36.879 27.113 9.766 17865
5868 1 9 . 1 1 104 104 CYS H H 129 7.973 7.973 7.861 0.112 17865
5869 1 9 . 1 1 105 105 LEU N N 130 121.804 121.804 122.269 -0.465 17865
5870 1 9 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.999 0.091 17865
5871 1 9 . 1 1 105 105 LEU C C 130 179.373 179.373 179.155 0.218 17865
5872 1 9 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.288 -0.921 17865
5873 1 9 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.153 0.945 17865
5874 1 9 . 1 1 105 105 LEU H H 130 8.666 8.666 8.875 -0.209 17865
5875 1 9 . 1 1 106 106 ASN N N 131 118.535 118.535 116.415 2.120 17865
5876 1 9 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.427 -0.189 17865
5877 1 9 . 1 1 106 106 ASN C C 131 177.830 177.830 177.506 0.324 17865
5878 1 9 . 1 1 106 106 ASN CA C 131 56.256 56.256 55.996 0.260 17865
5879 1 9 . 1 1 106 106 ASN CB C 131 37.817 37.817 38.047 -0.230 17865
5880 1 9 . 1 1 106 106 ASN H H 131 8.438 8.438 7.976 0.462 17865
5881 1 9 . 1 1 107 107 ALA N N 132 121.485 121.485 123.542 -2.057 17865
5882 1 9 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.157 0.062 17865
5883 1 9 . 1 1 107 107 ALA C C 132 180.726 180.726 179.217 1.509 17865
5884 1 9 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.507 0.456 17865
5885 1 9 . 1 1 107 107 ALA CB C 132 17.821 17.821 19.030 -1.209 17865
5886 1 9 . 1 1 107 107 ALA H H 132 7.541 7.541 7.152 0.389 17865
5887 1 9 . 1 1 108 108 ILE N N 133 120.979 120.979 118.472 2.507 17865
5888 1 9 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.588 0.343 17865
5889 1 9 . 1 1 108 108 ILE C C 133 178.114 178.114 178.387 -0.273 17865
5890 1 9 . 1 1 108 108 ILE CA C 133 63.353 63.353 63.776 -0.423 17865
5891 1 9 . 1 1 108 108 ILE CB C 133 36.454 36.454 36.529 -0.075 17865
5892 1 9 . 1 1 108 108 ILE H H 133 7.551 7.551 8.599 -1.048 17865
5893 1 9 . 1 1 109 109 LYS N N 134 121.415 121.415 118.765 2.650 17865
5894 1 9 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.075 -0.487 17865
5895 1 9 . 1 1 109 109 LYS C C 134 179.561 179.561 178.554 1.007 17865
5896 1 9 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.796 0.312 17865
5897 1 9 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.327 -0.166 17865
5898 1 9 . 1 1 109 109 LYS H H 134 8.414 8.414 7.517 0.897 17865
5899 1 9 . 1 1 110 110 GLU N N 135 116.099 116.099 118.364 -2.265 17865
5900 1 9 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.194 -0.265 17865
5901 1 9 . 1 1 110 110 GLU C C 135 178.239 178.239 179.232 -0.993 17865
5902 1 9 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.510 0.136 17865
5903 1 9 . 1 1 110 110 GLU CB C 135 29.638 29.638 29.017 0.621 17865
5904 1 9 . 1 1 110 110 GLU H H 135 7.473 7.473 7.882 -0.409 17865
5905 1 9 . 1 1 111 111 LYS N N 136 119.805 119.805 119.855 -0.050 17865
5906 1 9 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.022 -0.116 17865
5907 1 9 . 1 1 111 111 LYS C C 136 177.600 177.600 177.037 0.563 17865
5908 1 9 . 1 1 111 111 LYS CA C 136 58.749 58.749 57.728 1.021 17865
5909 1 9 . 1 1 111 111 LYS CB C 136 33.238 33.238 31.962 1.276 17865
5910 1 9 . 1 1 111 111 LYS H H 136 7.540 7.540 7.834 -0.294 17865
5911 1 9 . 1 1 112 112 TYR N N 137 114.768 114.768 116.998 -2.230 17865
5912 1 9 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.740 -0.217 17865
5913 1 9 . 1 1 112 112 TYR C C 137 174.690 174.690 174.209 0.481 17865
5914 1 9 . 1 1 112 112 TYR CA C 137 58.359 58.359 55.716 2.643 17865
5915 1 9 . 1 1 112 112 TYR CB C 137 38.328 38.328 37.552 0.776 17865
5916 1 9 . 1 1 112 112 TYR H H 137 7.488 7.488 7.473 0.015 17865
5917 1 9 . 1 1 113 113 LYS N N 138 123.694 123.694 121.858 1.836 17865
5918 1 9 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.300 0.201 17865
5919 1 9 . 1 1 113 113 LYS CA C 138 55.282 55.282 55.902 -0.620 17865
5920 1 9 . 1 1 113 113 LYS CB C 138 32.124 32.124 31.787 0.337 17865
5921 1 9 . 1 1 113 113 LYS H H 138 7.217 7.217 7.284 -0.067 17865
5922 1 9 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.425 0.027 17865
5923 1 9 . 1 1 114 114 PRO C C 139 176.974 176.974 176.574 0.400 17865
5924 1 9 . 1 1 114 114 PRO CA C 139 63.189 63.189 63.196 -0.007 17865
5925 1 9 . 1 1 114 114 PRO CB C 139 32.251 32.251 31.416 0.835 17865
5926 1 9 . 1 1 115 115 VAL N N 140 121.098 121.098 120.177 0.921 17865
5927 1 9 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.384 -0.282 17865
5928 1 9 . 1 1 115 115 VAL C C 140 176.207 176.207 176.081 0.126 17865
5929 1 9 . 1 1 115 115 VAL CA C 140 62.356 62.356 61.717 0.639 17865
5930 1 9 . 1 1 115 115 VAL CB C 140 33.256 33.256 32.326 0.930 17865
5931 1 9 . 1 1 115 115 VAL H H 140 8.272 8.272 8.203 0.069 17865
5932 1 9 . 1 1 116 116 VAL N N 141 124.167 124.167 120.368 3.799 17865
5933 1 9 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.138 -0.016 17865
5934 1 9 . 1 1 116 116 VAL C C 141 175.415 175.415 175.740 -0.325 17865
5935 1 9 . 1 1 116 116 VAL CA C 141 61.731 61.731 62.128 -0.397 17865
5936 1 9 . 1 1 116 116 VAL CB C 141 33.145 33.145 33.061 0.084 17865
5937 1 9 . 1 1 116 116 VAL H H 141 8.142 8.142 7.553 0.589 17865
5938 1 9 . 1 1 117 117 ASP N N 142 126.737 126.737 124.344 2.393 17865
5939 1 9 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.625 0.187 17865
5940 1 9 . 1 1 117 117 ASP CA C 142 52.217 52.217 53.911 -1.694 17865
5941 1 9 . 1 1 117 117 ASP CB C 142 41.368 41.368 40.810 0.558 17865
5942 1 9 . 1 1 117 117 ASP H H 142 8.419 8.419 8.414 0.005 17865
5943 1 9 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.410 0.001 17865
5944 1 9 . 1 1 118 118 PRO C C 143 176.662 176.662 176.007 0.655 17865
5945 1 9 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.235 0.012 17865
5946 1 9 . 1 1 118 118 PRO CB C 143 32.310 32.310 31.719 0.591 17865
5947 1 9 . 1 1 119 119 ASN N N 144 119.287 119.287 123.762 -4.475 17865
5948 1 9 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.779 0.168 17865
5949 1 9 . 1 1 119 119 ASN CA C 144 51.633 51.633 51.284 0.349 17865
5950 1 9 . 1 1 119 119 ASN CB C 144 38.859 38.859 37.864 0.995 17865
5951 1 9 . 1 1 119 119 ASN H H 144 8.432 8.432 8.499 -0.067 17865
5952 1 9 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.764 -0.084 17865
5953 1 9 . 1 1 120 120 PRO CA C 145 61.640 61.640 62.279 -0.639 17865
5954 1 9 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.572 -0.654 17865
5955 1 9 . 1 1 121 121 PRO HA H 146 4.377 4.377 5.044 -0.667 17865
5956 1 9 . 1 1 121 121 PRO C C 146 175.876 175.876 176.043 -0.167 17865
5957 1 9 . 1 1 121 121 PRO CA C 146 63.174 63.174 62.294 0.880 17865
5958 1 9 . 1 1 121 121 PRO CB C 146 31.939 31.939 32.749 -0.810 17865
5959 1 10 . 1 1 2 2 ASP N N 27 121.041 121.041 122.018 -0.977 17865
5960 1 10 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.793 -0.155 17865
5961 1 10 . 1 1 2 2 ASP C C 27 175.878 175.878 176.103 -0.225 17865
5962 1 10 . 1 1 2 2 ASP CA C 27 54.382 54.382 53.843 0.540 17865
5963 1 10 . 1 1 2 2 ASP CB C 27 41.729 41.729 41.874 -0.145 17865
5964 1 10 . 1 1 2 2 ASP H H 27 8.639 8.639 8.245 0.394 17865
5965 1 10 . 1 1 3 3 VAL N N 28 119.901 119.901 121.491 -1.590 17865
5966 1 10 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.412 -0.379 17865
5967 1 10 . 1 1 3 3 VAL C C 28 175.521 175.521 175.444 0.077 17865
5968 1 10 . 1 1 3 3 VAL CA C 28 62.216 62.216 61.312 0.904 17865
5969 1 10 . 1 1 3 3 VAL CB C 28 33.003 33.003 30.216 2.787 17865
5970 1 10 . 1 1 3 3 VAL H H 28 8.113 8.113 8.417 -0.304 17865
5971 1 10 . 1 1 4 4 PHE N N 29 123.707 123.707 121.456 2.251 17865
5972 1 10 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.091 0.565 17865
5973 1 10 . 1 1 4 4 PHE C C 29 174.874 174.874 175.946 -1.072 17865
5974 1 10 . 1 1 4 4 PHE CA C 29 57.159 57.159 58.889 -1.730 17865
5975 1 10 . 1 1 4 4 PHE CB C 29 39.795 39.795 38.115 1.680 17865
5976 1 10 . 1 1 4 4 PHE H H 29 8.255 8.255 7.623 0.632 17865
5977 1 10 . 1 1 5 5 ASP N N 30 124.203 124.203 124.099 0.104 17865
5978 1 10 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.627 0.211 17865
5979 1 10 . 1 1 5 5 ASP CA C 30 52.385 52.385 53.128 -0.743 17865
5980 1 10 . 1 1 5 5 ASP CB C 30 40.801 40.801 40.861 -0.060 17865
5981 1 10 . 1 1 5 5 ASP H H 30 8.226 8.226 8.463 -0.237 17865
5982 1 10 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.548 -0.011 17865
5983 1 10 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.258 -0.594 17865
5984 1 10 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.220 -0.394 17865
5985 1 10 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.418 0.008 17865
5986 1 10 . 1 1 7 7 PRO C C 32 177.226 177.226 176.631 0.595 17865
5987 1 10 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.200 -0.031 17865
5988 1 10 . 1 1 7 7 PRO CB C 32 31.948 31.948 32.407 -0.459 17865
5989 1 10 . 1 1 8 8 THR N N 33 114.158 114.158 116.539 -2.381 17865
5990 1 10 . 1 1 8 8 THR HA H 33 4.195 4.195 4.298 -0.103 17865
5991 1 10 . 1 1 8 8 THR C C 33 174.468 174.468 174.472 -0.004 17865
5992 1 10 . 1 1 8 8 THR CA C 33 62.110 62.110 63.377 -1.268 17865
5993 1 10 . 1 1 8 8 THR CB C 33 69.975 69.975 68.289 1.686 17865
5994 1 10 . 1 1 8 8 THR H H 33 8.096 8.096 8.393 -0.297 17865
5995 1 10 . 1 1 9 9 GLN N N 34 122.411 122.411 126.766 -4.355 17865
5996 1 10 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.438 -0.175 17865
5997 1 10 . 1 1 9 9 GLN C C 34 175.445 175.445 174.490 0.955 17865
5998 1 10 . 1 1 9 9 GLN CA C 34 55.763 55.763 54.927 0.836 17865
5999 1 10 . 1 1 9 9 GLN CB C 34 29.691 29.691 30.528 -0.837 17865
6000 1 10 . 1 1 9 9 GLN H H 34 8.278 8.278 8.665 -0.387 17865
6001 1 10 . 1 1 10 10 TYR N N 35 121.048 121.048 118.051 2.997 17865
6002 1 10 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.810 -0.290 17865
6003 1 10 . 1 1 10 10 TYR C C 35 176.314 176.314 175.373 0.941 17865
6004 1 10 . 1 1 10 10 TYR CA C 35 57.972 57.972 56.716 1.256 17865
6005 1 10 . 1 1 10 10 TYR CB C 35 38.936 38.936 39.238 -0.302 17865
6006 1 10 . 1 1 10 10 TYR H H 35 8.227 8.227 7.123 1.104 17865
6007 1 10 . 1 1 11 11 GLY N N 36 109.711 109.711 111.008 -1.297 17865
6008 1 10 . 1 1 11 11 GLY C C 36 174.128 174.128 172.635 1.493 17865
6009 1 10 . 1 1 11 11 GLY CA C 36 45.212 45.212 45.350 -0.138 17865
6010 1 10 . 1 1 11 11 GLY H H 36 8.247 8.247 8.926 -0.679 17865
6011 1 10 . 1 1 12 12 TYR N N 37 120.302 120.302 119.751 0.551 17865
6012 1 10 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.869 -0.387 17865
6013 1 10 . 1 1 12 12 TYR C C 37 175.864 175.864 173.712 2.152 17865
6014 1 10 . 1 1 12 12 TYR CA C 37 58.541 58.541 58.654 -0.113 17865
6015 1 10 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.634 -0.919 17865
6016 1 10 . 1 1 12 12 TYR H H 37 8.101 8.101 8.166 -0.065 17865
6017 1 10 . 1 1 13 13 ASP N N 38 121.883 121.883 119.611 2.272 17865
6018 1 10 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.444 0.042 17865
6019 1 10 . 1 1 13 13 ASP C C 38 176.538 176.538 175.495 1.043 17865
6020 1 10 . 1 1 13 13 ASP CA C 38 54.223 54.223 54.505 -0.282 17865
6021 1 10 . 1 1 13 13 ASP CB C 38 40.988 40.988 40.850 0.138 17865
6022 1 10 . 1 1 13 13 ASP H H 38 8.266 8.266 8.010 0.256 17865
6023 1 10 . 1 1 14 14 GLY N N 39 107.705 107.705 107.802 -0.097 17865
6024 1 10 . 1 1 14 14 GLY C C 39 173.822 173.822 173.589 0.233 17865
6025 1 10 . 1 1 14 14 GLY CA C 39 45.404 45.404 44.739 0.665 17865
6026 1 10 . 1 1 14 14 GLY H H 39 7.647 7.647 8.021 -0.374 17865
6027 1 10 . 1 1 15 15 LYS N N 40 121.621 121.621 120.058 1.563 17865
6028 1 10 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.759 -0.184 17865
6029 1 10 . 1 1 15 15 LYS CA C 40 54.100 54.100 53.107 0.993 17865
6030 1 10 . 1 1 15 15 LYS CB C 40 32.510 32.510 33.576 -1.066 17865
6031 1 10 . 1 1 15 15 LYS H H 40 7.908 7.908 7.707 0.201 17865
6032 1 10 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.616 -0.264 17865
6033 1 10 . 1 1 16 16 PRO C C 41 176.806 176.806 176.113 0.693 17865
6034 1 10 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.712 0.046 17865
6035 1 10 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.281 0.033 17865
6036 1 10 . 1 1 17 17 LEU N N 42 123.488 123.488 121.250 2.238 17865
6037 1 10 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.250 -0.201 17865
6038 1 10 . 1 1 17 17 LEU C C 42 174.973 174.973 175.721 -0.748 17865
6039 1 10 . 1 1 17 17 LEU CA C 42 55.436 55.436 54.592 0.844 17865
6040 1 10 . 1 1 17 17 LEU CB C 42 42.093 42.093 42.089 0.004 17865
6041 1 10 . 1 1 17 17 LEU H H 42 8.499 8.499 8.399 0.100 17865
6042 1 10 . 1 1 18 18 ASP N N 43 123.354 123.354 125.635 -2.281 17865
6043 1 10 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.733 -0.235 17865
6044 1 10 . 1 1 18 18 ASP C C 43 175.947 175.947 176.220 -0.273 17865
6045 1 10 . 1 1 18 18 ASP CA C 43 52.858 52.858 52.493 0.365 17865
6046 1 10 . 1 1 18 18 ASP CB C 43 42.221 42.221 42.659 -0.438 17865
6047 1 10 . 1 1 18 18 ASP H H 43 7.789 7.789 7.951 -0.162 17865
6048 1 10 . 1 1 19 19 ALA N N 44 120.147 120.147 120.423 -0.276 17865
6049 1 10 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.108 -0.122 17865
6050 1 10 . 1 1 19 19 ALA C C 44 179.476 179.476 178.918 0.558 17865
6051 1 10 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.395 0.768 17865
6052 1 10 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.743 -0.356 17865
6053 1 10 . 1 1 19 19 ALA H H 44 8.561 8.561 8.493 0.068 17865
6054 1 10 . 1 1 20 20 SER N N 45 115.037 115.037 114.390 0.647 17865
6055 1 10 . 1 1 20 20 SER HA H 45 4.151 4.151 4.152 -0.001 17865
6056 1 10 . 1 1 20 20 SER C C 45 177.191 177.191 176.950 0.241 17865
6057 1 10 . 1 1 20 20 SER CA C 45 61.629 61.629 61.412 0.217 17865
6058 1 10 . 1 1 20 20 SER CB C 45 62.804 62.804 63.103 -0.299 17865
6059 1 10 . 1 1 20 20 SER H H 45 8.466 8.466 8.289 0.177 17865
6060 1 10 . 1 1 21 21 PHE N N 46 125.030 125.030 123.198 1.832 17865
6061 1 10 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.268 -0.037 17865
6062 1 10 . 1 1 21 21 PHE C C 46 176.850 176.850 175.997 0.853 17865
6063 1 10 . 1 1 21 21 PHE CA C 46 60.806 60.806 61.237 -0.431 17865
6064 1 10 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.224 0.657 17865
6065 1 10 . 1 1 21 21 PHE H H 46 8.034 8.034 7.720 0.314 17865
6066 1 10 . 1 1 22 22 CYS N N 47 113.943 113.943 115.633 -1.690 17865
6067 1 10 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.316 -0.065 17865
6068 1 10 . 1 1 22 22 CYS C C 47 176.449 176.449 176.729 -0.280 17865
6069 1 10 . 1 1 22 22 CYS CA C 47 53.600 53.600 58.460 -4.860 17865
6070 1 10 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.518 10.873 17865
6071 1 10 . 1 1 22 22 CYS H H 47 7.691 7.691 7.850 -0.159 17865
6072 1 10 . 1 1 23 23 ARG N N 48 119.958 119.958 120.706 -0.748 17865
6073 1 10 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.090 -0.010 17865
6074 1 10 . 1 1 23 23 ARG C C 48 177.904 177.904 177.253 0.651 17865
6075 1 10 . 1 1 23 23 ARG CA C 48 58.907 58.907 58.472 0.435 17865
6076 1 10 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.940 0.231 17865
6077 1 10 . 1 1 23 23 ARG H H 48 7.628 7.628 7.542 0.086 17865
6078 1 10 . 1 1 24 24 THR N N 49 106.445 106.445 111.647 -5.202 17865
6079 1 10 . 1 1 24 24 THR HA H 49 4.385 4.385 4.082 0.303 17865
6080 1 10 . 1 1 24 24 THR C C 49 174.758 174.758 175.384 -0.626 17865
6081 1 10 . 1 1 24 24 THR CA C 49 61.573 61.573 64.498 -2.925 17865
6082 1 10 . 1 1 24 24 THR CB C 49 68.794 68.794 68.439 0.355 17865
6083 1 10 . 1 1 24 24 THR H H 49 7.307 7.307 7.424 -0.117 17865
6084 1 10 . 1 1 25 25 ALA N N 50 122.242 122.242 121.193 1.049 17865
6085 1 10 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.415 -0.011 17865
6086 1 10 . 1 1 25 25 ALA C C 50 178.554 178.554 177.605 0.949 17865
6087 1 10 . 1 1 25 25 ALA CA C 50 52.381 52.381 52.328 0.053 17865
6088 1 10 . 1 1 25 25 ALA CB C 50 18.395 18.395 20.109 -1.714 17865
6089 1 10 . 1 1 25 25 ALA H H 50 7.401 7.401 7.520 -0.119 17865
6090 1 10 . 1 1 26 26 GLY N N 51 110.604 110.604 107.374 3.230 17865
6091 1 10 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.306 0.716 17865
6092 1 10 . 1 1 26 26 GLY H H 51 8.285 8.285 7.532 0.753 17865
6093 1 10 . 1 1 27 27 SER HA H 52 4.382 4.382 4.205 0.177 17865
6094 1 10 . 1 1 27 27 SER C C 52 175.774 175.774 175.869 -0.095 17865
6095 1 10 . 1 1 27 27 SER CA C 52 60.803 60.803 61.766 -0.963 17865
6096 1 10 . 1 1 27 27 SER CB C 52 62.827 62.827 63.031 -0.204 17865
6097 1 10 . 1 1 28 28 ARG N N 53 119.682 119.682 119.270 0.412 17865
6098 1 10 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.769 0.111 17865
6099 1 10 . 1 1 28 28 ARG C C 53 175.796 175.796 177.701 -1.905 17865
6100 1 10 . 1 1 28 28 ARG CA C 53 55.738 55.738 55.393 0.345 17865
6101 1 10 . 1 1 28 28 ARG CB C 53 30.237 30.237 29.451 0.786 17865
6102 1 10 . 1 1 28 28 ARG H H 53 7.894 7.894 7.748 0.146 17865
6103 1 10 . 1 1 29 29 GLU N N 54 122.318 122.318 121.374 0.944 17865
6104 1 10 . 1 1 29 29 GLU HA H 54 3.595 3.595 3.879 -0.284 17865
6105 1 10 . 1 1 29 29 GLU C C 54 177.523 177.523 177.838 -0.315 17865
6106 1 10 . 1 1 29 29 GLU CA C 54 61.223 61.223 59.730 1.493 17865
6107 1 10 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.334 -0.397 17865
6108 1 10 . 1 1 29 29 GLU H H 54 7.730 7.730 7.859 -0.129 17865
6109 1 10 . 1 1 30 30 LYS N N 55 118.377 118.377 117.659 0.718 17865
6110 1 10 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.031 -0.203 17865
6111 1 10 . 1 1 30 30 LYS C C 55 179.205 179.205 178.950 0.255 17865
6112 1 10 . 1 1 30 30 LYS CA C 55 60.427 60.427 58.933 1.494 17865
6113 1 10 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.398 -0.797 17865
6114 1 10 . 1 1 30 30 LYS H H 55 8.659 8.659 7.459 1.200 17865
6115 1 10 . 1 1 31 31 ASP N N 56 121.614 121.614 120.209 1.405 17865
6116 1 10 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.492 -0.181 17865
6117 1 10 . 1 1 31 31 ASP C C 56 177.393 177.393 178.612 -1.219 17865
6118 1 10 . 1 1 31 31 ASP CA C 56 57.316 57.316 57.324 -0.008 17865
6119 1 10 . 1 1 31 31 ASP CB C 56 40.423 40.423 40.801 -0.378 17865
6120 1 10 . 1 1 31 31 ASP H H 56 7.646 7.646 7.851 -0.205 17865
6121 1 10 . 1 1 32 32 CYS N N 57 120.345 120.345 119.612 0.733 17865
6122 1 10 . 1 1 32 32 CYS HA H 57 3.601 3.601 4.381 -0.780 17865
6123 1 10 . 1 1 32 32 CYS C C 57 175.772 175.772 176.472 -0.700 17865
6124 1 10 . 1 1 32 32 CYS CA C 57 60.197 60.197 60.049 0.148 17865
6125 1 10 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.603 8.363 17865
6126 1 10 . 1 1 32 32 CYS H H 57 8.042 8.042 7.785 0.257 17865
6127 1 10 . 1 1 33 33 ARG N N 58 120.293 120.293 119.638 0.655 17865
6128 1 10 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.898 -0.222 17865
6129 1 10 . 1 1 33 33 ARG C C 58 179.633 179.633 178.488 1.145 17865
6130 1 10 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.545 0.841 17865
6131 1 10 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.768 0.073 17865
6132 1 10 . 1 1 33 33 ARG H H 58 8.531 8.531 7.813 0.718 17865
6133 1 10 . 1 1 34 34 LYS N N 59 121.166 121.166 119.756 1.410 17865
6134 1 10 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.101 -0.065 17865
6135 1 10 . 1 1 34 34 LYS C C 59 179.220 179.220 178.035 1.185 17865
6136 1 10 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.966 0.564 17865
6137 1 10 . 1 1 34 34 LYS CB C 59 32.110 32.110 31.752 0.358 17865
6138 1 10 . 1 1 34 34 LYS H H 59 7.633 7.633 7.602 0.031 17865
6139 1 10 . 1 1 35 35 ASP N N 60 122.166 122.166 119.914 2.252 17865
6140 1 10 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.390 0.041 17865
6141 1 10 . 1 1 35 35 ASP C C 60 179.709 179.709 178.410 1.299 17865
6142 1 10 . 1 1 35 35 ASP CA C 60 57.703 57.703 58.185 -0.482 17865
6143 1 10 . 1 1 35 35 ASP CB C 60 40.672 40.672 40.606 0.066 17865
6144 1 10 . 1 1 35 35 ASP H H 60 8.221 8.221 8.164 0.057 17865
6145 1 10 . 1 1 36 36 VAL N N 61 121.312 121.312 119.756 1.556 17865
6146 1 10 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.626 -0.225 17865
6147 1 10 . 1 1 36 36 VAL C C 61 178.339 178.339 176.758 1.581 17865
6148 1 10 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.115 2.018 17865
6149 1 10 . 1 1 36 36 VAL CB C 61 31.657 31.657 32.019 -0.362 17865
6150 1 10 . 1 1 36 36 VAL H H 61 8.916 8.916 8.068 0.848 17865
6151 1 10 . 1 1 37 37 GLN N N 62 119.166 119.166 117.898 1.268 17865
6152 1 10 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.086 -0.144 17865
6153 1 10 . 1 1 37 37 GLN C C 62 177.293 177.293 178.077 -0.784 17865
6154 1 10 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.754 0.526 17865
6155 1 10 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.645 -0.275 17865
6156 1 10 . 1 1 37 37 GLN H H 62 7.697 7.697 7.504 0.193 17865
6157 1 10 . 1 1 38 38 ALA N N 63 118.964 118.964 120.740 -1.776 17865
6158 1 10 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.241 0.001 17865
6159 1 10 . 1 1 38 38 ALA C C 63 177.221 177.221 178.274 -1.053 17865
6160 1 10 . 1 1 38 38 ALA CA C 63 53.137 53.137 53.403 -0.265 17865
6161 1 10 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.205 -0.308 17865
6162 1 10 . 1 1 38 38 ALA H H 63 7.508 7.508 7.909 -0.401 17865
6163 1 10 . 1 1 39 39 CYS N N 64 119.081 119.081 118.893 0.188 17865
6164 1 10 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.390 0.563 17865
6165 1 10 . 1 1 39 39 CYS C C 64 172.052 172.052 174.810 -2.758 17865
6166 1 10 . 1 1 39 39 CYS CA C 64 51.880 51.880 59.342 -7.462 17865
6167 1 10 . 1 1 39 39 CYS CB C 64 34.328 34.328 25.309 9.019 17865
6168 1 10 . 1 1 39 39 CYS H H 64 7.354 7.354 7.845 -0.491 17865
6169 1 10 . 1 1 40 40 ASP N N 65 124.167 124.167 126.878 -2.711 17865
6170 1 10 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.428 -0.103 17865
6171 1 10 . 1 1 40 40 ASP C C 65 176.496 176.496 176.047 0.449 17865
6172 1 10 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.169 0.555 17865
6173 1 10 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.510 -0.197 17865
6174 1 10 . 1 1 40 40 ASP H H 65 8.142 8.142 8.514 -0.372 17865
6175 1 10 . 1 1 41 41 LYS N N 66 118.844 118.844 118.566 0.278 17865
6176 1 10 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.543 -0.019 17865
6177 1 10 . 1 1 41 41 LYS C C 66 175.586 175.586 176.616 -1.030 17865
6178 1 10 . 1 1 41 41 LYS CA C 66 55.275 55.275 55.681 -0.406 17865
6179 1 10 . 1 1 41 41 LYS CB C 66 32.598 32.598 32.109 0.489 17865
6180 1 10 . 1 1 41 41 LYS H H 66 7.858 7.858 8.231 -0.373 17865
6181 1 10 . 1 1 42 42 LYS N N 67 126.081 126.081 122.754 3.327 17865
6182 1 10 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.169 -0.254 17865
6183 1 10 . 1 1 42 42 LYS C C 67 174.665 174.665 175.199 -0.534 17865
6184 1 10 . 1 1 42 42 LYS CA C 67 57.827 57.827 56.802 1.025 17865
6185 1 10 . 1 1 42 42 LYS CB C 67 34.059 34.059 32.800 1.259 17865
6186 1 10 . 1 1 42 42 LYS H H 67 8.790 8.790 8.682 0.108 17865
6187 1 10 . 1 1 43 43 TYR N N 68 114.138 114.138 115.859 -1.721 17865
6188 1 10 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.761 0.498 17865
6189 1 10 . 1 1 43 43 TYR C C 68 175.767 175.767 175.793 -0.026 17865
6190 1 10 . 1 1 43 43 TYR CA C 68 55.880 55.880 56.448 -0.568 17865
6191 1 10 . 1 1 43 43 TYR CB C 68 42.363 42.363 41.567 0.796 17865
6192 1 10 . 1 1 43 43 TYR H H 68 7.294 7.294 7.438 -0.144 17865
6193 1 10 . 1 1 44 44 ASP N N 69 121.807 121.807 121.992 -0.185 17865
6194 1 10 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.681 -0.041 17865
6195 1 10 . 1 1 44 44 ASP C C 69 177.812 177.812 177.400 0.412 17865
6196 1 10 . 1 1 44 44 ASP CA C 69 52.110 52.110 54.160 -2.050 17865
6197 1 10 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.299 -1.859 17865
6198 1 10 . 1 1 44 44 ASP H H 69 8.995 8.995 9.111 -0.116 17865
6199 1 10 . 1 1 45 45 ASP N N 70 116.686 116.686 124.712 -8.026 17865
6200 1 10 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.439 -0.015 17865
6201 1 10 . 1 1 45 45 ASP C C 70 177.054 177.054 176.906 0.148 17865
6202 1 10 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.658 -0.277 17865
6203 1 10 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.715 -0.467 17865
6204 1 10 . 1 1 45 45 ASP H H 70 8.369 8.369 8.872 -0.503 17865
6205 1 10 . 1 1 46 46 GLN N N 71 117.949 117.949 117.282 0.667 17865
6206 1 10 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.428 0.028 17865
6207 1 10 . 1 1 46 46 GLN C C 71 176.273 176.273 176.619 -0.346 17865
6208 1 10 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.001 0.366 17865
6209 1 10 . 1 1 46 46 GLN CB C 71 29.330 29.330 28.765 0.565 17865
6210 1 10 . 1 1 46 46 GLN H H 71 8.274 8.274 8.174 0.100 17865
6211 1 10 . 1 1 47 47 GLY N N 72 108.369 108.369 108.212 0.157 17865
6212 1 10 . 1 1 47 47 GLY C C 72 174.145 174.145 173.935 0.210 17865
6213 1 10 . 1 1 47 47 GLY CA C 72 45.823 45.823 44.999 0.824 17865
6214 1 10 . 1 1 47 47 GLY H H 72 8.174 8.174 8.381 -0.207 17865
6215 1 10 . 1 1 48 48 ARG N N 73 121.554 121.554 119.488 2.066 17865
6216 1 10 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.499 -0.014 17865
6217 1 10 . 1 1 48 48 ARG C C 73 176.855 176.855 175.321 1.534 17865
6218 1 10 . 1 1 48 48 ARG CA C 73 55.289 55.289 55.054 0.235 17865
6219 1 10 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.551 -0.993 17865
6220 1 10 . 1 1 48 48 ARG H H 73 8.462 8.462 7.891 0.571 17865
6221 1 10 . 1 1 49 49 GLU N N 74 122.784 122.784 121.448 1.336 17865
6222 1 10 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.483 0.000 17865
6223 1 10 . 1 1 49 49 GLU C C 74 178.098 178.098 176.727 1.371 17865
6224 1 10 . 1 1 49 49 GLU CA C 74 57.184 57.184 56.649 0.535 17865
6225 1 10 . 1 1 49 49 GLU CB C 74 30.777 30.777 30.360 0.417 17865
6226 1 10 . 1 1 49 49 GLU H H 74 8.703 8.703 8.644 0.059 17865
6227 1 10 . 1 1 50 50 THR N N 75 114.563 114.563 115.806 -1.243 17865
6228 1 10 . 1 1 50 50 THR HA H 75 4.212 4.212 4.414 -0.202 17865
6229 1 10 . 1 1 50 50 THR C C 75 175.170 175.170 175.485 -0.315 17865
6230 1 10 . 1 1 50 50 THR CA C 75 60.589 60.589 60.908 -0.319 17865
6231 1 10 . 1 1 50 50 THR CB C 75 70.952 70.952 70.256 0.696 17865
6232 1 10 . 1 1 50 50 THR H H 75 7.717 7.717 8.054 -0.337 17865
6233 1 10 . 1 1 51 51 ALA N N 76 122.097 122.097 122.929 -0.832 17865
6234 1 10 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.032 0.006 17865
6235 1 10 . 1 1 51 51 ALA C C 76 181.906 181.906 179.251 2.655 17865
6236 1 10 . 1 1 51 51 ALA CA C 76 55.654 55.654 54.978 0.676 17865
6237 1 10 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.303 -0.310 17865
6238 1 10 . 1 1 51 51 ALA H H 76 8.734 8.734 8.588 0.146 17865
6239 1 10 . 1 1 52 52 CYS N N 77 115.347 115.347 117.243 -1.896 17865
6240 1 10 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.048 0.432 17865
6241 1 10 . 1 1 52 52 CYS C C 77 176.299 176.299 176.449 -0.150 17865
6242 1 10 . 1 1 52 52 CYS CA C 77 57.701 57.701 61.323 -3.622 17865
6243 1 10 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.352 10.279 17865
6244 1 10 . 1 1 52 52 CYS H H 77 9.073 9.073 8.226 0.847 17865
6245 1 10 . 1 1 53 53 ALA N N 78 128.517 128.517 122.483 6.034 17865
6246 1 10 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.845 0.010 17865
6247 1 10 . 1 1 53 53 ALA C C 78 178.736 178.736 179.179 -0.443 17865
6248 1 10 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.022 0.611 17865
6249 1 10 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.887 1.304 17865
6250 1 10 . 1 1 53 53 ALA H H 78 7.174 7.174 7.811 -0.637 17865
6251 1 10 . 1 1 54 54 LYS N N 79 118.706 118.706 119.111 -0.405 17865
6252 1 10 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.096 -0.293 17865
6253 1 10 . 1 1 54 54 LYS C C 79 179.611 179.611 178.711 0.900 17865
6254 1 10 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.921 0.804 17865
6255 1 10 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.359 0.294 17865
6256 1 10 . 1 1 54 54 LYS H H 79 8.313 8.313 7.784 0.529 17865
6257 1 10 . 1 1 55 55 GLY N N 80 104.822 104.822 108.045 -3.223 17865
6258 1 10 . 1 1 55 55 GLY C C 80 176.504 176.504 176.112 0.392 17865
6259 1 10 . 1 1 55 55 GLY CA C 80 46.839 46.839 47.260 -0.421 17865
6260 1 10 . 1 1 55 55 GLY H H 80 8.175 8.175 7.783 0.392 17865
6261 1 10 . 1 1 56 56 ILE N N 81 123.697 123.697 122.940 0.757 17865
6262 1 10 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.785 0.010 17865
6263 1 10 . 1 1 56 56 ILE C C 81 177.334 177.334 178.312 -0.978 17865
6264 1 10 . 1 1 56 56 ILE CA C 81 65.281 65.281 65.132 0.149 17865
6265 1 10 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.801 0.534 17865
6266 1 10 . 1 1 56 56 ILE H H 81 7.590 7.590 7.546 0.044 17865
6267 1 10 . 1 1 57 57 ARG N N 82 118.161 118.161 119.070 -0.909 17865
6268 1 10 . 1 1 57 57 ARG HA H 82 3.935 3.935 4.301 -0.366 17865
6269 1 10 . 1 1 57 57 ARG C C 82 178.662 178.662 179.316 -0.654 17865
6270 1 10 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.263 0.439 17865
6271 1 10 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.708 0.191 17865
6272 1 10 . 1 1 57 57 ARG H H 82 7.569 7.569 7.805 -0.236 17865
6273 1 10 . 1 1 58 58 GLU N N 83 115.085 115.085 118.306 -3.221 17865
6274 1 10 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.362 -0.331 17865
6275 1 10 . 1 1 58 58 GLU C C 83 178.224 178.224 179.085 -0.861 17865
6276 1 10 . 1 1 58 58 GLU CA C 83 58.304 58.304 59.338 -1.034 17865
6277 1 10 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.699 0.332 17865
6278 1 10 . 1 1 58 58 GLU H H 83 7.786 7.786 8.253 -0.467 17865
6279 1 10 . 1 1 59 59 LYS N N 84 119.183 119.183 118.912 0.271 17865
6280 1 10 . 1 1 59 59 LYS HA H 84 3.830 3.830 3.936 -0.106 17865
6281 1 10 . 1 1 59 59 LYS C C 84 177.933 177.933 177.556 0.377 17865
6282 1 10 . 1 1 59 59 LYS CA C 84 59.043 59.043 58.485 0.558 17865
6283 1 10 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.595 1.055 17865
6284 1 10 . 1 1 59 59 LYS H H 84 7.968 7.968 8.412 -0.444 17865
6285 1 10 . 1 1 60 60 TYR N N 85 113.663 113.663 114.242 -0.579 17865
6286 1 10 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.684 0.019 17865
6287 1 10 . 1 1 60 60 TYR C C 85 174.729 174.729 174.467 0.262 17865
6288 1 10 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.604 0.598 17865
6289 1 10 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.608 0.294 17865
6290 1 10 . 1 1 60 60 TYR H H 85 7.562 7.562 7.520 0.042 17865
6291 1 10 . 1 1 61 61 LYS N N 86 121.862 121.862 122.704 -0.842 17865
6292 1 10 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.452 0.060 17865
6293 1 10 . 1 1 61 61 LYS CA C 86 54.942 54.942 54.902 0.040 17865
6294 1 10 . 1 1 61 61 LYS CB C 86 32.102 32.102 31.524 0.578 17865
6295 1 10 . 1 1 61 61 LYS H H 86 7.222 7.222 7.297 -0.075 17865
6296 1 10 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.443 -0.120 17865
6297 1 10 . 1 1 62 62 PRO C C 87 176.576 176.576 175.857 0.719 17865
6298 1 10 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.550 0.470 17865
6299 1 10 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.423 -0.183 17865
6300 1 10 . 1 1 63 63 ALA N N 88 125.029 125.029 123.188 1.841 17865
6301 1 10 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.463 -0.209 17865
6302 1 10 . 1 1 63 63 ALA C C 88 177.301 177.301 176.735 0.566 17865
6303 1 10 . 1 1 63 63 ALA CA C 88 52.281 52.281 51.939 0.342 17865
6304 1 10 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.703 1.499 17865
6305 1 10 . 1 1 63 63 ALA H H 88 8.329 8.329 8.220 0.109 17865
6306 1 10 . 1 1 64 64 VAL N N 89 121.843 121.843 120.277 1.566 17865
6307 1 10 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.262 -0.318 17865
6308 1 10 . 1 1 64 64 VAL C C 89 174.791 174.791 174.156 0.635 17865
6309 1 10 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.654 1.327 17865
6310 1 10 . 1 1 64 64 VAL CB C 89 33.485 33.485 34.846 -1.361 17865
6311 1 10 . 1 1 64 64 VAL H H 89 8.075 8.075 7.595 0.480 17865
6312 1 10 . 1 1 65 65 VAL N N 90 125.399 125.399 117.212 8.187 17865
6313 1 10 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.512 -0.374 17865
6314 1 10 . 1 1 65 65 VAL C C 90 174.340 174.340 174.619 -0.279 17865
6315 1 10 . 1 1 65 65 VAL CA C 90 61.162 61.162 61.257 -0.095 17865
6316 1 10 . 1 1 65 65 VAL CB C 90 33.866 33.866 32.280 1.586 17865
6317 1 10 . 1 1 65 65 VAL H H 90 8.229 8.229 8.074 0.155 17865
6318 1 10 . 1 1 66 66 TYR N N 91 124.848 124.848 126.638 -1.790 17865
6319 1 10 . 1 1 66 66 TYR HA H 91 4.771 4.771 5.087 -0.316 17865
6320 1 10 . 1 1 66 66 TYR C C 91 176.658 176.658 176.808 -0.150 17865
6321 1 10 . 1 1 66 66 TYR CA C 91 58.084 58.084 56.408 1.676 17865
6322 1 10 . 1 1 66 66 TYR CB C 91 41.535 41.535 39.397 2.138 17865
6323 1 10 . 1 1 66 66 TYR H H 91 9.145 9.145 8.822 0.323 17865
6324 1 10 . 1 1 67 67 GLY N N 92 106.185 106.185 110.314 -4.129 17865
6325 1 10 . 1 1 67 67 GLY C C 92 175.681 175.681 175.143 0.538 17865
6326 1 10 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.890 0.085 17865
6327 1 10 . 1 1 67 67 GLY H H 92 8.730 8.730 8.885 -0.155 17865
6328 1 10 . 1 1 68 68 TYR N N 93 121.815 121.815 116.642 5.173 17865
6329 1 10 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.236 -0.261 17865
6330 1 10 . 1 1 68 68 TYR C C 93 176.035 176.035 175.916 0.119 17865
6331 1 10 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.688 1.358 17865
6332 1 10 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.112 0.312 17865
6333 1 10 . 1 1 68 68 TYR H H 93 8.711 8.711 8.262 0.449 17865
6334 1 10 . 1 1 69 69 ASP N N 94 115.507 115.507 118.214 -2.707 17865
6335 1 10 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.527 -0.239 17865
6336 1 10 . 1 1 69 69 ASP C C 94 177.063 177.063 177.560 -0.497 17865
6337 1 10 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.927 -0.916 17865
6338 1 10 . 1 1 69 69 ASP CB C 94 40.167 40.167 41.315 -1.148 17865
6339 1 10 . 1 1 69 69 ASP H H 94 8.010 8.010 7.405 0.605 17865
6340 1 10 . 1 1 70 70 GLY N N 95 107.196 107.196 107.919 -0.723 17865
6341 1 10 . 1 1 70 70 GLY C C 95 173.936 173.936 174.059 -0.123 17865
6342 1 10 . 1 1 70 70 GLY CA C 95 45.392 45.392 44.900 0.492 17865
6343 1 10 . 1 1 70 70 GLY H H 95 7.986 7.986 7.658 0.328 17865
6344 1 10 . 1 1 71 71 LYS N N 96 121.258 121.258 121.235 0.023 17865
6345 1 10 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.478 0.306 17865
6346 1 10 . 1 1 71 71 LYS CA C 96 54.114 54.114 54.117 -0.003 17865
6347 1 10 . 1 1 71 71 LYS CB C 96 31.762 31.762 32.529 -0.767 17865
6348 1 10 . 1 1 71 71 LYS H H 96 7.877 7.877 7.566 0.311 17865
6349 1 10 . 1 1 72 72 PRO C C 97 177.170 177.170 175.817 1.353 17865
6350 1 10 . 1 1 72 72 PRO CA C 97 63.137 63.137 62.491 0.646 17865
6351 1 10 . 1 1 72 72 PRO CB C 97 32.240 32.240 30.861 1.379 17865
6352 1 10 . 1 1 73 73 LEU N N 98 123.503 123.503 121.849 1.654 17865
6353 1 10 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.808 -0.448 17865
6354 1 10 . 1 1 73 73 LEU C C 98 176.354 176.354 175.945 0.409 17865
6355 1 10 . 1 1 73 73 LEU CA C 98 53.927 53.927 52.993 0.934 17865
6356 1 10 . 1 1 73 73 LEU CB C 98 42.272 42.272 44.137 -1.865 17865
6357 1 10 . 1 1 73 73 LEU H H 98 8.850 8.850 7.755 1.095 17865
6358 1 10 . 1 1 74 74 ASP N N 99 122.212 122.212 122.997 -0.785 17865
6359 1 10 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.736 -0.139 17865
6360 1 10 . 1 1 74 74 ASP C C 99 175.819 175.819 175.076 0.743 17865
6361 1 10 . 1 1 74 74 ASP CA C 99 53.856 53.856 54.420 -0.564 17865
6362 1 10 . 1 1 74 74 ASP CB C 99 40.989 40.989 38.932 2.057 17865
6363 1 10 . 1 1 74 74 ASP H H 99 8.517 8.517 8.795 -0.278 17865
6364 1 10 . 1 1 75 75 LEU N N 100 125.874 125.874 120.900 4.974 17865
6365 1 10 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.651 -0.285 17865
6366 1 10 . 1 1 75 75 LEU C C 100 178.426 178.426 178.004 0.422 17865
6367 1 10 . 1 1 75 75 LEU CA C 100 53.631 53.631 55.130 -1.500 17865
6368 1 10 . 1 1 75 75 LEU CB C 100 40.676 40.676 44.398 -3.722 17865
6369 1 10 . 1 1 75 75 LEU H H 100 8.281 8.281 7.912 0.369 17865
6370 1 10 . 1 1 76 76 GLY N N 101 110.604 110.604 109.120 1.484 17865
6371 1 10 . 1 1 76 76 GLY C C 101 176.936 176.936 175.671 1.265 17865
6372 1 10 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.676 0.151 17865
6373 1 10 . 1 1 76 76 GLY H H 101 8.914 8.914 7.978 0.936 17865
6374 1 10 . 1 1 77 77 PHE N N 102 117.639 117.639 117.209 0.430 17865
6375 1 10 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.632 -0.251 17865
6376 1 10 . 1 1 77 77 PHE C C 102 177.878 177.878 176.529 1.349 17865
6377 1 10 . 1 1 77 77 PHE CA C 102 59.139 59.139 59.699 -0.560 17865
6378 1 10 . 1 1 77 77 PHE CB C 102 36.935 36.935 39.175 -2.240 17865
6379 1 10 . 1 1 77 77 PHE H H 102 7.992 7.992 7.873 0.119 17865
6380 1 10 . 1 1 78 78 CYS N N 103 121.136 121.136 116.384 4.752 17865
6381 1 10 . 1 1 78 78 CYS HA H 103 4.385 4.385 5.024 -0.639 17865
6382 1 10 . 1 1 78 78 CYS C C 103 172.780 172.780 176.687 -3.907 17865
6383 1 10 . 1 1 78 78 CYS CA C 103 53.696 53.696 58.134 -4.438 17865
6384 1 10 . 1 1 78 78 CYS CB C 103 34.237 34.237 27.451 6.786 17865
6385 1 10 . 1 1 78 78 CYS H H 103 7.362 7.362 7.864 -0.502 17865
6386 1 10 . 1 1 79 79 THR N N 104 114.773 114.773 116.696 -1.923 17865
6387 1 10 . 1 1 79 79 THR HA H 104 3.984 3.984 4.227 -0.243 17865
6388 1 10 . 1 1 79 79 THR C C 104 176.624 176.624 175.216 1.408 17865
6389 1 10 . 1 1 79 79 THR CA C 104 65.180 65.180 64.399 0.781 17865
6390 1 10 . 1 1 79 79 THR CB C 104 69.062 69.062 68.510 0.552 17865
6391 1 10 . 1 1 79 79 THR H H 104 7.864 7.864 8.402 -0.538 17865
6392 1 10 . 1 1 80 80 LEU N N 105 119.785 119.785 120.367 -0.582 17865
6393 1 10 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.375 -0.044 17865
6394 1 10 . 1 1 80 80 LEU C C 105 177.208 177.208 176.354 0.854 17865
6395 1 10 . 1 1 80 80 LEU CA C 105 55.453 55.453 54.882 0.571 17865
6396 1 10 . 1 1 80 80 LEU CB C 105 41.293 41.293 41.867 -0.574 17865
6397 1 10 . 1 1 80 80 LEU H H 105 7.238 7.238 8.008 -0.770 17865
6398 1 10 . 1 1 81 81 ALA N N 106 119.309 119.309 120.631 -1.322 17865
6399 1 10 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.774 -0.247 17865
6400 1 10 . 1 1 81 81 ALA C C 106 178.769 178.769 175.962 2.807 17865
6401 1 10 . 1 1 81 81 ALA CA C 106 52.049 52.049 51.325 0.724 17865
6402 1 10 . 1 1 81 81 ALA CB C 106 18.820 18.820 21.840 -3.020 17865
6403 1 10 . 1 1 81 81 ALA H H 106 7.432 7.432 7.617 -0.185 17865
6404 1 10 . 1 1 82 82 GLY N N 107 109.793 109.793 106.883 2.910 17865
6405 1 10 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.447 1.672 17865
6406 1 10 . 1 1 82 82 GLY H H 107 7.918 7.918 8.337 -0.419 17865
6407 1 10 . 1 1 83 83 ILE HA H 108 4.266 4.266 4.032 0.234 17865
6408 1 10 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.252 0.011 17865
6409 1 10 . 1 1 83 83 ILE CB C 108 38.261 38.261 38.144 0.117 17865
6410 1 10 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.361 0.394 17865
6411 1 10 . 1 1 84 84 ARG C C 109 181.344 181.344 177.422 3.922 17865
6412 1 10 . 1 1 84 84 ARG CA C 109 55.939 55.939 56.878 -0.939 17865
6413 1 10 . 1 1 84 84 ARG CB C 109 30.283 30.283 28.399 1.884 17865
6414 1 10 . 1 1 85 85 GLU N N 110 122.944 122.944 122.389 0.555 17865
6415 1 10 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.175 -0.558 17865
6416 1 10 . 1 1 85 85 GLU C C 110 177.797 177.797 177.986 -0.189 17865
6417 1 10 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.753 0.975 17865
6418 1 10 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.536 -0.665 17865
6419 1 10 . 1 1 85 85 GLU H H 110 8.003 8.003 7.708 0.295 17865
6420 1 10 . 1 1 86 86 VAL N N 111 117.101 117.101 117.647 -0.546 17865
6421 1 10 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.638 -0.127 17865
6422 1 10 . 1 1 86 86 VAL C C 111 177.710 177.710 178.387 -0.677 17865
6423 1 10 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.006 0.424 17865
6424 1 10 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.554 -0.341 17865
6425 1 10 . 1 1 86 86 VAL H H 111 8.106 8.106 7.659 0.447 17865
6426 1 10 . 1 1 87 87 ASP N N 112 122.242 122.242 119.537 2.705 17865
6427 1 10 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.483 -0.179 17865
6428 1 10 . 1 1 87 87 ASP C C 112 176.912 176.912 177.955 -1.043 17865
6429 1 10 . 1 1 87 87 ASP CA C 112 57.417 57.417 56.532 0.885 17865
6430 1 10 . 1 1 87 87 ASP CB C 112 40.476 40.476 40.956 -0.480 17865
6431 1 10 . 1 1 87 87 ASP H H 112 7.401 7.401 8.124 -0.723 17865
6432 1 10 . 1 1 88 88 CYS N N 113 120.819 120.819 119.464 1.355 17865
6433 1 10 . 1 1 88 88 CYS HA H 113 3.309 3.309 3.972 -0.663 17865
6434 1 10 . 1 1 88 88 CYS C C 113 175.270 175.270 176.383 -1.113 17865
6435 1 10 . 1 1 88 88 CYS CA C 113 59.759 59.759 61.742 -1.983 17865
6436 1 10 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.524 7.311 17865
6437 1 10 . 1 1 88 88 CYS H H 113 7.785 7.785 8.190 -0.405 17865
6438 1 10 . 1 1 89 89 ARG N N 114 118.654 118.654 118.541 0.113 17865
6439 1 10 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.047 -0.406 17865
6440 1 10 . 1 1 89 89 ARG C C 114 179.018 179.018 178.638 0.380 17865
6441 1 10 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.091 1.102 17865
6442 1 10 . 1 1 89 89 ARG CB C 114 29.713 29.713 29.916 -0.203 17865
6443 1 10 . 1 1 89 89 ARG H H 114 8.142 8.142 7.597 0.545 17865
6444 1 10 . 1 1 90 90 LYS N N 115 120.964 120.964 119.058 1.906 17865
6445 1 10 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.123 -0.093 17865
6446 1 10 . 1 1 90 90 LYS C C 115 180.092 180.092 178.737 1.355 17865
6447 1 10 . 1 1 90 90 LYS CA C 115 59.568 59.568 59.116 0.452 17865
6448 1 10 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.501 -0.280 17865
6449 1 10 . 1 1 90 90 LYS H H 115 7.936 7.936 7.617 0.319 17865
6450 1 10 . 1 1 91 91 ASP N N 116 121.690 121.690 119.364 2.326 17865
6451 1 10 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.542 -0.029 17865
6452 1 10 . 1 1 91 91 ASP C C 116 179.419 179.419 178.186 1.233 17865
6453 1 10 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.400 0.837 17865
6454 1 10 . 1 1 91 91 ASP CB C 116 40.648 40.648 41.149 -0.501 17865
6455 1 10 . 1 1 91 91 ASP H H 116 8.558 8.558 7.865 0.693 17865
6456 1 10 . 1 1 92 92 ALA N N 117 122.784 122.784 123.103 -0.319 17865
6457 1 10 . 1 1 92 92 ALA HA H 117 4.023 4.023 3.908 0.115 17865
6458 1 10 . 1 1 92 92 ALA C C 117 178.789 178.789 178.828 -0.039 17865
6459 1 10 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.004 0.047 17865
6460 1 10 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.442 0.733 17865
6461 1 10 . 1 1 92 92 ALA H H 117 8.703 8.703 7.636 1.067 17865
6462 1 10 . 1 1 93 93 GLN N N 118 115.510 115.510 114.446 1.064 17865
6463 1 10 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.033 -0.089 17865
6464 1 10 . 1 1 93 93 GLN C C 118 178.745 178.745 176.911 1.834 17865
6465 1 10 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.370 1.112 17865
6466 1 10 . 1 1 93 93 GLN CB C 118 28.397 28.397 27.857 0.540 17865
6467 1 10 . 1 1 93 93 GLN H H 118 7.664 7.664 8.202 -0.538 17865
6468 1 10 . 1 1 94 94 THR N N 119 110.110 110.110 115.590 -5.480 17865
6469 1 10 . 1 1 94 94 THR HA H 119 4.237 4.237 4.140 0.097 17865
6470 1 10 . 1 1 94 94 THR C C 119 175.861 175.861 175.523 0.338 17865
6471 1 10 . 1 1 94 94 THR CA C 119 64.604 64.604 64.658 -0.054 17865
6472 1 10 . 1 1 94 94 THR CB C 119 69.716 69.716 68.731 0.985 17865
6473 1 10 . 1 1 94 94 THR H H 119 7.726 7.726 7.372 0.354 17865
6474 1 10 . 1 1 95 95 CYS N N 120 118.523 118.523 120.634 -2.111 17865
6475 1 10 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.419 0.314 17865
6476 1 10 . 1 1 95 95 CYS C C 120 175.165 175.165 175.161 0.004 17865
6477 1 10 . 1 1 95 95 CYS CA C 120 52.973 52.973 58.925 -5.952 17865
6478 1 10 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.706 12.025 17865
6479 1 10 . 1 1 95 95 CYS H H 120 7.756 7.756 8.270 -0.514 17865
6480 1 10 . 1 1 96 96 ASP N N 121 119.081 119.081 122.155 -3.074 17865
6481 1 10 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.350 0.328 17865
6482 1 10 . 1 1 96 96 ASP CA C 121 56.224 56.224 57.379 -1.155 17865
6483 1 10 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.205 1.526 17865
6484 1 10 . 1 1 96 96 ASP H H 121 7.354 7.354 8.500 -1.146 17865
6485 1 10 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.505 -0.930 17865
6486 1 10 . 1 1 97 97 LYS C C 122 175.510 175.510 177.273 -1.763 17865
6487 1 10 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.536 0.303 17865
6488 1 10 . 1 1 97 97 LYS CB C 122 30.750 30.750 33.664 -2.914 17865
6489 1 10 . 1 1 98 98 LYS N N 123 119.980 119.980 119.010 0.970 17865
6490 1 10 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.588 -0.294 17865
6491 1 10 . 1 1 98 98 LYS C C 123 176.968 176.968 178.448 -1.480 17865
6492 1 10 . 1 1 98 98 LYS CA C 123 55.904 55.904 57.215 -1.311 17865
6493 1 10 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.792 -0.560 17865
6494 1 10 . 1 1 98 98 LYS H H 123 7.799 7.799 8.255 -0.456 17865
6495 1 10 . 1 1 99 99 TYR N N 124 122.378 122.378 121.743 0.635 17865
6496 1 10 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.350 -0.455 17865
6497 1 10 . 1 1 99 99 TYR C C 124 177.126 177.126 176.776 0.350 17865
6498 1 10 . 1 1 99 99 TYR CA C 124 60.211 60.211 60.284 -0.073 17865
6499 1 10 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.699 -0.428 17865
6500 1 10 . 1 1 99 99 TYR H H 124 8.536 8.536 8.384 0.152 17865
6501 1 10 . 1 1 100 100 GLU N N 125 118.610 118.610 117.293 1.317 17865
6502 1 10 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.196 0.072 17865
6503 1 10 . 1 1 100 100 GLU C C 125 177.387 177.387 177.715 -0.328 17865
6504 1 10 . 1 1 100 100 GLU CA C 125 55.759 55.759 57.049 -1.290 17865
6505 1 10 . 1 1 100 100 GLU CB C 125 27.321 27.321 28.706 -1.385 17865
6506 1 10 . 1 1 100 100 GLU H H 125 8.385 8.385 8.995 -0.610 17865
6507 1 10 . 1 1 101 101 SER N N 126 115.949 115.949 116.244 -0.295 17865
6508 1 10 . 1 1 101 101 SER HA H 126 3.959 3.959 4.146 -0.187 17865
6509 1 10 . 1 1 101 101 SER C C 126 176.047 176.047 176.135 -0.088 17865
6510 1 10 . 1 1 101 101 SER CA C 126 62.439 62.439 61.967 0.472 17865
6511 1 10 . 1 1 101 101 SER CB C 126 63.299 63.299 62.885 0.414 17865
6512 1 10 . 1 1 101 101 SER H H 126 7.823 7.823 7.578 0.245 17865
6513 1 10 . 1 1 102 102 ASP N N 127 120.920 120.920 123.162 -2.242 17865
6514 1 10 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.253 0.154 17865
6515 1 10 . 1 1 102 102 ASP C C 127 178.234 178.234 178.387 -0.153 17865
6516 1 10 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.782 -0.371 17865
6517 1 10 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.105 -0.389 17865
6518 1 10 . 1 1 102 102 ASP H H 127 8.683 8.683 7.974 0.709 17865
6519 1 10 . 1 1 103 103 LYS N N 128 121.753 121.753 118.129 3.624 17865
6520 1 10 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.082 -0.078 17865
6521 1 10 . 1 1 103 103 LYS C C 128 179.395 179.395 178.299 1.096 17865
6522 1 10 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.446 1.025 17865
6523 1 10 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.908 0.493 17865
6524 1 10 . 1 1 103 103 LYS H H 128 7.771 7.771 7.633 0.138 17865
6525 1 10 . 1 1 104 104 CYS N N 129 120.109 120.109 118.636 1.473 17865
6526 1 10 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.325 -0.131 17865
6527 1 10 . 1 1 104 104 CYS C C 129 176.779 176.779 176.670 0.109 17865
6528 1 10 . 1 1 104 104 CYS CA C 129 59.790 59.790 60.449 -0.659 17865
6529 1 10 . 1 1 104 104 CYS CB C 129 36.879 36.879 26.967 9.912 17865
6530 1 10 . 1 1 104 104 CYS H H 129 7.973 7.973 7.621 0.352 17865
6531 1 10 . 1 1 105 105 LEU N N 130 121.804 121.804 122.902 -1.098 17865
6532 1 10 . 1 1 105 105 LEU HA H 130 4.090 4.090 4.012 0.078 17865
6533 1 10 . 1 1 105 105 LEU C C 130 179.373 179.373 179.124 0.249 17865
6534 1 10 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.270 -0.902 17865
6535 1 10 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.998 0.100 17865
6536 1 10 . 1 1 105 105 LEU H H 130 8.666 8.666 8.647 0.019 17865
6537 1 10 . 1 1 106 106 ASN N N 131 118.535 118.535 117.195 1.340 17865
6538 1 10 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.442 -0.204 17865
6539 1 10 . 1 1 106 106 ASN C C 131 177.830 177.830 177.036 0.794 17865
6540 1 10 . 1 1 106 106 ASN CA C 131 56.256 56.256 55.844 0.411 17865
6541 1 10 . 1 1 106 106 ASN CB C 131 37.817 37.817 38.046 -0.229 17865
6542 1 10 . 1 1 106 106 ASN H H 131 8.438 8.438 8.065 0.373 17865
6543 1 10 . 1 1 107 107 ALA N N 132 121.485 121.485 121.603 -0.118 17865
6544 1 10 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.246 -0.027 17865
6545 1 10 . 1 1 107 107 ALA C C 132 180.726 180.726 179.097 1.629 17865
6546 1 10 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.201 0.762 17865
6547 1 10 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.721 -0.900 17865
6548 1 10 . 1 1 107 107 ALA H H 132 7.541 7.541 7.557 -0.016 17865
6549 1 10 . 1 1 108 108 ILE N N 133 120.979 120.979 118.553 2.426 17865
6550 1 10 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.859 0.072 17865
6551 1 10 . 1 1 108 108 ILE C C 133 178.114 178.114 177.764 0.350 17865
6552 1 10 . 1 1 108 108 ILE CA C 133 63.353 63.353 63.511 -0.159 17865
6553 1 10 . 1 1 108 108 ILE CB C 133 36.454 36.454 37.307 -0.853 17865
6554 1 10 . 1 1 108 108 ILE H H 133 7.551 7.551 7.532 0.019 17865
6555 1 10 . 1 1 109 109 LYS N N 134 121.415 121.415 118.829 2.586 17865
6556 1 10 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.271 -0.683 17865
6557 1 10 . 1 1 109 109 LYS C C 134 179.561 179.561 178.366 1.195 17865
6558 1 10 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.241 0.867 17865
6559 1 10 . 1 1 109 109 LYS CB C 134 32.161 32.161 31.859 0.302 17865
6560 1 10 . 1 1 109 109 LYS H H 134 8.414 8.414 7.705 0.709 17865
6561 1 10 . 1 1 110 110 GLU N N 135 116.099 116.099 117.930 -1.831 17865
6562 1 10 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.146 -0.217 17865
6563 1 10 . 1 1 110 110 GLU C C 135 178.239 178.239 177.000 1.239 17865
6564 1 10 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.677 -0.031 17865
6565 1 10 . 1 1 110 110 GLU CB C 135 29.638 29.638 28.763 0.875 17865
6566 1 10 . 1 1 110 110 GLU H H 135 7.473 7.473 7.787 -0.314 17865
6567 1 10 . 1 1 111 111 LYS N N 136 119.805 119.805 115.999 3.806 17865
6568 1 10 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.030 -0.124 17865
6569 1 10 . 1 1 111 111 LYS C C 136 177.600 177.600 177.184 0.416 17865
6570 1 10 . 1 1 111 111 LYS CA C 136 58.749 58.749 57.420 1.329 17865
6571 1 10 . 1 1 111 111 LYS CB C 136 33.238 33.238 31.899 1.339 17865
6572 1 10 . 1 1 111 111 LYS H H 136 7.540 7.540 7.690 -0.150 17865
6573 1 10 . 1 1 112 112 TYR N N 137 114.768 114.768 116.403 -1.635 17865
6574 1 10 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.370 0.153 17865
6575 1 10 . 1 1 112 112 TYR C C 137 174.690 174.690 175.560 -0.870 17865
6576 1 10 . 1 1 112 112 TYR CA C 137 58.359 58.359 59.219 -0.860 17865
6577 1 10 . 1 1 112 112 TYR CB C 137 38.328 38.328 39.609 -1.281 17865
6578 1 10 . 1 1 112 112 TYR H H 137 7.488 7.488 7.480 0.008 17865
6579 1 10 . 1 1 113 113 LYS N N 138 123.694 123.694 120.530 3.164 17865
6580 1 10 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.655 -0.154 17865
6581 1 10 . 1 1 113 113 LYS CA C 138 55.282 55.282 53.350 1.932 17865
6582 1 10 . 1 1 113 113 LYS CB C 138 32.124 32.124 31.974 0.149 17865
6583 1 10 . 1 1 113 113 LYS H H 138 7.217 7.217 7.923 -0.706 17865
6584 1 10 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.410 0.042 17865
6585 1 10 . 1 1 114 114 PRO C C 139 176.974 176.974 176.188 0.786 17865
6586 1 10 . 1 1 114 114 PRO CA C 139 63.189 63.189 63.392 -0.204 17865
6587 1 10 . 1 1 114 114 PRO CB C 139 32.251 32.251 31.446 0.805 17865
6588 1 10 . 1 1 115 115 VAL N N 140 121.098 121.098 119.659 1.439 17865
6589 1 10 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.444 -0.342 17865
6590 1 10 . 1 1 115 115 VAL C C 140 176.207 176.207 174.844 1.363 17865
6591 1 10 . 1 1 115 115 VAL CA C 140 62.356 62.356 61.469 0.887 17865
6592 1 10 . 1 1 115 115 VAL CB C 140 33.256 33.256 32.649 0.607 17865
6593 1 10 . 1 1 115 115 VAL H H 140 8.272 8.272 8.027 0.245 17865
6594 1 10 . 1 1 116 116 VAL N N 141 124.167 124.167 119.881 4.286 17865
6595 1 10 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.374 -0.252 17865
6596 1 10 . 1 1 116 116 VAL C C 141 175.415 175.415 175.022 0.393 17865
6597 1 10 . 1 1 116 116 VAL CA C 141 61.731 61.731 61.464 0.267 17865
6598 1 10 . 1 1 116 116 VAL CB C 141 33.145 33.145 33.042 0.103 17865
6599 1 10 . 1 1 116 116 VAL H H 141 8.142 8.142 7.479 0.663 17865
6600 1 10 . 1 1 117 117 ASP N N 142 126.737 126.737 128.179 -1.442 17865
6601 1 10 . 1 1 117 117 ASP HA H 142 4.812 4.812 5.018 -0.206 17865
6602 1 10 . 1 1 117 117 ASP CA C 142 52.217 52.217 52.597 -0.380 17865
6603 1 10 . 1 1 117 117 ASP CB C 142 41.368 41.368 41.073 0.295 17865
6604 1 10 . 1 1 117 117 ASP H H 142 8.419 8.419 8.611 -0.192 17865
6605 1 10 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.405 0.006 17865
6606 1 10 . 1 1 118 118 PRO C C 143 176.662 176.662 176.179 0.483 17865
6607 1 10 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.819 -0.572 17865
6608 1 10 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.268 0.042 17865
6609 1 10 . 1 1 119 119 ASN N N 144 119.287 119.287 116.140 3.147 17865
6610 1 10 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.949 -0.002 17865
6611 1 10 . 1 1 119 119 ASN CA C 144 51.633 51.633 51.551 0.082 17865
6612 1 10 . 1 1 119 119 ASN CB C 144 38.859 38.859 40.096 -1.238 17865
6613 1 10 . 1 1 119 119 ASN H H 144 8.432 8.432 8.055 0.377 17865
6614 1 10 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.569 0.111 17865
6615 1 10 . 1 1 120 120 PRO CA C 145 61.640 61.640 62.191 -0.551 17865
6616 1 10 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.543 -0.625 17865
6617 1 10 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.304 0.073 17865
6618 1 10 . 1 1 121 121 PRO C C 146 175.876 175.876 176.158 -0.282 17865
6619 1 10 . 1 1 121 121 PRO CA C 146 63.174 63.174 63.583 -0.409 17865
6620 1 10 . 1 1 121 121 PRO CB C 146 31.939 31.939 31.806 0.133 17865
6621 1 11 . 1 1 2 2 ASP N N 27 121.041 121.041 122.059 -1.018 17865
6622 1 11 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.713 -0.075 17865
6623 1 11 . 1 1 2 2 ASP C C 27 175.878 175.878 175.700 0.178 17865
6624 1 11 . 1 1 2 2 ASP CA C 27 54.382 54.382 54.016 0.366 17865
6625 1 11 . 1 1 2 2 ASP CB C 27 41.729 41.729 40.559 1.170 17865
6626 1 11 . 1 1 2 2 ASP H H 27 8.639 8.639 8.323 0.316 17865
6627 1 11 . 1 1 3 3 VAL N N 28 119.901 119.901 121.597 -1.696 17865
6628 1 11 . 1 1 3 3 VAL HA H 28 4.033 4.033 3.847 0.186 17865
6629 1 11 . 1 1 3 3 VAL C C 28 175.521 175.521 174.702 0.819 17865
6630 1 11 . 1 1 3 3 VAL CA C 28 62.216 62.216 63.568 -1.351 17865
6631 1 11 . 1 1 3 3 VAL CB C 28 33.003 33.003 31.836 1.167 17865
6632 1 11 . 1 1 3 3 VAL H H 28 8.113 8.113 7.753 0.360 17865
6633 1 11 . 1 1 4 4 PHE N N 29 123.707 123.707 121.136 2.571 17865
6634 1 11 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.916 -0.260 17865
6635 1 11 . 1 1 4 4 PHE C C 29 174.874 174.874 174.520 0.354 17865
6636 1 11 . 1 1 4 4 PHE CA C 29 57.159 57.159 55.792 1.367 17865
6637 1 11 . 1 1 4 4 PHE CB C 29 39.795 39.795 40.498 -0.703 17865
6638 1 11 . 1 1 4 4 PHE H H 29 8.255 8.255 7.755 0.500 17865
6639 1 11 . 1 1 5 5 ASP N N 30 124.203 124.203 123.111 1.092 17865
6640 1 11 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.779 0.059 17865
6641 1 11 . 1 1 5 5 ASP CA C 30 52.385 52.385 50.461 1.924 17865
6642 1 11 . 1 1 5 5 ASP CB C 30 40.801 40.801 41.737 -0.936 17865
6643 1 11 . 1 1 5 5 ASP H H 30 8.226 8.226 8.518 -0.292 17865
6644 1 11 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.630 -0.093 17865
6645 1 11 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.108 -0.444 17865
6646 1 11 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.562 -0.736 17865
6647 1 11 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.473 -0.047 17865
6648 1 11 . 1 1 7 7 PRO C C 32 177.226 177.226 176.783 0.443 17865
6649 1 11 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.548 -0.379 17865
6650 1 11 . 1 1 7 7 PRO CB C 32 31.948 31.948 31.767 0.181 17865
6651 1 11 . 1 1 8 8 THR N N 33 114.158 114.158 119.367 -5.209 17865
6652 1 11 . 1 1 8 8 THR HA H 33 4.195 4.195 4.513 -0.318 17865
6653 1 11 . 1 1 8 8 THR C C 33 174.468 174.468 173.824 0.644 17865
6654 1 11 . 1 1 8 8 THR CA C 33 62.110 62.110 61.776 0.334 17865
6655 1 11 . 1 1 8 8 THR CB C 33 69.975 69.975 69.838 0.136 17865
6656 1 11 . 1 1 8 8 THR H H 33 8.096 8.096 8.283 -0.187 17865
6657 1 11 . 1 1 9 9 GLN N N 34 122.411 122.411 126.380 -3.969 17865
6658 1 11 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.252 0.011 17865
6659 1 11 . 1 1 9 9 GLN C C 34 175.445 175.445 174.659 0.786 17865
6660 1 11 . 1 1 9 9 GLN CA C 34 55.763 55.763 55.163 0.600 17865
6661 1 11 . 1 1 9 9 GLN CB C 34 29.691 29.691 29.536 0.155 17865
6662 1 11 . 1 1 9 9 GLN H H 34 8.278 8.278 8.493 -0.215 17865
6663 1 11 . 1 1 10 10 TYR N N 35 121.048 121.048 120.077 0.971 17865
6664 1 11 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.395 0.125 17865
6665 1 11 . 1 1 10 10 TYR C C 35 176.314 176.314 174.863 1.451 17865
6666 1 11 . 1 1 10 10 TYR CA C 35 57.972 57.972 56.785 1.187 17865
6667 1 11 . 1 1 10 10 TYR CB C 35 38.936 38.936 39.193 -0.257 17865
6668 1 11 . 1 1 10 10 TYR H H 35 8.227 8.227 7.790 0.437 17865
6669 1 11 . 1 1 11 11 GLY N N 36 109.711 109.711 110.935 -1.224 17865
6670 1 11 . 1 1 11 11 GLY C C 36 174.128 174.128 172.993 1.135 17865
6671 1 11 . 1 1 11 11 GLY CA C 36 45.212 45.212 44.741 0.471 17865
6672 1 11 . 1 1 11 11 GLY H H 36 8.247 8.247 8.113 0.134 17865
6673 1 11 . 1 1 12 12 TYR N N 37 120.302 120.302 116.315 3.987 17865
6674 1 11 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.791 -0.309 17865
6675 1 11 . 1 1 12 12 TYR C C 37 175.864 175.864 174.136 1.728 17865
6676 1 11 . 1 1 12 12 TYR CA C 37 58.541 58.541 53.442 5.099 17865
6677 1 11 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.907 -1.192 17865
6678 1 11 . 1 1 12 12 TYR H H 37 8.101 8.101 6.809 1.292 17865
6679 1 11 . 1 1 13 13 ASP N N 38 121.883 121.883 121.556 0.327 17865
6680 1 11 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.674 -0.188 17865
6681 1 11 . 1 1 13 13 ASP C C 38 176.538 176.538 176.860 -0.322 17865
6682 1 11 . 1 1 13 13 ASP CA C 38 54.223 54.223 54.677 -0.454 17865
6683 1 11 . 1 1 13 13 ASP CB C 38 40.988 40.988 40.587 0.401 17865
6684 1 11 . 1 1 13 13 ASP H H 38 8.266 8.266 8.637 -0.371 17865
6685 1 11 . 1 1 14 14 GLY N N 39 107.705 107.705 115.307 -7.602 17865
6686 1 11 . 1 1 14 14 GLY C C 39 173.822 173.822 172.887 0.935 17865
6687 1 11 . 1 1 14 14 GLY CA C 39 45.404 45.404 44.736 0.668 17865
6688 1 11 . 1 1 14 14 GLY H H 39 7.647 7.647 8.063 -0.416 17865
6689 1 11 . 1 1 15 15 LYS N N 40 121.621 121.621 122.096 -0.475 17865
6690 1 11 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.467 0.108 17865
6691 1 11 . 1 1 15 15 LYS CA C 40 54.100 54.100 53.649 0.451 17865
6692 1 11 . 1 1 15 15 LYS CB C 40 32.510 32.510 35.118 -2.608 17865
6693 1 11 . 1 1 15 15 LYS H H 40 7.908 7.908 8.563 -0.655 17865
6694 1 11 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.638 -0.286 17865
6695 1 11 . 1 1 16 16 PRO C C 41 176.806 176.806 176.153 0.653 17865
6696 1 11 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.614 0.144 17865
6697 1 11 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.752 -0.438 17865
6698 1 11 . 1 1 17 17 LEU N N 42 123.488 123.488 122.827 0.661 17865
6699 1 11 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.488 -0.439 17865
6700 1 11 . 1 1 17 17 LEU C C 42 174.973 174.973 175.851 -0.878 17865
6701 1 11 . 1 1 17 17 LEU CA C 42 55.436 55.436 55.994 -0.558 17865
6702 1 11 . 1 1 17 17 LEU CB C 42 42.093 42.093 41.434 0.659 17865
6703 1 11 . 1 1 17 17 LEU H H 42 8.499 8.499 8.666 -0.167 17865
6704 1 11 . 1 1 18 18 ASP N N 43 123.354 123.354 124.633 -1.279 17865
6705 1 11 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.752 -0.254 17865
6706 1 11 . 1 1 18 18 ASP C C 43 175.947 175.947 176.588 -0.641 17865
6707 1 11 . 1 1 18 18 ASP CA C 43 52.858 52.858 53.000 -0.142 17865
6708 1 11 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.430 -2.209 17865
6709 1 11 . 1 1 18 18 ASP H H 43 7.789 7.789 7.852 -0.063 17865
6710 1 11 . 1 1 19 19 ALA N N 44 120.147 120.147 122.687 -2.540 17865
6711 1 11 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.131 -0.145 17865
6712 1 11 . 1 1 19 19 ALA C C 44 179.476 179.476 178.668 0.808 17865
6713 1 11 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.312 0.851 17865
6714 1 11 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.716 -0.330 17865
6715 1 11 . 1 1 19 19 ALA H H 44 8.561 8.561 8.542 0.019 17865
6716 1 11 . 1 1 20 20 SER N N 45 115.037 115.037 114.610 0.427 17865
6717 1 11 . 1 1 20 20 SER HA H 45 4.151 4.151 4.005 0.146 17865
6718 1 11 . 1 1 20 20 SER C C 45 177.191 177.191 176.306 0.885 17865
6719 1 11 . 1 1 20 20 SER CA C 45 61.629 61.629 62.040 -0.411 17865
6720 1 11 . 1 1 20 20 SER CB C 45 62.804 62.804 62.730 0.074 17865
6721 1 11 . 1 1 20 20 SER H H 45 8.466 8.466 8.074 0.392 17865
6722 1 11 . 1 1 21 21 PHE N N 46 125.030 125.030 119.583 5.447 17865
6723 1 11 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.425 -0.194 17865
6724 1 11 . 1 1 21 21 PHE C C 46 176.850 176.850 178.559 -1.709 17865
6725 1 11 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.381 0.425 17865
6726 1 11 . 1 1 21 21 PHE CB C 46 39.881 39.881 38.495 1.386 17865
6727 1 11 . 1 1 21 21 PHE H H 46 8.034 8.034 7.407 0.627 17865
6728 1 11 . 1 1 22 22 CYS N N 47 113.943 113.943 118.175 -4.232 17865
6729 1 11 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.138 0.113 17865
6730 1 11 . 1 1 22 22 CYS C C 47 176.449 176.449 176.376 0.073 17865
6731 1 11 . 1 1 22 22 CYS CA C 47 53.600 53.600 61.747 -8.147 17865
6732 1 11 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.282 11.110 17865
6733 1 11 . 1 1 22 22 CYS H H 47 7.691 7.691 8.064 -0.373 17865
6734 1 11 . 1 1 23 23 ARG N N 48 119.958 119.958 120.451 -0.493 17865
6735 1 11 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.099 -0.019 17865
6736 1 11 . 1 1 23 23 ARG C C 48 177.904 177.904 177.557 0.347 17865
6737 1 11 . 1 1 23 23 ARG CA C 48 58.907 58.907 59.359 -0.452 17865
6738 1 11 . 1 1 23 23 ARG CB C 48 30.171 30.171 30.029 0.142 17865
6739 1 11 . 1 1 23 23 ARG H H 48 7.628 7.628 8.349 -0.721 17865
6740 1 11 . 1 1 24 24 THR N N 49 106.445 106.445 114.589 -8.144 17865
6741 1 11 . 1 1 24 24 THR HA H 49 4.385 4.385 4.229 0.156 17865
6742 1 11 . 1 1 24 24 THR C C 49 174.758 174.758 175.010 -0.252 17865
6743 1 11 . 1 1 24 24 THR CA C 49 61.573 61.573 64.444 -2.871 17865
6744 1 11 . 1 1 24 24 THR CB C 49 68.794 68.794 68.702 0.092 17865
6745 1 11 . 1 1 24 24 THR H H 49 7.307 7.307 7.488 -0.181 17865
6746 1 11 . 1 1 25 25 ALA N N 50 122.242 122.242 122.291 -0.049 17865
6747 1 11 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.255 0.149 17865
6748 1 11 . 1 1 25 25 ALA C C 50 178.554 178.554 177.831 0.723 17865
6749 1 11 . 1 1 25 25 ALA CA C 50 52.381 52.381 53.054 -0.673 17865
6750 1 11 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.818 -1.423 17865
6751 1 11 . 1 1 25 25 ALA H H 50 7.401 7.401 7.290 0.111 17865
6752 1 11 . 1 1 26 26 GLY N N 51 110.604 110.604 106.869 3.735 17865
6753 1 11 . 1 1 26 26 GLY CA C 51 47.022 47.022 45.346 1.675 17865
6754 1 11 . 1 1 26 26 GLY H H 51 8.285 8.285 7.833 0.452 17865
6755 1 11 . 1 1 27 27 SER HA H 52 4.382 4.382 4.196 0.186 17865
6756 1 11 . 1 1 27 27 SER C C 52 175.774 175.774 175.973 -0.199 17865
6757 1 11 . 1 1 27 27 SER CA C 52 60.803 60.803 60.106 0.697 17865
6758 1 11 . 1 1 27 27 SER CB C 52 62.827 62.827 62.900 -0.073 17865
6759 1 11 . 1 1 28 28 ARG N N 53 119.682 119.682 119.664 0.018 17865
6760 1 11 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.212 0.668 17865
6761 1 11 . 1 1 28 28 ARG C C 53 175.796 175.796 177.504 -1.708 17865
6762 1 11 . 1 1 28 28 ARG CA C 53 55.738 55.738 56.721 -0.983 17865
6763 1 11 . 1 1 28 28 ARG CB C 53 30.237 30.237 29.204 1.033 17865
6764 1 11 . 1 1 28 28 ARG H H 53 7.894 7.894 8.425 -0.531 17865
6765 1 11 . 1 1 29 29 GLU N N 54 122.318 122.318 121.094 1.224 17865
6766 1 11 . 1 1 29 29 GLU HA H 54 3.595 3.595 3.851 -0.256 17865
6767 1 11 . 1 1 29 29 GLU C C 54 177.523 177.523 177.949 -0.426 17865
6768 1 11 . 1 1 29 29 GLU CA C 54 61.223 61.223 59.768 1.455 17865
6769 1 11 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.278 -0.341 17865
6770 1 11 . 1 1 29 29 GLU H H 54 7.730 7.730 8.045 -0.315 17865
6771 1 11 . 1 1 30 30 LYS N N 55 118.377 118.377 118.072 0.305 17865
6772 1 11 . 1 1 30 30 LYS HA H 55 3.828 3.828 3.964 -0.136 17865
6773 1 11 . 1 1 30 30 LYS C C 55 179.205 179.205 178.996 0.209 17865
6774 1 11 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.413 1.014 17865
6775 1 11 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.170 -0.569 17865
6776 1 11 . 1 1 30 30 LYS H H 55 8.659 8.659 7.676 0.983 17865
6777 1 11 . 1 1 31 31 ASP N N 56 121.614 121.614 119.633 1.981 17865
6778 1 11 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.535 -0.224 17865
6779 1 11 . 1 1 31 31 ASP C C 56 177.393 177.393 177.040 0.353 17865
6780 1 11 . 1 1 31 31 ASP CA C 56 57.316 57.316 56.795 0.521 17865
6781 1 11 . 1 1 31 31 ASP CB C 56 40.423 40.423 41.363 -0.940 17865
6782 1 11 . 1 1 31 31 ASP H H 56 7.646 7.646 7.957 -0.311 17865
6783 1 11 . 1 1 32 32 CYS N N 57 120.345 120.345 120.221 0.124 17865
6784 1 11 . 1 1 32 32 CYS HA H 57 3.601 3.601 4.007 -0.406 17865
6785 1 11 . 1 1 32 32 CYS C C 57 175.772 175.772 176.454 -0.682 17865
6786 1 11 . 1 1 32 32 CYS CA C 57 60.197 60.197 61.081 -0.884 17865
6787 1 11 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.645 8.320 17865
6788 1 11 . 1 1 32 32 CYS H H 57 8.042 8.042 8.004 0.038 17865
6789 1 11 . 1 1 33 33 ARG N N 58 120.293 120.293 118.573 1.720 17865
6790 1 11 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.888 -0.212 17865
6791 1 11 . 1 1 33 33 ARG C C 58 179.633 179.633 178.567 1.066 17865
6792 1 11 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.104 1.282 17865
6793 1 11 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.244 0.597 17865
6794 1 11 . 1 1 33 33 ARG H H 58 8.531 8.531 8.593 -0.062 17865
6795 1 11 . 1 1 34 34 LYS N N 59 121.166 121.166 119.384 1.782 17865
6796 1 11 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.202 -0.166 17865
6797 1 11 . 1 1 34 34 LYS C C 59 179.220 179.220 178.425 0.795 17865
6798 1 11 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.490 1.040 17865
6799 1 11 . 1 1 34 34 LYS CB C 59 32.110 32.110 32.332 -0.222 17865
6800 1 11 . 1 1 34 34 LYS H H 59 7.633 7.633 7.517 0.116 17865
6801 1 11 . 1 1 35 35 ASP N N 60 122.166 122.166 119.851 2.315 17865
6802 1 11 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.446 -0.015 17865
6803 1 11 . 1 1 35 35 ASP C C 60 179.709 179.709 178.557 1.152 17865
6804 1 11 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.010 0.693 17865
6805 1 11 . 1 1 35 35 ASP CB C 60 40.672 40.672 40.889 -0.216 17865
6806 1 11 . 1 1 35 35 ASP H H 60 8.221 8.221 7.579 0.642 17865
6807 1 11 . 1 1 36 36 VAL N N 61 121.312 121.312 118.765 2.547 17865
6808 1 11 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.734 -0.333 17865
6809 1 11 . 1 1 36 36 VAL C C 61 178.339 178.339 177.649 0.690 17865
6810 1 11 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.912 1.221 17865
6811 1 11 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.944 -0.287 17865
6812 1 11 . 1 1 36 36 VAL H H 61 8.916 8.916 8.163 0.753 17865
6813 1 11 . 1 1 37 37 GLN N N 62 119.166 119.166 117.914 1.252 17865
6814 1 11 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.227 -0.285 17865
6815 1 11 . 1 1 37 37 GLN C C 62 177.293 177.293 176.757 0.536 17865
6816 1 11 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.505 0.775 17865
6817 1 11 . 1 1 37 37 GLN CB C 62 28.371 28.371 29.076 -0.705 17865
6818 1 11 . 1 1 37 37 GLN H H 62 7.697 7.697 7.552 0.145 17865
6819 1 11 . 1 1 38 38 ALA N N 63 118.964 118.964 121.604 -2.640 17865
6820 1 11 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.351 -0.109 17865
6821 1 11 . 1 1 38 38 ALA C C 63 177.221 177.221 176.841 0.380 17865
6822 1 11 . 1 1 38 38 ALA CA C 63 53.137 53.137 52.108 1.029 17865
6823 1 11 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.068 -0.171 17865
6824 1 11 . 1 1 38 38 ALA H H 63 7.508 7.508 7.521 -0.013 17865
6825 1 11 . 1 1 39 39 CYS N N 64 119.081 119.081 118.574 0.507 17865
6826 1 11 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.631 0.322 17865
6827 1 11 . 1 1 39 39 CYS C C 64 172.052 172.052 174.901 -2.849 17865
6828 1 11 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.750 -6.870 17865
6829 1 11 . 1 1 39 39 CYS CB C 64 34.328 34.328 28.589 5.739 17865
6830 1 11 . 1 1 39 39 CYS H H 64 7.354 7.354 7.374 -0.020 17865
6831 1 11 . 1 1 40 40 ASP N N 65 124.167 124.167 126.327 -2.160 17865
6832 1 11 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.538 -0.213 17865
6833 1 11 . 1 1 40 40 ASP C C 65 176.496 176.496 176.493 0.003 17865
6834 1 11 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.429 0.295 17865
6835 1 11 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.435 -0.122 17865
6836 1 11 . 1 1 40 40 ASP H H 65 8.142 8.142 8.768 -0.626 17865
6837 1 11 . 1 1 41 41 LYS N N 66 118.844 118.844 121.366 -2.522 17865
6838 1 11 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.544 -0.020 17865
6839 1 11 . 1 1 41 41 LYS C C 66 175.586 175.586 176.295 -0.709 17865
6840 1 11 . 1 1 41 41 LYS CA C 66 55.275 55.275 55.639 -0.364 17865
6841 1 11 . 1 1 41 41 LYS CB C 66 32.598 32.598 32.309 0.289 17865
6842 1 11 . 1 1 41 41 LYS H H 66 7.858 7.858 8.438 -0.580 17865
6843 1 11 . 1 1 42 42 LYS N N 67 126.081 126.081 122.261 3.820 17865
6844 1 11 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.184 -0.269 17865
6845 1 11 . 1 1 42 42 LYS C C 67 174.665 174.665 175.206 -0.541 17865
6846 1 11 . 1 1 42 42 LYS CA C 67 57.827 57.827 57.138 0.689 17865
6847 1 11 . 1 1 42 42 LYS CB C 67 34.059 34.059 33.127 0.932 17865
6848 1 11 . 1 1 42 42 LYS H H 67 8.790 8.790 8.598 0.192 17865
6849 1 11 . 1 1 43 43 TYR N N 68 114.138 114.138 116.135 -1.997 17865
6850 1 11 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.863 0.396 17865
6851 1 11 . 1 1 43 43 TYR C C 68 175.767 175.767 174.408 1.359 17865
6852 1 11 . 1 1 43 43 TYR CA C 68 55.880 55.880 57.056 -1.176 17865
6853 1 11 . 1 1 43 43 TYR CB C 68 42.363 42.363 41.974 0.389 17865
6854 1 11 . 1 1 43 43 TYR H H 68 7.294 7.294 7.393 -0.099 17865
6855 1 11 . 1 1 44 44 ASP N N 69 121.807 121.807 121.808 -0.001 17865
6856 1 11 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.772 -0.132 17865
6857 1 11 . 1 1 44 44 ASP C C 69 177.812 177.812 177.648 0.164 17865
6858 1 11 . 1 1 44 44 ASP CA C 69 52.110 52.110 53.715 -1.605 17865
6859 1 11 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.753 -2.313 17865
6860 1 11 . 1 1 44 44 ASP H H 69 8.995 8.995 8.884 0.111 17865
6861 1 11 . 1 1 45 45 ASP N N 70 116.686 116.686 120.897 -4.211 17865
6862 1 11 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.494 -0.070 17865
6863 1 11 . 1 1 45 45 ASP C C 70 177.054 177.054 177.349 -0.295 17865
6864 1 11 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.443 -0.062 17865
6865 1 11 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.849 -0.601 17865
6866 1 11 . 1 1 45 45 ASP H H 70 8.369 8.369 8.769 -0.400 17865
6867 1 11 . 1 1 46 46 GLN N N 71 117.949 117.949 117.425 0.524 17865
6868 1 11 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.355 0.101 17865
6869 1 11 . 1 1 46 46 GLN C C 71 176.273 176.273 176.771 -0.498 17865
6870 1 11 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.614 -0.247 17865
6871 1 11 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.124 0.206 17865
6872 1 11 . 1 1 46 46 GLN H H 71 8.274 8.274 8.171 0.103 17865
6873 1 11 . 1 1 47 47 GLY N N 72 108.369 108.369 106.353 2.016 17865
6874 1 11 . 1 1 47 47 GLY C C 72 174.145 174.145 174.073 0.072 17865
6875 1 11 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.372 0.451 17865
6876 1 11 . 1 1 47 47 GLY H H 72 8.174 8.174 7.930 0.244 17865
6877 1 11 . 1 1 48 48 ARG N N 73 121.554 121.554 118.964 2.590 17865
6878 1 11 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.708 -0.223 17865
6879 1 11 . 1 1 48 48 ARG C C 73 176.855 176.855 175.443 1.412 17865
6880 1 11 . 1 1 48 48 ARG CA C 73 55.289 55.289 53.554 1.735 17865
6881 1 11 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.900 -1.342 17865
6882 1 11 . 1 1 48 48 ARG H H 73 8.462 8.462 8.109 0.353 17865
6883 1 11 . 1 1 49 49 GLU N N 74 122.784 122.784 120.269 2.515 17865
6884 1 11 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.185 0.298 17865
6885 1 11 . 1 1 49 49 GLU C C 74 178.098 178.098 177.028 1.070 17865
6886 1 11 . 1 1 49 49 GLU CA C 74 57.184 57.184 57.419 -0.235 17865
6887 1 11 . 1 1 49 49 GLU CB C 74 30.777 30.777 30.034 0.743 17865
6888 1 11 . 1 1 49 49 GLU H H 74 8.703 8.703 8.607 0.096 17865
6889 1 11 . 1 1 50 50 THR N N 75 114.563 114.563 112.266 2.297 17865
6890 1 11 . 1 1 50 50 THR HA H 75 4.212 4.212 4.502 -0.290 17865
6891 1 11 . 1 1 50 50 THR C C 75 175.170 175.170 175.034 0.136 17865
6892 1 11 . 1 1 50 50 THR CA C 75 60.589 60.589 60.183 0.406 17865
6893 1 11 . 1 1 50 50 THR CB C 75 70.952 70.952 71.423 -0.471 17865
6894 1 11 . 1 1 50 50 THR H H 75 7.717 7.717 8.258 -0.541 17865
6895 1 11 . 1 1 51 51 ALA N N 76 122.097 122.097 123.616 -1.519 17865
6896 1 11 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.068 -0.030 17865
6897 1 11 . 1 1 51 51 ALA C C 76 181.906 181.906 179.252 2.654 17865
6898 1 11 . 1 1 51 51 ALA CA C 76 55.654 55.654 54.905 0.749 17865
6899 1 11 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.269 -0.276 17865
6900 1 11 . 1 1 51 51 ALA H H 76 8.734 8.734 8.643 0.092 17865
6901 1 11 . 1 1 52 52 CYS N N 77 115.347 115.347 116.679 -1.332 17865
6902 1 11 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.247 0.233 17865
6903 1 11 . 1 1 52 52 CYS C C 77 176.299 176.299 176.747 -0.448 17865
6904 1 11 . 1 1 52 52 CYS CA C 77 57.701 57.701 60.061 -2.360 17865
6905 1 11 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.737 9.894 17865
6906 1 11 . 1 1 52 52 CYS H H 77 9.073 9.073 8.100 0.973 17865
6907 1 11 . 1 1 53 53 ALA N N 78 128.517 128.517 123.243 5.274 17865
6908 1 11 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.777 0.078 17865
6909 1 11 . 1 1 53 53 ALA C C 78 178.736 178.736 178.957 -0.221 17865
6910 1 11 . 1 1 53 53 ALA CA C 78 55.633 55.633 54.963 0.670 17865
6911 1 11 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.809 1.382 17865
6912 1 11 . 1 1 53 53 ALA H H 78 7.174 7.174 7.779 -0.605 17865
6913 1 11 . 1 1 54 54 LYS N N 79 118.706 118.706 118.816 -0.110 17865
6914 1 11 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.075 -0.272 17865
6915 1 11 . 1 1 54 54 LYS C C 79 179.611 179.611 178.872 0.739 17865
6916 1 11 . 1 1 54 54 LYS CA C 79 59.725 59.725 59.145 0.580 17865
6917 1 11 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.263 0.390 17865
6918 1 11 . 1 1 54 54 LYS H H 79 8.313 8.313 7.780 0.533 17865
6919 1 11 . 1 1 55 55 GLY N N 80 104.822 104.822 106.624 -1.802 17865
6920 1 11 . 1 1 55 55 GLY C C 80 176.504 176.504 176.269 0.235 17865
6921 1 11 . 1 1 55 55 GLY CA C 80 46.839 46.839 46.906 -0.066 17865
6922 1 11 . 1 1 55 55 GLY H H 80 8.175 8.175 7.721 0.454 17865
6923 1 11 . 1 1 56 56 ILE N N 81 123.697 123.697 122.351 1.346 17865
6924 1 11 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.763 0.032 17865
6925 1 11 . 1 1 56 56 ILE C C 81 177.334 177.334 177.347 -0.013 17865
6926 1 11 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.290 0.991 17865
6927 1 11 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.965 0.370 17865
6928 1 11 . 1 1 56 56 ILE H H 81 7.590 7.590 6.970 0.620 17865
6929 1 11 . 1 1 57 57 ARG N N 82 118.161 118.161 119.308 -1.147 17865
6930 1 11 . 1 1 57 57 ARG HA H 82 3.935 3.935 3.954 -0.019 17865
6931 1 11 . 1 1 57 57 ARG C C 82 178.662 178.662 178.234 0.428 17865
6932 1 11 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.270 0.431 17865
6933 1 11 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.471 0.428 17865
6934 1 11 . 1 1 57 57 ARG H H 82 7.569 7.569 7.601 -0.032 17865
6935 1 11 . 1 1 58 58 GLU N N 83 115.085 115.085 119.249 -4.164 17865
6936 1 11 . 1 1 58 58 GLU HA H 83 4.031 4.031 3.908 0.123 17865
6937 1 11 . 1 1 58 58 GLU C C 83 178.224 178.224 178.514 -0.290 17865
6938 1 11 . 1 1 58 58 GLU CA C 83 58.304 58.304 59.164 -0.860 17865
6939 1 11 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.137 0.894 17865
6940 1 11 . 1 1 58 58 GLU H H 83 7.786 7.786 8.015 -0.229 17865
6941 1 11 . 1 1 59 59 LYS N N 84 119.183 119.183 118.719 0.464 17865
6942 1 11 . 1 1 59 59 LYS HA H 84 3.830 3.830 3.896 -0.066 17865
6943 1 11 . 1 1 59 59 LYS C C 84 177.933 177.933 177.417 0.516 17865
6944 1 11 . 1 1 59 59 LYS CA C 84 59.043 59.043 58.501 0.542 17865
6945 1 11 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.908 0.742 17865
6946 1 11 . 1 1 59 59 LYS H H 84 7.968 7.968 7.692 0.276 17865
6947 1 11 . 1 1 60 60 TYR N N 85 113.663 113.663 115.147 -1.484 17865
6948 1 11 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.670 0.033 17865
6949 1 11 . 1 1 60 60 TYR C C 85 174.729 174.729 175.984 -1.255 17865
6950 1 11 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.810 0.392 17865
6951 1 11 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.809 0.093 17865
6952 1 11 . 1 1 60 60 TYR H H 85 7.562 7.562 7.832 -0.270 17865
6953 1 11 . 1 1 61 61 LYS N N 86 121.862 121.862 122.167 -0.305 17865
6954 1 11 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.348 0.164 17865
6955 1 11 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.057 -0.115 17865
6956 1 11 . 1 1 61 61 LYS CB C 86 32.102 32.102 31.336 0.766 17865
6957 1 11 . 1 1 61 61 LYS H H 86 7.222 7.222 7.594 -0.372 17865
6958 1 11 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.316 0.007 17865
6959 1 11 . 1 1 62 62 PRO C C 87 176.576 176.576 175.929 0.647 17865
6960 1 11 . 1 1 62 62 PRO CA C 87 63.020 63.020 63.147 -0.127 17865
6961 1 11 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.136 0.104 17865
6962 1 11 . 1 1 63 63 ALA N N 88 125.029 125.029 123.044 1.985 17865
6963 1 11 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.208 0.046 17865
6964 1 11 . 1 1 63 63 ALA C C 88 177.301 177.301 176.570 0.731 17865
6965 1 11 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.486 -0.206 17865
6966 1 11 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.913 1.289 17865
6967 1 11 . 1 1 63 63 ALA H H 88 8.329 8.329 8.389 -0.060 17865
6968 1 11 . 1 1 64 64 VAL N N 89 121.843 121.843 122.426 -0.583 17865
6969 1 11 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.209 -0.265 17865
6970 1 11 . 1 1 64 64 VAL C C 89 174.791 174.791 174.149 0.642 17865
6971 1 11 . 1 1 64 64 VAL CA C 89 61.981 61.981 61.012 0.969 17865
6972 1 11 . 1 1 64 64 VAL CB C 89 33.485 33.485 35.113 -1.628 17865
6973 1 11 . 1 1 64 64 VAL H H 89 8.075 8.075 7.838 0.237 17865
6974 1 11 . 1 1 65 65 VAL N N 90 125.399 125.399 124.622 0.777 17865
6975 1 11 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.383 -0.245 17865
6976 1 11 . 1 1 65 65 VAL C C 90 174.340 174.340 174.229 0.111 17865
6977 1 11 . 1 1 65 65 VAL CA C 90 61.162 61.162 61.449 -0.287 17865
6978 1 11 . 1 1 65 65 VAL CB C 90 33.866 33.866 32.419 1.447 17865
6979 1 11 . 1 1 65 65 VAL H H 90 8.229 8.229 8.119 0.110 17865
6980 1 11 . 1 1 66 66 TYR N N 91 124.848 124.848 127.401 -2.553 17865
6981 1 11 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.686 0.085 17865
6982 1 11 . 1 1 66 66 TYR C C 91 176.658 176.658 176.067 0.591 17865
6983 1 11 . 1 1 66 66 TYR CA C 91 58.084 58.084 57.690 0.394 17865
6984 1 11 . 1 1 66 66 TYR CB C 91 41.535 41.535 41.253 0.282 17865
6985 1 11 . 1 1 66 66 TYR H H 91 9.145 9.145 8.239 0.906 17865
6986 1 11 . 1 1 67 67 GLY N N 92 106.185 106.185 107.285 -1.100 17865
6987 1 11 . 1 1 67 67 GLY C C 92 175.681 175.681 175.161 0.520 17865
6988 1 11 . 1 1 67 67 GLY CA C 92 43.975 43.975 44.049 -0.074 17865
6989 1 11 . 1 1 67 67 GLY H H 92 8.730 8.730 8.468 0.262 17865
6990 1 11 . 1 1 68 68 TYR N N 93 121.815 121.815 120.127 1.688 17865
6991 1 11 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.253 -0.278 17865
6992 1 11 . 1 1 68 68 TYR C C 93 176.035 176.035 176.177 -0.142 17865
6993 1 11 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.589 1.457 17865
6994 1 11 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.069 0.356 17865
6995 1 11 . 1 1 68 68 TYR H H 93 8.711 8.711 8.724 -0.013 17865
6996 1 11 . 1 1 69 69 ASP N N 94 115.507 115.507 118.846 -3.339 17865
6997 1 11 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.303 -0.015 17865
6998 1 11 . 1 1 69 69 ASP C C 94 177.063 177.063 177.491 -0.428 17865
6999 1 11 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.852 -0.841 17865
7000 1 11 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.607 -0.440 17865
7001 1 11 . 1 1 69 69 ASP H H 94 8.010 8.010 7.493 0.517 17865
7002 1 11 . 1 1 70 70 GLY N N 95 107.196 107.196 107.630 -0.434 17865
7003 1 11 . 1 1 70 70 GLY C C 95 173.936 173.936 174.059 -0.123 17865
7004 1 11 . 1 1 70 70 GLY CA C 95 45.392 45.392 44.848 0.544 17865
7005 1 11 . 1 1 70 70 GLY H H 95 7.986 7.986 8.039 -0.053 17865
7006 1 11 . 1 1 71 71 LYS N N 96 121.258 121.258 122.015 -0.757 17865
7007 1 11 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.461 0.323 17865
7008 1 11 . 1 1 71 71 LYS CA C 96 54.114 54.114 54.079 0.035 17865
7009 1 11 . 1 1 71 71 LYS CB C 96 31.762 31.762 32.271 -0.509 17865
7010 1 11 . 1 1 71 71 LYS H H 96 7.877 7.877 7.531 0.346 17865
7011 1 11 . 1 1 72 72 PRO C C 97 177.170 177.170 175.330 1.840 17865
7012 1 11 . 1 1 72 72 PRO CA C 97 63.137 63.137 63.022 0.115 17865
7013 1 11 . 1 1 72 72 PRO CB C 97 32.240 32.240 29.725 2.515 17865
7014 1 11 . 1 1 73 73 LEU N N 98 123.503 123.503 119.670 3.833 17865
7015 1 11 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.694 -0.334 17865
7016 1 11 . 1 1 73 73 LEU C C 98 176.354 176.354 175.546 0.808 17865
7017 1 11 . 1 1 73 73 LEU CA C 98 53.927 53.927 53.714 0.213 17865
7018 1 11 . 1 1 73 73 LEU CB C 98 42.272 42.272 43.477 -1.205 17865
7019 1 11 . 1 1 73 73 LEU H H 98 8.850 8.850 7.687 1.163 17865
7020 1 11 . 1 1 74 74 ASP N N 99 122.212 122.212 122.660 -0.448 17865
7021 1 11 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.839 -0.242 17865
7022 1 11 . 1 1 74 74 ASP C C 99 175.819 175.819 176.341 -0.522 17865
7023 1 11 . 1 1 74 74 ASP CA C 99 53.856 53.856 53.184 0.671 17865
7024 1 11 . 1 1 74 74 ASP CB C 99 40.989 40.989 42.942 -1.953 17865
7025 1 11 . 1 1 74 74 ASP H H 99 8.517 8.517 8.224 0.293 17865
7026 1 11 . 1 1 75 75 LEU N N 100 125.874 125.874 113.599 12.275 17865
7027 1 11 . 1 1 75 75 LEU HA H 100 4.366 4.366 3.626 0.740 17865
7028 1 11 . 1 1 75 75 LEU C C 100 178.426 178.426 178.946 -0.520 17865
7029 1 11 . 1 1 75 75 LEU CA C 100 53.631 53.631 56.400 -2.769 17865
7030 1 11 . 1 1 75 75 LEU CB C 100 40.676 40.676 40.409 0.267 17865
7031 1 11 . 1 1 75 75 LEU H H 100 8.281 8.281 8.506 -0.225 17865
7032 1 11 . 1 1 76 76 GLY N N 101 110.604 110.604 108.224 2.380 17865
7033 1 11 . 1 1 76 76 GLY C C 101 176.936 176.936 175.416 1.520 17865
7034 1 11 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.680 0.147 17865
7035 1 11 . 1 1 76 76 GLY H H 101 8.914 8.914 8.807 0.107 17865
7036 1 11 . 1 1 77 77 PHE N N 102 117.639 117.639 115.545 2.094 17865
7037 1 11 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.954 -0.573 17865
7038 1 11 . 1 1 77 77 PHE C C 102 177.878 177.878 175.626 2.252 17865
7039 1 11 . 1 1 77 77 PHE CA C 102 59.139 59.139 56.820 2.319 17865
7040 1 11 . 1 1 77 77 PHE CB C 102 36.935 36.935 38.637 -1.702 17865
7041 1 11 . 1 1 77 77 PHE H H 102 7.992 7.992 7.449 0.543 17865
7042 1 11 . 1 1 78 78 CYS N N 103 121.136 121.136 117.988 3.148 17865
7043 1 11 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.567 -0.182 17865
7044 1 11 . 1 1 78 78 CYS C C 103 172.780 172.780 176.469 -3.689 17865
7045 1 11 . 1 1 78 78 CYS CA C 103 53.696 53.696 58.589 -4.893 17865
7046 1 11 . 1 1 78 78 CYS CB C 103 34.237 34.237 28.370 5.867 17865
7047 1 11 . 1 1 78 78 CYS H H 103 7.362 7.362 8.312 -0.950 17865
7048 1 11 . 1 1 79 79 THR N N 104 114.773 114.773 118.800 -4.027 17865
7049 1 11 . 1 1 79 79 THR HA H 104 3.984 3.984 4.094 -0.110 17865
7050 1 11 . 1 1 79 79 THR C C 104 176.624 176.624 175.366 1.258 17865
7051 1 11 . 1 1 79 79 THR CA C 104 65.180 65.180 65.242 -0.062 17865
7052 1 11 . 1 1 79 79 THR CB C 104 69.062 69.062 68.537 0.525 17865
7053 1 11 . 1 1 79 79 THR H H 104 7.864 7.864 8.172 -0.308 17865
7054 1 11 . 1 1 80 80 LEU N N 105 119.785 119.785 119.798 -0.013 17865
7055 1 11 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.224 0.107 17865
7056 1 11 . 1 1 80 80 LEU C C 105 177.208 177.208 177.505 -0.297 17865
7057 1 11 . 1 1 80 80 LEU CA C 105 55.453 55.453 56.544 -1.091 17865
7058 1 11 . 1 1 80 80 LEU CB C 105 41.293 41.293 40.358 0.935 17865
7059 1 11 . 1 1 80 80 LEU H H 105 7.238 7.238 7.990 -0.752 17865
7060 1 11 . 1 1 81 81 ALA N N 106 119.309 119.309 121.623 -2.314 17865
7061 1 11 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.428 0.099 17865
7062 1 11 . 1 1 81 81 ALA C C 106 178.769 178.769 177.116 1.653 17865
7063 1 11 . 1 1 81 81 ALA CA C 106 52.049 52.049 52.551 -0.502 17865
7064 1 11 . 1 1 81 81 ALA CB C 106 18.820 18.820 19.807 -0.987 17865
7065 1 11 . 1 1 81 81 ALA H H 106 7.432 7.432 7.814 -0.382 17865
7066 1 11 . 1 1 82 82 GLY N N 107 109.793 109.793 106.373 3.420 17865
7067 1 11 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.352 1.767 17865
7068 1 11 . 1 1 82 82 GLY H H 107 7.918 7.918 8.126 -0.208 17865
7069 1 11 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.921 0.345 17865
7070 1 11 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.519 -0.256 17865
7071 1 11 . 1 1 83 83 ILE CB C 108 38.261 38.261 38.147 0.114 17865
7072 1 11 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.250 0.505 17865
7073 1 11 . 1 1 84 84 ARG C C 109 181.344 181.344 177.862 3.482 17865
7074 1 11 . 1 1 84 84 ARG CA C 109 55.939 55.939 57.357 -1.418 17865
7075 1 11 . 1 1 84 84 ARG CB C 109 30.283 30.283 29.817 0.466 17865
7076 1 11 . 1 1 85 85 GLU N N 110 122.944 122.944 120.947 1.997 17865
7077 1 11 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.417 -0.800 17865
7078 1 11 . 1 1 85 85 GLU C C 110 177.797 177.797 179.050 -1.253 17865
7079 1 11 . 1 1 85 85 GLU CA C 110 60.728 60.728 58.987 1.741 17865
7080 1 11 . 1 1 85 85 GLU CB C 110 28.871 28.871 28.947 -0.076 17865
7081 1 11 . 1 1 85 85 GLU H H 110 8.003 8.003 7.918 0.085 17865
7082 1 11 . 1 1 86 86 VAL N N 111 117.101 117.101 119.406 -2.305 17865
7083 1 11 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.639 -0.128 17865
7084 1 11 . 1 1 86 86 VAL C C 111 177.710 177.710 177.965 -0.255 17865
7085 1 11 . 1 1 86 86 VAL CA C 111 66.430 66.430 65.876 0.554 17865
7086 1 11 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.252 -0.039 17865
7087 1 11 . 1 1 86 86 VAL H H 111 8.106 8.106 7.472 0.634 17865
7088 1 11 . 1 1 87 87 ASP N N 112 122.242 122.242 120.355 1.887 17865
7089 1 11 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.502 -0.198 17865
7090 1 11 . 1 1 87 87 ASP C C 112 176.912 176.912 178.462 -1.550 17865
7091 1 11 . 1 1 87 87 ASP CA C 112 57.417 57.417 57.540 -0.123 17865
7092 1 11 . 1 1 87 87 ASP CB C 112 40.476 40.476 40.770 -0.294 17865
7093 1 11 . 1 1 87 87 ASP H H 112 7.401 7.401 7.832 -0.430 17865
7094 1 11 . 1 1 88 88 CYS N N 113 120.819 120.819 118.027 2.792 17865
7095 1 11 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.066 -0.757 17865
7096 1 11 . 1 1 88 88 CYS C C 113 175.270 175.270 176.513 -1.243 17865
7097 1 11 . 1 1 88 88 CYS CA C 113 59.759 59.759 62.176 -2.417 17865
7098 1 11 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.004 7.831 17865
7099 1 11 . 1 1 88 88 CYS H H 113 7.785 7.785 8.440 -0.655 17865
7100 1 11 . 1 1 89 89 ARG N N 114 118.654 118.654 121.603 -2.949 17865
7101 1 11 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.027 -0.386 17865
7102 1 11 . 1 1 89 89 ARG C C 114 179.018 179.018 178.127 0.891 17865
7103 1 11 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.278 0.915 17865
7104 1 11 . 1 1 89 89 ARG CB C 114 29.713 29.713 29.573 0.140 17865
7105 1 11 . 1 1 89 89 ARG H H 114 8.142 8.142 8.094 0.048 17865
7106 1 11 . 1 1 90 90 LYS N N 115 120.964 120.964 116.799 4.165 17865
7107 1 11 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.143 -0.113 17865
7108 1 11 . 1 1 90 90 LYS C C 115 180.092 180.092 177.953 2.139 17865
7109 1 11 . 1 1 90 90 LYS CA C 115 59.568 59.568 59.076 0.492 17865
7110 1 11 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.328 -0.107 17865
7111 1 11 . 1 1 90 90 LYS H H 115 7.936 7.936 7.685 0.251 17865
7112 1 11 . 1 1 91 91 ASP N N 116 121.690 121.690 118.705 2.985 17865
7113 1 11 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.721 -0.208 17865
7114 1 11 . 1 1 91 91 ASP C C 116 179.419 179.419 177.959 1.460 17865
7115 1 11 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.810 0.427 17865
7116 1 11 . 1 1 91 91 ASP CB C 116 40.648 40.648 41.466 -0.818 17865
7117 1 11 . 1 1 91 91 ASP H H 116 8.558 8.558 7.675 0.883 17865
7118 1 11 . 1 1 92 92 ALA N N 117 122.784 122.784 123.686 -0.902 17865
7119 1 11 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.110 -0.087 17865
7120 1 11 . 1 1 92 92 ALA C C 117 178.789 178.789 179.694 -0.905 17865
7121 1 11 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.111 -0.060 17865
7122 1 11 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.666 0.509 17865
7123 1 11 . 1 1 92 92 ALA H H 117 8.703 8.703 8.616 0.087 17865
7124 1 11 . 1 1 93 93 GLN N N 118 115.510 115.510 114.658 0.852 17865
7125 1 11 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.144 -0.200 17865
7126 1 11 . 1 1 93 93 GLN C C 118 178.745 178.745 177.200 1.545 17865
7127 1 11 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.602 0.880 17865
7128 1 11 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.453 -0.056 17865
7129 1 11 . 1 1 93 93 GLN H H 118 7.664 7.664 7.867 -0.203 17865
7130 1 11 . 1 1 94 94 THR N N 119 110.110 110.110 109.266 0.844 17865
7131 1 11 . 1 1 94 94 THR HA H 119 4.237 4.237 4.369 -0.132 17865
7132 1 11 . 1 1 94 94 THR C C 119 175.861 175.861 174.406 1.455 17865
7133 1 11 . 1 1 94 94 THR CA C 119 64.604 64.604 63.127 1.478 17865
7134 1 11 . 1 1 94 94 THR CB C 119 69.716 69.716 69.538 0.178 17865
7135 1 11 . 1 1 94 94 THR H H 119 7.726 7.726 7.892 -0.166 17865
7136 1 11 . 1 1 95 95 CYS N N 120 118.523 118.523 122.606 -4.083 17865
7137 1 11 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.667 0.066 17865
7138 1 11 . 1 1 95 95 CYS C C 120 175.165 175.165 175.476 -0.311 17865
7139 1 11 . 1 1 95 95 CYS CA C 120 52.973 52.973 58.804 -5.831 17865
7140 1 11 . 1 1 95 95 CYS CB C 120 36.731 36.731 25.595 11.136 17865
7141 1 11 . 1 1 95 95 CYS H H 120 7.756 7.756 7.811 -0.055 17865
7142 1 11 . 1 1 96 96 ASP N N 121 119.081 119.081 122.452 -3.371 17865
7143 1 11 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.380 0.298 17865
7144 1 11 . 1 1 96 96 ASP CA C 121 56.224 56.224 57.172 -0.948 17865
7145 1 11 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.230 1.502 17865
7146 1 11 . 1 1 96 96 ASP H H 121 7.354 7.354 8.262 -0.908 17865
7147 1 11 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.457 -0.882 17865
7148 1 11 . 1 1 97 97 LYS C C 122 175.510 175.510 176.915 -1.405 17865
7149 1 11 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.366 0.473 17865
7150 1 11 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.804 -4.054 17865
7151 1 11 . 1 1 98 98 LYS N N 123 119.980 119.980 118.153 1.827 17865
7152 1 11 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.547 -0.253 17865
7153 1 11 . 1 1 98 98 LYS C C 123 176.968 176.968 177.635 -0.667 17865
7154 1 11 . 1 1 98 98 LYS CA C 123 55.904 55.904 56.178 -0.274 17865
7155 1 11 . 1 1 98 98 LYS CB C 123 33.232 33.232 32.940 0.292 17865
7156 1 11 . 1 1 98 98 LYS H H 123 7.799 7.799 8.153 -0.354 17865
7157 1 11 . 1 1 99 99 TYR N N 124 122.378 122.378 123.944 -1.566 17865
7158 1 11 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.239 -0.344 17865
7159 1 11 . 1 1 99 99 TYR C C 124 177.126 177.126 176.396 0.730 17865
7160 1 11 . 1 1 99 99 TYR CA C 124 60.211 60.211 61.135 -0.924 17865
7161 1 11 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.886 -0.615 17865
7162 1 11 . 1 1 99 99 TYR H H 124 8.536 8.536 7.836 0.700 17865
7163 1 11 . 1 1 100 100 GLU N N 125 118.610 118.610 116.991 1.619 17865
7164 1 11 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.443 -0.175 17865
7165 1 11 . 1 1 100 100 GLU C C 125 177.387 177.387 176.134 1.253 17865
7166 1 11 . 1 1 100 100 GLU CA C 125 55.759 55.759 55.655 0.104 17865
7167 1 11 . 1 1 100 100 GLU CB C 125 27.321 27.321 30.120 -2.799 17865
7168 1 11 . 1 1 100 100 GLU H H 125 8.385 8.385 7.945 0.440 17865
7169 1 11 . 1 1 101 101 SER N N 126 115.949 115.949 116.854 -0.905 17865
7170 1 11 . 1 1 101 101 SER HA H 126 3.959 3.959 4.115 -0.156 17865
7171 1 11 . 1 1 101 101 SER C C 126 176.047 176.047 176.120 -0.073 17865
7172 1 11 . 1 1 101 101 SER CA C 126 62.439 62.439 62.109 0.330 17865
7173 1 11 . 1 1 101 101 SER CB C 126 63.299 63.299 63.130 0.169 17865
7174 1 11 . 1 1 101 101 SER H H 126 7.823 7.823 8.376 -0.553 17865
7175 1 11 . 1 1 102 102 ASP N N 127 120.920 120.920 119.736 1.184 17865
7176 1 11 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.268 0.139 17865
7177 1 11 . 1 1 102 102 ASP C C 127 178.234 178.234 177.673 0.561 17865
7178 1 11 . 1 1 102 102 ASP CA C 127 57.411 57.411 58.082 -0.671 17865
7179 1 11 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.777 -1.061 17865
7180 1 11 . 1 1 102 102 ASP H H 127 8.683 8.683 8.891 -0.208 17865
7181 1 11 . 1 1 103 103 LYS N N 128 121.753 121.753 117.286 4.467 17865
7182 1 11 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.101 -0.097 17865
7183 1 11 . 1 1 103 103 LYS C C 128 179.395 179.395 178.466 0.929 17865
7184 1 11 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.555 0.916 17865
7185 1 11 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.759 0.642 17865
7186 1 11 . 1 1 103 103 LYS H H 128 7.771 7.771 8.004 -0.233 17865
7187 1 11 . 1 1 104 104 CYS N N 129 120.109 120.109 119.134 0.975 17865
7188 1 11 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.285 -0.091 17865
7189 1 11 . 1 1 104 104 CYS C C 129 176.779 176.779 176.744 0.035 17865
7190 1 11 . 1 1 104 104 CYS CA C 129 59.790 59.790 61.743 -1.953 17865
7191 1 11 . 1 1 104 104 CYS CB C 129 36.879 36.879 25.965 10.914 17865
7192 1 11 . 1 1 104 104 CYS H H 129 7.973 7.973 7.924 0.049 17865
7193 1 11 . 1 1 105 105 LEU N N 130 121.804 121.804 122.459 -0.655 17865
7194 1 11 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.907 0.183 17865
7195 1 11 . 1 1 105 105 LEU C C 130 179.373 179.373 178.322 1.051 17865
7196 1 11 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.331 -0.963 17865
7197 1 11 . 1 1 105 105 LEU CB C 130 42.098 42.098 42.103 -0.005 17865
7198 1 11 . 1 1 105 105 LEU H H 130 8.666 8.666 8.497 0.169 17865
7199 1 11 . 1 1 106 106 ASN N N 131 118.535 118.535 117.217 1.318 17865
7200 1 11 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.397 -0.159 17865
7201 1 11 . 1 1 106 106 ASN C C 131 177.830 177.830 177.724 0.106 17865
7202 1 11 . 1 1 106 106 ASN CA C 131 56.256 56.256 56.568 -0.312 17865
7203 1 11 . 1 1 106 106 ASN CB C 131 37.817 37.817 38.363 -0.546 17865
7204 1 11 . 1 1 106 106 ASN H H 131 8.438 8.438 7.859 0.579 17865
7205 1 11 . 1 1 107 107 ALA N N 132 121.485 121.485 121.736 -0.251 17865
7206 1 11 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.412 -0.193 17865
7207 1 11 . 1 1 107 107 ALA C C 132 180.726 180.726 178.910 1.816 17865
7208 1 11 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.529 0.434 17865
7209 1 11 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.783 -0.962 17865
7210 1 11 . 1 1 107 107 ALA H H 132 7.541 7.541 7.966 -0.425 17865
7211 1 11 . 1 1 108 108 ILE N N 133 120.979 120.979 119.561 1.418 17865
7212 1 11 . 1 1 108 108 ILE HA H 133 3.931 3.931 4.098 -0.167 17865
7213 1 11 . 1 1 108 108 ILE C C 133 178.114 178.114 177.521 0.593 17865
7214 1 11 . 1 1 108 108 ILE CA C 133 63.353 63.353 62.597 0.756 17865
7215 1 11 . 1 1 108 108 ILE CB C 133 36.454 36.454 37.577 -1.123 17865
7216 1 11 . 1 1 108 108 ILE H H 133 7.551 7.551 7.499 0.052 17865
7217 1 11 . 1 1 109 109 LYS N N 134 121.415 121.415 120.020 1.395 17865
7218 1 11 . 1 1 109 109 LYS HA H 134 3.588 3.588 3.988 -0.400 17865
7219 1 11 . 1 1 109 109 LYS C C 134 179.561 179.561 178.107 1.454 17865
7220 1 11 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.714 0.394 17865
7221 1 11 . 1 1 109 109 LYS CB C 134 32.161 32.161 31.921 0.240 17865
7222 1 11 . 1 1 109 109 LYS H H 134 8.414 8.414 8.124 0.290 17865
7223 1 11 . 1 1 110 110 GLU N N 135 116.099 116.099 118.066 -1.967 17865
7224 1 11 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.133 -0.204 17865
7225 1 11 . 1 1 110 110 GLU C C 135 178.239 178.239 179.512 -1.273 17865
7226 1 11 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.752 -0.106 17865
7227 1 11 . 1 1 110 110 GLU CB C 135 29.638 29.638 29.240 0.398 17865
7228 1 11 . 1 1 110 110 GLU H H 135 7.473 7.473 7.812 -0.339 17865
7229 1 11 . 1 1 111 111 LYS N N 136 119.805 119.805 119.163 0.642 17865
7230 1 11 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.106 -0.200 17865
7231 1 11 . 1 1 111 111 LYS C C 136 177.600 177.600 177.821 -0.221 17865
7232 1 11 . 1 1 111 111 LYS CA C 136 58.749 58.749 58.149 0.600 17865
7233 1 11 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.937 0.301 17865
7234 1 11 . 1 1 111 111 LYS H H 136 7.540 7.540 7.638 -0.098 17865
7235 1 11 . 1 1 112 112 TYR N N 137 114.768 114.768 116.289 -1.521 17865
7236 1 11 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.573 -0.050 17865
7237 1 11 . 1 1 112 112 TYR C C 137 174.690 174.690 175.007 -0.317 17865
7238 1 11 . 1 1 112 112 TYR CA C 137 58.359 58.359 57.330 1.029 17865
7239 1 11 . 1 1 112 112 TYR CB C 137 38.328 38.328 37.365 0.963 17865
7240 1 11 . 1 1 112 112 TYR H H 137 7.488 7.488 8.190 -0.702 17865
7241 1 11 . 1 1 113 113 LYS N N 138 123.694 123.694 122.581 1.113 17865
7242 1 11 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.458 0.043 17865
7243 1 11 . 1 1 113 113 LYS CA C 138 55.282 55.282 54.920 0.362 17865
7244 1 11 . 1 1 113 113 LYS CB C 138 32.124 32.124 31.699 0.425 17865
7245 1 11 . 1 1 113 113 LYS H H 138 7.217 7.217 7.316 -0.099 17865
7246 1 11 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.521 -0.069 17865
7247 1 11 . 1 1 114 114 PRO C C 139 176.974 176.974 175.894 1.080 17865
7248 1 11 . 1 1 114 114 PRO CA C 139 63.189 63.189 62.576 0.613 17865
7249 1 11 . 1 1 114 114 PRO CB C 139 32.251 32.251 30.496 1.755 17865
7250 1 11 . 1 1 115 115 VAL N N 140 121.098 121.098 121.716 -0.618 17865
7251 1 11 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.252 -0.150 17865
7252 1 11 . 1 1 115 115 VAL C C 140 176.207 176.207 175.317 0.890 17865
7253 1 11 . 1 1 115 115 VAL CA C 140 62.356 62.356 62.547 -0.191 17865
7254 1 11 . 1 1 115 115 VAL CB C 140 33.256 33.256 31.264 1.992 17865
7255 1 11 . 1 1 115 115 VAL H H 140 8.272 8.272 7.848 0.424 17865
7256 1 11 . 1 1 116 116 VAL N N 141 124.167 124.167 127.494 -3.327 17865
7257 1 11 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.335 -0.213 17865
7258 1 11 . 1 1 116 116 VAL C C 141 175.415 175.415 176.097 -0.682 17865
7259 1 11 . 1 1 116 116 VAL CA C 141 61.731 61.731 60.856 0.875 17865
7260 1 11 . 1 1 116 116 VAL CB C 141 33.145 33.145 33.375 -0.230 17865
7261 1 11 . 1 1 116 116 VAL H H 141 8.142 8.142 7.985 0.157 17865
7262 1 11 . 1 1 117 117 ASP N N 142 126.737 126.737 123.436 3.301 17865
7263 1 11 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.645 0.167 17865
7264 1 11 . 1 1 117 117 ASP CA C 142 52.217 52.217 53.779 -1.562 17865
7265 1 11 . 1 1 117 117 ASP CB C 142 41.368 41.368 40.626 0.742 17865
7266 1 11 . 1 1 117 117 ASP H H 142 8.419 8.419 8.302 0.117 17865
7267 1 11 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.358 0.053 17865
7268 1 11 . 1 1 118 118 PRO C C 143 176.662 176.662 176.637 0.025 17865
7269 1 11 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.083 0.164 17865
7270 1 11 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.342 -0.032 17865
7271 1 11 . 1 1 119 119 ASN N N 144 119.287 119.287 119.243 0.044 17865
7272 1 11 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.808 0.139 17865
7273 1 11 . 1 1 119 119 ASN CA C 144 51.633 51.633 52.402 -0.769 17865
7274 1 11 . 1 1 119 119 ASN CB C 144 38.859 38.859 38.522 0.337 17865
7275 1 11 . 1 1 119 119 ASN H H 144 8.432 8.432 8.398 0.034 17865
7276 1 11 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.583 0.097 17865
7277 1 11 . 1 1 120 120 PRO CA C 145 61.640 61.640 62.393 -0.753 17865
7278 1 11 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.130 -0.211 17865
7279 1 11 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.390 -0.013 17865
7280 1 11 . 1 1 121 121 PRO C C 146 175.876 175.876 176.747 -0.871 17865
7281 1 11 . 1 1 121 121 PRO CA C 146 63.174 63.174 62.747 0.427 17865
7282 1 11 . 1 1 121 121 PRO CB C 146 31.939 31.939 32.332 -0.393 17865
7283 1 12 . 1 1 2 2 ASP N N 27 121.041 121.041 120.402 0.639 17865
7284 1 12 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.788 -0.150 17865
7285 1 12 . 1 1 2 2 ASP C C 27 175.878 175.878 175.068 0.810 17865
7286 1 12 . 1 1 2 2 ASP CA C 27 54.382 54.382 54.470 -0.088 17865
7287 1 12 . 1 1 2 2 ASP CB C 27 41.729 41.729 40.916 0.813 17865
7288 1 12 . 1 1 2 2 ASP H H 27 8.639 8.639 8.315 0.324 17865
7289 1 12 . 1 1 3 3 VAL N N 28 119.901 119.901 120.935 -1.034 17865
7290 1 12 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.150 -0.117 17865
7291 1 12 . 1 1 3 3 VAL C C 28 175.521 175.521 175.384 0.137 17865
7292 1 12 . 1 1 3 3 VAL CA C 28 62.216 62.216 62.297 -0.081 17865
7293 1 12 . 1 1 3 3 VAL CB C 28 33.003 33.003 30.295 2.708 17865
7294 1 12 . 1 1 3 3 VAL H H 28 8.113 8.113 8.208 -0.095 17865
7295 1 12 . 1 1 4 4 PHE N N 29 123.707 123.707 124.702 -0.995 17865
7296 1 12 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.705 -0.049 17865
7297 1 12 . 1 1 4 4 PHE C C 29 174.874 174.874 173.893 0.981 17865
7298 1 12 . 1 1 4 4 PHE CA C 29 57.159 57.159 56.667 0.492 17865
7299 1 12 . 1 1 4 4 PHE CB C 29 39.795 39.795 40.350 -0.555 17865
7300 1 12 . 1 1 4 4 PHE H H 29 8.255 8.255 7.753 0.501 17865
7301 1 12 . 1 1 5 5 ASP N N 30 124.203 124.203 123.054 1.149 17865
7302 1 12 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.737 0.101 17865
7303 1 12 . 1 1 5 5 ASP CA C 30 52.385 52.385 52.946 -0.561 17865
7304 1 12 . 1 1 5 5 ASP CB C 30 40.801 40.801 41.622 -0.821 17865
7305 1 12 . 1 1 5 5 ASP H H 30 8.226 8.226 8.533 -0.307 17865
7306 1 12 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.378 0.159 17865
7307 1 12 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.175 -0.511 17865
7308 1 12 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.617 -0.791 17865
7309 1 12 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.480 -0.054 17865
7310 1 12 . 1 1 7 7 PRO C C 32 177.226 177.226 176.674 0.552 17865
7311 1 12 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.188 -0.019 17865
7312 1 12 . 1 1 7 7 PRO CB C 32 31.948 31.948 32.121 -0.173 17865
7313 1 12 . 1 1 8 8 THR N N 33 114.158 114.158 117.548 -3.390 17865
7314 1 12 . 1 1 8 8 THR HA H 33 4.195 4.195 4.101 0.094 17865
7315 1 12 . 1 1 8 8 THR C C 33 174.468 174.468 174.883 -0.415 17865
7316 1 12 . 1 1 8 8 THR CA C 33 62.110 62.110 62.943 -0.833 17865
7317 1 12 . 1 1 8 8 THR CB C 33 69.975 69.975 69.074 0.901 17865
7318 1 12 . 1 1 8 8 THR H H 33 8.096 8.096 8.346 -0.250 17865
7319 1 12 . 1 1 9 9 GLN N N 34 122.411 122.411 125.222 -2.811 17865
7320 1 12 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.256 0.007 17865
7321 1 12 . 1 1 9 9 GLN C C 34 175.445 175.445 176.132 -0.687 17865
7322 1 12 . 1 1 9 9 GLN CA C 34 55.763 55.763 55.776 -0.013 17865
7323 1 12 . 1 1 9 9 GLN CB C 34 29.691 29.691 29.067 0.624 17865
7324 1 12 . 1 1 9 9 GLN H H 34 8.278 8.278 8.114 0.164 17865
7325 1 12 . 1 1 10 10 TYR N N 35 121.048 121.048 117.215 3.833 17865
7326 1 12 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.532 -0.012 17865
7327 1 12 . 1 1 10 10 TYR C C 35 176.314 176.314 176.150 0.164 17865
7328 1 12 . 1 1 10 10 TYR CA C 35 57.972 57.972 58.099 -0.127 17865
7329 1 12 . 1 1 10 10 TYR CB C 35 38.936 38.936 39.611 -0.675 17865
7330 1 12 . 1 1 10 10 TYR H H 35 8.227 8.227 7.296 0.931 17865
7331 1 12 . 1 1 11 11 GLY N N 36 109.711 109.711 106.833 2.878 17865
7332 1 12 . 1 1 11 11 GLY C C 36 174.128 174.128 174.436 -0.308 17865
7333 1 12 . 1 1 11 11 GLY CA C 36 45.212 45.212 46.189 -0.977 17865
7334 1 12 . 1 1 11 11 GLY H H 36 8.247 8.247 7.895 0.352 17865
7335 1 12 . 1 1 12 12 TYR N N 37 120.302 120.302 121.180 -0.878 17865
7336 1 12 . 1 1 12 12 TYR HA H 37 4.482 4.482 5.028 -0.546 17865
7337 1 12 . 1 1 12 12 TYR C C 37 175.864 175.864 175.111 0.753 17865
7338 1 12 . 1 1 12 12 TYR CA C 37 58.541 58.541 56.797 1.744 17865
7339 1 12 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.807 -1.092 17865
7340 1 12 . 1 1 12 12 TYR H H 37 8.101 8.101 7.801 0.300 17865
7341 1 12 . 1 1 13 13 ASP N N 38 121.883 121.883 117.413 4.470 17865
7342 1 12 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.699 -0.213 17865
7343 1 12 . 1 1 13 13 ASP C C 38 176.538 176.538 176.493 0.045 17865
7344 1 12 . 1 1 13 13 ASP CA C 38 54.223 54.223 54.378 -0.155 17865
7345 1 12 . 1 1 13 13 ASP CB C 38 40.988 40.988 43.080 -2.092 17865
7346 1 12 . 1 1 13 13 ASP H H 38 8.266 8.266 7.428 0.838 17865
7347 1 12 . 1 1 14 14 GLY N N 39 107.705 107.705 111.749 -4.044 17865
7348 1 12 . 1 1 14 14 GLY C C 39 173.822 173.822 173.093 0.729 17865
7349 1 12 . 1 1 14 14 GLY CA C 39 45.404 45.404 45.124 0.280 17865
7350 1 12 . 1 1 14 14 GLY H H 39 7.647 7.647 8.277 -0.630 17865
7351 1 12 . 1 1 15 15 LYS N N 40 121.621 121.621 122.027 -0.406 17865
7352 1 12 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.545 0.030 17865
7353 1 12 . 1 1 15 15 LYS CA C 40 54.100 54.100 52.780 1.320 17865
7354 1 12 . 1 1 15 15 LYS CB C 40 32.510 32.510 34.189 -1.679 17865
7355 1 12 . 1 1 15 15 LYS H H 40 7.908 7.908 7.503 0.405 17865
7356 1 12 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.955 -0.603 17865
7357 1 12 . 1 1 16 16 PRO C C 41 176.806 176.806 177.961 -1.155 17865
7358 1 12 . 1 1 16 16 PRO CA C 41 62.758 62.758 61.854 0.904 17865
7359 1 12 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.699 -0.385 17865
7360 1 12 . 1 1 17 17 LEU N N 42 123.488 123.488 120.810 2.678 17865
7361 1 12 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.147 -0.098 17865
7362 1 12 . 1 1 17 17 LEU C C 42 174.973 174.973 176.774 -1.801 17865
7363 1 12 . 1 1 17 17 LEU CA C 42 55.436 55.436 55.795 -0.359 17865
7364 1 12 . 1 1 17 17 LEU CB C 42 42.093 42.093 41.431 0.662 17865
7365 1 12 . 1 1 17 17 LEU H H 42 8.499 8.499 8.150 0.349 17865
7366 1 12 . 1 1 18 18 ASP N N 43 123.354 123.354 122.680 0.674 17865
7367 1 12 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.778 -0.280 17865
7368 1 12 . 1 1 18 18 ASP C C 43 175.947 175.947 176.996 -1.049 17865
7369 1 12 . 1 1 18 18 ASP CA C 43 52.858 52.858 52.519 0.339 17865
7370 1 12 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.004 -1.783 17865
7371 1 12 . 1 1 18 18 ASP H H 43 7.789 7.789 8.106 -0.317 17865
7372 1 12 . 1 1 19 19 ALA N N 44 120.147 120.147 125.257 -5.110 17865
7373 1 12 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.140 -0.154 17865
7374 1 12 . 1 1 19 19 ALA C C 44 179.476 179.476 178.825 0.651 17865
7375 1 12 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.897 0.266 17865
7376 1 12 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.803 -0.416 17865
7377 1 12 . 1 1 19 19 ALA H H 44 8.561 8.561 8.661 -0.100 17865
7378 1 12 . 1 1 20 20 SER N N 45 115.037 115.037 115.351 -0.314 17865
7379 1 12 . 1 1 20 20 SER HA H 45 4.151 4.151 4.202 -0.051 17865
7380 1 12 . 1 1 20 20 SER C C 45 177.191 177.191 176.482 0.709 17865
7381 1 12 . 1 1 20 20 SER CA C 45 61.629 61.629 60.609 1.020 17865
7382 1 12 . 1 1 20 20 SER CB C 45 62.804 62.804 63.070 -0.266 17865
7383 1 12 . 1 1 20 20 SER H H 45 8.466 8.466 8.060 0.406 17865
7384 1 12 . 1 1 21 21 PHE N N 46 125.030 125.030 123.690 1.340 17865
7385 1 12 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.330 -0.099 17865
7386 1 12 . 1 1 21 21 PHE C C 46 176.850 176.850 176.505 0.345 17865
7387 1 12 . 1 1 21 21 PHE CA C 46 60.806 60.806 61.377 -0.571 17865
7388 1 12 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.387 0.494 17865
7389 1 12 . 1 1 21 21 PHE H H 46 8.034 8.034 7.944 0.090 17865
7390 1 12 . 1 1 22 22 CYS N N 47 113.943 113.943 116.991 -3.048 17865
7391 1 12 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.284 -0.033 17865
7392 1 12 . 1 1 22 22 CYS C C 47 176.449 176.449 176.441 0.008 17865
7393 1 12 . 1 1 22 22 CYS CA C 47 53.600 53.600 59.285 -5.685 17865
7394 1 12 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.232 11.159 17865
7395 1 12 . 1 1 22 22 CYS H H 47 7.691 7.691 7.999 -0.308 17865
7396 1 12 . 1 1 23 23 ARG N N 48 119.958 119.958 121.915 -1.957 17865
7397 1 12 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.052 0.028 17865
7398 1 12 . 1 1 23 23 ARG C C 48 177.904 177.904 177.604 0.300 17865
7399 1 12 . 1 1 23 23 ARG CA C 48 58.907 58.907 58.914 -0.007 17865
7400 1 12 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.264 0.907 17865
7401 1 12 . 1 1 23 23 ARG H H 48 7.628 7.628 7.499 0.129 17865
7402 1 12 . 1 1 24 24 THR N N 49 106.445 106.445 115.345 -8.900 17865
7403 1 12 . 1 1 24 24 THR HA H 49 4.385 4.385 4.125 0.260 17865
7404 1 12 . 1 1 24 24 THR C C 49 174.758 174.758 174.916 -0.158 17865
7405 1 12 . 1 1 24 24 THR CA C 49 61.573 61.573 64.472 -2.899 17865
7406 1 12 . 1 1 24 24 THR CB C 49 68.794 68.794 68.299 0.494 17865
7407 1 12 . 1 1 24 24 THR H H 49 7.307 7.307 7.460 -0.153 17865
7408 1 12 . 1 1 25 25 ALA N N 50 122.242 122.242 121.745 0.497 17865
7409 1 12 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.287 0.117 17865
7410 1 12 . 1 1 25 25 ALA C C 50 178.554 178.554 177.650 0.904 17865
7411 1 12 . 1 1 25 25 ALA CA C 50 52.381 52.381 52.422 -0.041 17865
7412 1 12 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.678 -1.283 17865
7413 1 12 . 1 1 25 25 ALA H H 50 7.401 7.401 7.596 -0.195 17865
7414 1 12 . 1 1 26 26 GLY N N 51 110.604 110.604 107.564 3.040 17865
7415 1 12 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.796 0.226 17865
7416 1 12 . 1 1 26 26 GLY H H 51 8.285 8.285 7.605 0.680 17865
7417 1 12 . 1 1 27 27 SER HA H 52 4.382 4.382 4.274 0.108 17865
7418 1 12 . 1 1 27 27 SER C C 52 175.774 175.774 175.516 0.258 17865
7419 1 12 . 1 1 27 27 SER CA C 52 60.803 60.803 61.216 -0.413 17865
7420 1 12 . 1 1 27 27 SER CB C 52 62.827 62.827 63.237 -0.410 17865
7421 1 12 . 1 1 28 28 ARG N N 53 119.682 119.682 118.954 0.728 17865
7422 1 12 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.538 0.342 17865
7423 1 12 . 1 1 28 28 ARG C C 53 175.796 175.796 176.947 -1.151 17865
7424 1 12 . 1 1 28 28 ARG CA C 53 55.738 55.738 56.244 -0.506 17865
7425 1 12 . 1 1 28 28 ARG CB C 53 30.237 30.237 30.411 -0.174 17865
7426 1 12 . 1 1 28 28 ARG H H 53 7.894 7.894 7.287 0.607 17865
7427 1 12 . 1 1 29 29 GLU N N 54 122.318 122.318 121.152 1.166 17865
7428 1 12 . 1 1 29 29 GLU HA H 54 3.595 3.595 4.075 -0.480 17865
7429 1 12 . 1 1 29 29 GLU C C 54 177.523 177.523 177.781 -0.258 17865
7430 1 12 . 1 1 29 29 GLU CA C 54 61.223 61.223 59.746 1.477 17865
7431 1 12 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.553 -0.616 17865
7432 1 12 . 1 1 29 29 GLU H H 54 7.730 7.730 7.635 0.095 17865
7433 1 12 . 1 1 30 30 LYS N N 55 118.377 118.377 118.102 0.275 17865
7434 1 12 . 1 1 30 30 LYS HA H 55 3.828 3.828 3.989 -0.161 17865
7435 1 12 . 1 1 30 30 LYS C C 55 179.205 179.205 178.878 0.327 17865
7436 1 12 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.234 1.193 17865
7437 1 12 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.149 -0.548 17865
7438 1 12 . 1 1 30 30 LYS H H 55 8.659 8.659 8.169 0.490 17865
7439 1 12 . 1 1 31 31 ASP N N 56 121.614 121.614 119.459 2.155 17865
7440 1 12 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.399 -0.088 17865
7441 1 12 . 1 1 31 31 ASP C C 56 177.393 177.393 177.839 -0.446 17865
7442 1 12 . 1 1 31 31 ASP CA C 56 57.316 57.316 57.472 -0.156 17865
7443 1 12 . 1 1 31 31 ASP CB C 56 40.423 40.423 40.715 -0.292 17865
7444 1 12 . 1 1 31 31 ASP H H 56 7.646 7.646 8.111 -0.465 17865
7445 1 12 . 1 1 32 32 CYS N N 57 120.345 120.345 118.206 2.139 17865
7446 1 12 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.664 -0.063 17865
7447 1 12 . 1 1 32 32 CYS C C 57 175.772 175.772 176.479 -0.707 17865
7448 1 12 . 1 1 32 32 CYS CA C 57 60.197 60.197 61.171 -0.974 17865
7449 1 12 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.973 7.993 17865
7450 1 12 . 1 1 32 32 CYS H H 57 8.042 8.042 7.437 0.605 17865
7451 1 12 . 1 1 33 33 ARG N N 58 120.293 120.293 118.697 1.596 17865
7452 1 12 . 1 1 33 33 ARG HA H 58 3.676 3.676 4.009 -0.333 17865
7453 1 12 . 1 1 33 33 ARG C C 58 179.633 179.633 178.546 1.087 17865
7454 1 12 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.518 0.868 17865
7455 1 12 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.932 -0.091 17865
7456 1 12 . 1 1 33 33 ARG H H 58 8.531 8.531 7.498 1.033 17865
7457 1 12 . 1 1 34 34 LYS N N 59 121.166 121.166 119.468 1.698 17865
7458 1 12 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.167 -0.131 17865
7459 1 12 . 1 1 34 34 LYS C C 59 179.220 179.220 178.858 0.362 17865
7460 1 12 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.589 0.941 17865
7461 1 12 . 1 1 34 34 LYS CB C 59 32.110 32.110 32.051 0.059 17865
7462 1 12 . 1 1 34 34 LYS H H 59 7.633 7.633 7.453 0.180 17865
7463 1 12 . 1 1 35 35 ASP N N 60 122.166 122.166 120.692 1.474 17865
7464 1 12 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.442 -0.011 17865
7465 1 12 . 1 1 35 35 ASP C C 60 179.709 179.709 178.837 0.872 17865
7466 1 12 . 1 1 35 35 ASP CA C 60 57.703 57.703 58.030 -0.327 17865
7467 1 12 . 1 1 35 35 ASP CB C 60 40.672 40.672 40.841 -0.169 17865
7468 1 12 . 1 1 35 35 ASP H H 60 8.221 8.221 7.853 0.368 17865
7469 1 12 . 1 1 36 36 VAL N N 61 121.312 121.312 118.949 2.363 17865
7470 1 12 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.716 -0.315 17865
7471 1 12 . 1 1 36 36 VAL C C 61 178.339 178.339 176.413 1.926 17865
7472 1 12 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.772 1.361 17865
7473 1 12 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.716 -0.059 17865
7474 1 12 . 1 1 36 36 VAL H H 61 8.916 8.916 8.003 0.913 17865
7475 1 12 . 1 1 37 37 GLN N N 62 119.166 119.166 116.889 2.277 17865
7476 1 12 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.168 -0.226 17865
7477 1 12 . 1 1 37 37 GLN C C 62 177.293 177.293 177.784 -0.491 17865
7478 1 12 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.242 1.038 17865
7479 1 12 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.430 -0.059 17865
7480 1 12 . 1 1 37 37 GLN H H 62 7.697 7.697 7.509 0.188 17865
7481 1 12 . 1 1 38 38 ALA N N 63 118.964 118.964 121.736 -2.772 17865
7482 1 12 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.263 -0.021 17865
7483 1 12 . 1 1 38 38 ALA C C 63 177.221 177.221 178.134 -0.913 17865
7484 1 12 . 1 1 38 38 ALA CA C 63 53.137 53.137 53.433 -0.296 17865
7485 1 12 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.349 -0.452 17865
7486 1 12 . 1 1 38 38 ALA H H 63 7.508 7.508 7.572 -0.064 17865
7487 1 12 . 1 1 39 39 CYS N N 64 119.081 119.081 120.031 -0.950 17865
7488 1 12 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.495 0.458 17865
7489 1 12 . 1 1 39 39 CYS C C 64 172.052 172.052 175.527 -3.475 17865
7490 1 12 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.766 -6.886 17865
7491 1 12 . 1 1 39 39 CYS CB C 64 34.328 34.328 25.927 8.401 17865
7492 1 12 . 1 1 39 39 CYS H H 64 7.354 7.354 8.033 -0.679 17865
7493 1 12 . 1 1 40 40 ASP N N 65 124.167 124.167 129.006 -4.839 17865
7494 1 12 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.364 -0.039 17865
7495 1 12 . 1 1 40 40 ASP C C 65 176.496 176.496 177.627 -1.131 17865
7496 1 12 . 1 1 40 40 ASP CA C 65 56.724 56.724 57.105 -0.381 17865
7497 1 12 . 1 1 40 40 ASP CB C 65 41.313 41.313 40.593 0.720 17865
7498 1 12 . 1 1 40 40 ASP H H 65 8.142 8.142 8.716 -0.574 17865
7499 1 12 . 1 1 41 41 LYS N N 66 118.844 118.844 119.278 -0.434 17865
7500 1 12 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.154 0.370 17865
7501 1 12 . 1 1 41 41 LYS C C 66 175.586 175.586 177.472 -1.886 17865
7502 1 12 . 1 1 41 41 LYS CA C 66 55.275 55.275 57.826 -2.551 17865
7503 1 12 . 1 1 41 41 LYS CB C 66 32.598 32.598 32.082 0.516 17865
7504 1 12 . 1 1 41 41 LYS H H 66 7.858 7.858 8.477 -0.619 17865
7505 1 12 . 1 1 42 42 LYS N N 67 126.081 126.081 114.495 11.586 17865
7506 1 12 . 1 1 42 42 LYS HA H 67 3.915 3.915 3.655 0.260 17865
7507 1 12 . 1 1 42 42 LYS C C 67 174.665 174.665 175.867 -1.202 17865
7508 1 12 . 1 1 42 42 LYS CA C 67 57.827 57.827 58.516 -0.689 17865
7509 1 12 . 1 1 42 42 LYS CB C 67 34.059 34.059 30.525 3.534 17865
7510 1 12 . 1 1 42 42 LYS H H 67 8.790 8.790 8.355 0.435 17865
7511 1 12 . 1 1 43 43 TYR N N 68 114.138 114.138 118.003 -3.865 17865
7512 1 12 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.663 0.596 17865
7513 1 12 . 1 1 43 43 TYR C C 68 175.767 175.767 176.129 -0.362 17865
7514 1 12 . 1 1 43 43 TYR CA C 68 55.880 55.880 57.570 -1.690 17865
7515 1 12 . 1 1 43 43 TYR CB C 68 42.363 42.363 40.583 1.780 17865
7516 1 12 . 1 1 43 43 TYR H H 68 7.294 7.294 8.091 -0.797 17865
7517 1 12 . 1 1 44 44 ASP N N 69 121.807 121.807 121.165 0.642 17865
7518 1 12 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.611 0.029 17865
7519 1 12 . 1 1 44 44 ASP C C 69 177.812 177.812 177.642 0.170 17865
7520 1 12 . 1 1 44 44 ASP CA C 69 52.110 52.110 54.557 -2.447 17865
7521 1 12 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.384 -1.944 17865
7522 1 12 . 1 1 44 44 ASP H H 69 8.995 8.995 8.877 0.118 17865
7523 1 12 . 1 1 45 45 ASP N N 70 116.686 116.686 122.238 -5.552 17865
7524 1 12 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.439 -0.015 17865
7525 1 12 . 1 1 45 45 ASP C C 70 177.054 177.054 177.218 -0.164 17865
7526 1 12 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.292 0.089 17865
7527 1 12 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.980 -0.732 17865
7528 1 12 . 1 1 45 45 ASP H H 70 8.369 8.369 8.721 -0.352 17865
7529 1 12 . 1 1 46 46 GLN N N 71 117.949 117.949 117.266 0.683 17865
7530 1 12 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.285 0.171 17865
7531 1 12 . 1 1 46 46 GLN C C 71 176.273 176.273 176.854 -0.581 17865
7532 1 12 . 1 1 46 46 GLN CA C 71 55.367 55.367 56.059 -0.692 17865
7533 1 12 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.306 0.024 17865
7534 1 12 . 1 1 46 46 GLN H H 71 8.274 8.274 8.495 -0.221 17865
7535 1 12 . 1 1 47 47 GLY N N 72 108.369 108.369 107.076 1.293 17865
7536 1 12 . 1 1 47 47 GLY C C 72 174.145 174.145 174.153 -0.008 17865
7537 1 12 . 1 1 47 47 GLY CA C 72 45.823 45.823 44.927 0.896 17865
7538 1 12 . 1 1 47 47 GLY H H 72 8.174 8.174 8.175 -0.001 17865
7539 1 12 . 1 1 48 48 ARG N N 73 121.554 121.554 119.914 1.640 17865
7540 1 12 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.475 0.010 17865
7541 1 12 . 1 1 48 48 ARG C C 73 176.855 176.855 175.597 1.258 17865
7542 1 12 . 1 1 48 48 ARG CA C 73 55.289 55.289 54.187 1.102 17865
7543 1 12 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.111 -0.553 17865
7544 1 12 . 1 1 48 48 ARG H H 73 8.462 8.462 7.962 0.500 17865
7545 1 12 . 1 1 49 49 GLU N N 74 122.784 122.784 120.636 2.148 17865
7546 1 12 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.379 0.104 17865
7547 1 12 . 1 1 49 49 GLU C C 74 178.098 178.098 176.822 1.276 17865
7548 1 12 . 1 1 49 49 GLU CA C 74 57.184 57.184 57.382 -0.198 17865
7549 1 12 . 1 1 49 49 GLU CB C 74 30.777 30.777 29.374 1.403 17865
7550 1 12 . 1 1 49 49 GLU H H 74 8.703 8.703 8.615 0.088 17865
7551 1 12 . 1 1 50 50 THR N N 75 114.563 114.563 114.785 -0.222 17865
7552 1 12 . 1 1 50 50 THR HA H 75 4.212 4.212 4.438 -0.226 17865
7553 1 12 . 1 1 50 50 THR C C 75 175.170 175.170 175.812 -0.642 17865
7554 1 12 . 1 1 50 50 THR CA C 75 60.589 60.589 59.967 0.622 17865
7555 1 12 . 1 1 50 50 THR CB C 75 70.952 70.952 70.956 -0.004 17865
7556 1 12 . 1 1 50 50 THR H H 75 7.717 7.717 8.161 -0.444 17865
7557 1 12 . 1 1 51 51 ALA N N 76 122.097 122.097 121.538 0.559 17865
7558 1 12 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.081 -0.043 17865
7559 1 12 . 1 1 51 51 ALA C C 76 181.906 181.906 179.136 2.770 17865
7560 1 12 . 1 1 51 51 ALA CA C 76 55.654 55.654 54.803 0.851 17865
7561 1 12 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.144 -0.151 17865
7562 1 12 . 1 1 51 51 ALA H H 76 8.734 8.734 8.701 0.033 17865
7563 1 12 . 1 1 52 52 CYS N N 77 115.347 115.347 118.097 -2.750 17865
7564 1 12 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.321 0.159 17865
7565 1 12 . 1 1 52 52 CYS C C 77 176.299 176.299 176.913 -0.614 17865
7566 1 12 . 1 1 52 52 CYS CA C 77 57.701 57.701 60.517 -2.816 17865
7567 1 12 . 1 1 52 52 CYS CB C 77 35.631 35.631 26.053 9.578 17865
7568 1 12 . 1 1 52 52 CYS H H 77 9.073 9.073 8.303 0.770 17865
7569 1 12 . 1 1 53 53 ALA N N 78 128.517 128.517 122.727 5.790 17865
7570 1 12 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.931 -0.076 17865
7571 1 12 . 1 1 53 53 ALA C C 78 178.736 178.736 179.213 -0.477 17865
7572 1 12 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.213 0.420 17865
7573 1 12 . 1 1 53 53 ALA CB C 78 19.191 19.191 18.124 1.067 17865
7574 1 12 . 1 1 53 53 ALA H H 78 7.174 7.174 8.220 -1.046 17865
7575 1 12 . 1 1 54 54 LYS N N 79 118.706 118.706 119.364 -0.658 17865
7576 1 12 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.031 -0.228 17865
7577 1 12 . 1 1 54 54 LYS C C 79 179.611 179.611 178.632 0.979 17865
7578 1 12 . 1 1 54 54 LYS CA C 79 59.725 59.725 59.191 0.534 17865
7579 1 12 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.505 0.148 17865
7580 1 12 . 1 1 54 54 LYS H H 79 8.313 8.313 8.052 0.261 17865
7581 1 12 . 1 1 55 55 GLY N N 80 104.822 104.822 107.393 -2.571 17865
7582 1 12 . 1 1 55 55 GLY C C 80 176.504 176.504 176.476 0.028 17865
7583 1 12 . 1 1 55 55 GLY CA C 80 46.839 46.839 47.214 -0.374 17865
7584 1 12 . 1 1 55 55 GLY H H 80 8.175 8.175 7.967 0.208 17865
7585 1 12 . 1 1 56 56 ILE N N 81 123.697 123.697 122.647 1.050 17865
7586 1 12 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.732 0.063 17865
7587 1 12 . 1 1 56 56 ILE C C 81 177.334 177.334 177.402 -0.068 17865
7588 1 12 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.858 0.423 17865
7589 1 12 . 1 1 56 56 ILE CB C 81 38.335 38.335 38.005 0.330 17865
7590 1 12 . 1 1 56 56 ILE H H 81 7.590 7.590 7.920 -0.330 17865
7591 1 12 . 1 1 57 57 ARG N N 82 118.161 118.161 119.206 -1.045 17865
7592 1 12 . 1 1 57 57 ARG HA H 82 3.935 3.935 4.047 -0.112 17865
7593 1 12 . 1 1 57 57 ARG C C 82 178.662 178.662 177.864 0.798 17865
7594 1 12 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.389 0.313 17865
7595 1 12 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.707 0.192 17865
7596 1 12 . 1 1 57 57 ARG H H 82 7.569 7.569 7.657 -0.088 17865
7597 1 12 . 1 1 58 58 GLU N N 83 115.085 115.085 117.770 -2.685 17865
7598 1 12 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.148 -0.117 17865
7599 1 12 . 1 1 58 58 GLU C C 83 178.224 178.224 178.494 -0.270 17865
7600 1 12 . 1 1 58 58 GLU CA C 83 58.304 58.304 57.793 0.511 17865
7601 1 12 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.186 0.845 17865
7602 1 12 . 1 1 58 58 GLU H H 83 7.786 7.786 8.124 -0.338 17865
7603 1 12 . 1 1 59 59 LYS N N 84 119.183 119.183 121.184 -2.001 17865
7604 1 12 . 1 1 59 59 LYS HA H 84 3.830 3.830 3.767 0.063 17865
7605 1 12 . 1 1 59 59 LYS C C 84 177.933 177.933 177.957 -0.024 17865
7606 1 12 . 1 1 59 59 LYS CA C 84 59.043 59.043 59.020 0.023 17865
7607 1 12 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.148 1.502 17865
7608 1 12 . 1 1 59 59 LYS H H 84 7.968 7.968 7.705 0.263 17865
7609 1 12 . 1 1 60 60 TYR N N 85 113.663 113.663 114.104 -0.441 17865
7610 1 12 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.785 -0.082 17865
7611 1 12 . 1 1 60 60 TYR C C 85 174.729 174.729 174.251 0.478 17865
7612 1 12 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.155 1.047 17865
7613 1 12 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.542 0.360 17865
7614 1 12 . 1 1 60 60 TYR H H 85 7.562 7.562 7.560 0.002 17865
7615 1 12 . 1 1 61 61 LYS N N 86 121.862 121.862 122.789 -0.927 17865
7616 1 12 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.564 -0.052 17865
7617 1 12 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.502 -0.560 17865
7618 1 12 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.177 -0.075 17865
7619 1 12 . 1 1 61 61 LYS H H 86 7.222 7.222 7.284 -0.062 17865
7620 1 12 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.448 -0.125 17865
7621 1 12 . 1 1 62 62 PRO C C 87 176.576 176.576 176.771 -0.195 17865
7622 1 12 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.701 0.319 17865
7623 1 12 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.468 -0.228 17865
7624 1 12 . 1 1 63 63 ALA N N 88 125.029 125.029 124.302 0.727 17865
7625 1 12 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.212 0.042 17865
7626 1 12 . 1 1 63 63 ALA C C 88 177.301 177.301 176.641 0.660 17865
7627 1 12 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.501 -0.220 17865
7628 1 12 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.693 1.509 17865
7629 1 12 . 1 1 63 63 ALA H H 88 8.329 8.329 8.364 -0.035 17865
7630 1 12 . 1 1 64 64 VAL N N 89 121.843 121.843 119.853 1.990 17865
7631 1 12 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.417 -0.473 17865
7632 1 12 . 1 1 64 64 VAL C C 89 174.791 174.791 175.062 -0.271 17865
7633 1 12 . 1 1 64 64 VAL CA C 89 61.981 61.981 59.987 1.994 17865
7634 1 12 . 1 1 64 64 VAL CB C 89 33.485 33.485 34.765 -1.280 17865
7635 1 12 . 1 1 64 64 VAL H H 89 8.075 8.075 7.679 0.396 17865
7636 1 12 . 1 1 65 65 VAL N N 90 125.399 125.399 123.080 2.319 17865
7637 1 12 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.037 0.101 17865
7638 1 12 . 1 1 65 65 VAL C C 90 174.340 174.340 175.073 -0.733 17865
7639 1 12 . 1 1 65 65 VAL CA C 90 61.162 61.162 62.666 -1.504 17865
7640 1 12 . 1 1 65 65 VAL CB C 90 33.866 33.866 31.276 2.590 17865
7641 1 12 . 1 1 65 65 VAL H H 90 8.229 8.229 8.339 -0.110 17865
7642 1 12 . 1 1 66 66 TYR N N 91 124.848 124.848 127.605 -2.757 17865
7643 1 12 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.851 -0.080 17865
7644 1 12 . 1 1 66 66 TYR C C 91 176.658 176.658 176.568 0.090 17865
7645 1 12 . 1 1 66 66 TYR CA C 91 58.084 58.084 56.976 1.108 17865
7646 1 12 . 1 1 66 66 TYR CB C 91 41.535 41.535 41.785 -0.251 17865
7647 1 12 . 1 1 66 66 TYR H H 91 9.145 9.145 7.801 1.344 17865
7648 1 12 . 1 1 67 67 GLY N N 92 106.185 106.185 107.916 -1.731 17865
7649 1 12 . 1 1 67 67 GLY C C 92 175.681 175.681 175.521 0.160 17865
7650 1 12 . 1 1 67 67 GLY CA C 92 43.975 43.975 44.309 -0.334 17865
7651 1 12 . 1 1 67 67 GLY H H 92 8.730 8.730 9.051 -0.321 17865
7652 1 12 . 1 1 68 68 TYR N N 93 121.815 121.815 118.429 3.386 17865
7653 1 12 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.302 -0.327 17865
7654 1 12 . 1 1 68 68 TYR C C 93 176.035 176.035 176.092 -0.057 17865
7655 1 12 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.416 1.630 17865
7656 1 12 . 1 1 68 68 TYR CB C 93 38.425 38.425 37.773 0.652 17865
7657 1 12 . 1 1 68 68 TYR H H 93 8.711 8.711 8.549 0.162 17865
7658 1 12 . 1 1 69 69 ASP N N 94 115.507 115.507 115.361 0.146 17865
7659 1 12 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.765 -0.477 17865
7660 1 12 . 1 1 69 69 ASP C C 94 177.063 177.063 176.547 0.516 17865
7661 1 12 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.783 -0.772 17865
7662 1 12 . 1 1 69 69 ASP CB C 94 40.167 40.167 41.362 -1.195 17865
7663 1 12 . 1 1 69 69 ASP H H 94 8.010 8.010 7.805 0.205 17865
7664 1 12 . 1 1 70 70 GLY N N 95 107.196 107.196 109.043 -1.847 17865
7665 1 12 . 1 1 70 70 GLY C C 95 173.936 173.936 173.971 -0.035 17865
7666 1 12 . 1 1 70 70 GLY CA C 95 45.392 45.392 44.762 0.630 17865
7667 1 12 . 1 1 70 70 GLY H H 95 7.986 7.986 7.663 0.323 17865
7668 1 12 . 1 1 71 71 LYS N N 96 121.258 121.258 121.870 -0.612 17865
7669 1 12 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.578 0.206 17865
7670 1 12 . 1 1 71 71 LYS CA C 96 54.114 54.114 54.020 0.094 17865
7671 1 12 . 1 1 71 71 LYS CB C 96 31.762 31.762 32.547 -0.785 17865
7672 1 12 . 1 1 71 71 LYS H H 96 7.877 7.877 7.529 0.348 17865
7673 1 12 . 1 1 72 72 PRO C C 97 177.170 177.170 175.788 1.382 17865
7674 1 12 . 1 1 72 72 PRO CA C 97 63.137 63.137 62.980 0.157 17865
7675 1 12 . 1 1 72 72 PRO CB C 97 32.240 32.240 30.442 1.798 17865
7676 1 12 . 1 1 73 73 LEU N N 98 123.503 123.503 121.590 1.913 17865
7677 1 12 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.805 -0.445 17865
7678 1 12 . 1 1 73 73 LEU C C 98 176.354 176.354 174.981 1.373 17865
7679 1 12 . 1 1 73 73 LEU CA C 98 53.927 53.927 52.810 1.117 17865
7680 1 12 . 1 1 73 73 LEU CB C 98 42.272 42.272 45.625 -3.353 17865
7681 1 12 . 1 1 73 73 LEU H H 98 8.850 8.850 7.629 1.221 17865
7682 1 12 . 1 1 74 74 ASP N N 99 122.212 122.212 122.680 -0.468 17865
7683 1 12 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.720 -0.123 17865
7684 1 12 . 1 1 74 74 ASP C C 99 175.819 175.819 176.741 -0.922 17865
7685 1 12 . 1 1 74 74 ASP CA C 99 53.856 53.856 53.876 -0.020 17865
7686 1 12 . 1 1 74 74 ASP CB C 99 40.989 40.989 42.982 -1.993 17865
7687 1 12 . 1 1 74 74 ASP H H 99 8.517 8.517 8.570 -0.053 17865
7688 1 12 . 1 1 75 75 LEU N N 100 125.874 125.874 113.540 12.334 17865
7689 1 12 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.103 0.263 17865
7690 1 12 . 1 1 75 75 LEU C C 100 178.426 178.426 177.406 1.020 17865
7691 1 12 . 1 1 75 75 LEU CA C 100 53.631 53.631 56.083 -2.452 17865
7692 1 12 . 1 1 75 75 LEU CB C 100 40.676 40.676 39.280 1.396 17865
7693 1 12 . 1 1 75 75 LEU H H 100 8.281 8.281 8.488 -0.207 17865
7694 1 12 . 1 1 76 76 GLY N N 101 110.604 110.604 108.141 2.463 17865
7695 1 12 . 1 1 76 76 GLY C C 101 176.936 176.936 175.236 1.700 17865
7696 1 12 . 1 1 76 76 GLY CA C 101 47.827 47.827 46.689 1.138 17865
7697 1 12 . 1 1 76 76 GLY H H 101 8.914 8.914 8.478 0.436 17865
7698 1 12 . 1 1 77 77 PHE N N 102 117.639 117.639 119.738 -2.099 17865
7699 1 12 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.971 -0.590 17865
7700 1 12 . 1 1 77 77 PHE C C 102 177.878 177.878 174.692 3.186 17865
7701 1 12 . 1 1 77 77 PHE CA C 102 59.139 59.139 57.900 1.239 17865
7702 1 12 . 1 1 77 77 PHE CB C 102 36.935 36.935 40.137 -3.202 17865
7703 1 12 . 1 1 77 77 PHE H H 102 7.992 7.992 7.943 0.049 17865
7704 1 12 . 1 1 78 78 CYS N N 103 121.136 121.136 117.696 3.440 17865
7705 1 12 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.949 -0.564 17865
7706 1 12 . 1 1 78 78 CYS C C 103 172.780 172.780 176.281 -3.501 17865
7707 1 12 . 1 1 78 78 CYS CA C 103 53.696 53.696 57.257 -3.561 17865
7708 1 12 . 1 1 78 78 CYS CB C 103 34.237 34.237 27.500 6.737 17865
7709 1 12 . 1 1 78 78 CYS H H 103 7.362 7.362 8.238 -0.876 17865
7710 1 12 . 1 1 79 79 THR N N 104 114.773 114.773 118.509 -3.736 17865
7711 1 12 . 1 1 79 79 THR HA H 104 3.984 3.984 4.100 -0.116 17865
7712 1 12 . 1 1 79 79 THR C C 104 176.624 176.624 175.611 1.013 17865
7713 1 12 . 1 1 79 79 THR CA C 104 65.180 65.180 66.075 -0.895 17865
7714 1 12 . 1 1 79 79 THR CB C 104 69.062 69.062 68.490 0.572 17865
7715 1 12 . 1 1 79 79 THR H H 104 7.864 7.864 7.954 -0.090 17865
7716 1 12 . 1 1 80 80 LEU N N 105 119.785 119.785 117.116 2.669 17865
7717 1 12 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.572 -0.241 17865
7718 1 12 . 1 1 80 80 LEU C C 105 177.208 177.208 176.256 0.952 17865
7719 1 12 . 1 1 80 80 LEU CA C 105 55.453 55.453 54.972 0.481 17865
7720 1 12 . 1 1 80 80 LEU CB C 105 41.293 41.293 40.599 0.694 17865
7721 1 12 . 1 1 80 80 LEU H H 105 7.238 7.238 7.724 -0.486 17865
7722 1 12 . 1 1 81 81 ALA N N 106 119.309 119.309 121.542 -2.233 17865
7723 1 12 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.684 -0.157 17865
7724 1 12 . 1 1 81 81 ALA C C 106 178.769 178.769 176.086 2.683 17865
7725 1 12 . 1 1 81 81 ALA CA C 106 52.049 52.049 51.606 0.443 17865
7726 1 12 . 1 1 81 81 ALA CB C 106 18.820 18.820 21.791 -2.971 17865
7727 1 12 . 1 1 81 81 ALA H H 106 7.432 7.432 7.548 -0.116 17865
7728 1 12 . 1 1 82 82 GLY N N 107 109.793 109.793 106.143 3.650 17865
7729 1 12 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.850 1.269 17865
7730 1 12 . 1 1 82 82 GLY H H 107 7.918 7.918 8.401 -0.483 17865
7731 1 12 . 1 1 83 83 ILE HA H 108 4.266 4.266 4.020 0.246 17865
7732 1 12 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.023 0.240 17865
7733 1 12 . 1 1 83 83 ILE CB C 108 38.261 38.261 37.224 1.037 17865
7734 1 12 . 1 1 84 84 ARG HA H 109 4.755 4.755 3.969 0.786 17865
7735 1 12 . 1 1 84 84 ARG C C 109 181.344 181.344 178.138 3.206 17865
7736 1 12 . 1 1 84 84 ARG CA C 109 55.939 55.939 58.349 -2.410 17865
7737 1 12 . 1 1 84 84 ARG CB C 109 30.283 30.283 29.138 1.145 17865
7738 1 12 . 1 1 85 85 GLU N N 110 122.944 122.944 119.268 3.676 17865
7739 1 12 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.099 -0.482 17865
7740 1 12 . 1 1 85 85 GLU C C 110 177.797 177.797 178.484 -0.687 17865
7741 1 12 . 1 1 85 85 GLU CA C 110 60.728 60.728 60.139 0.590 17865
7742 1 12 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.172 -0.301 17865
7743 1 12 . 1 1 85 85 GLU H H 110 8.003 8.003 8.672 -0.669 17865
7744 1 12 . 1 1 86 86 VAL N N 111 117.101 117.101 118.762 -1.661 17865
7745 1 12 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.648 -0.137 17865
7746 1 12 . 1 1 86 86 VAL C C 111 177.710 177.710 178.333 -0.623 17865
7747 1 12 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.388 0.043 17865
7748 1 12 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.497 -0.284 17865
7749 1 12 . 1 1 86 86 VAL H H 111 8.106 8.106 7.575 0.531 17865
7750 1 12 . 1 1 87 87 ASP N N 112 122.242 122.242 119.090 3.152 17865
7751 1 12 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.448 -0.144 17865
7752 1 12 . 1 1 87 87 ASP C C 112 176.912 176.912 177.885 -0.973 17865
7753 1 12 . 1 1 87 87 ASP CA C 112 57.417 57.417 56.537 0.880 17865
7754 1 12 . 1 1 87 87 ASP CB C 112 40.476 40.476 41.111 -0.635 17865
7755 1 12 . 1 1 87 87 ASP H H 112 7.401 7.401 7.599 -0.198 17865
7756 1 12 . 1 1 88 88 CYS N N 113 120.819 120.819 120.181 0.638 17865
7757 1 12 . 1 1 88 88 CYS HA H 113 3.309 3.309 3.994 -0.685 17865
7758 1 12 . 1 1 88 88 CYS C C 113 175.270 175.270 176.757 -1.487 17865
7759 1 12 . 1 1 88 88 CYS CA C 113 59.759 59.759 62.450 -2.691 17865
7760 1 12 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.559 7.276 17865
7761 1 12 . 1 1 88 88 CYS H H 113 7.785 7.785 8.262 -0.477 17865
7762 1 12 . 1 1 89 89 ARG N N 114 118.654 118.654 119.280 -0.626 17865
7763 1 12 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.062 -0.421 17865
7764 1 12 . 1 1 89 89 ARG C C 114 179.018 179.018 178.337 0.681 17865
7765 1 12 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.301 0.892 17865
7766 1 12 . 1 1 89 89 ARG CB C 114 29.713 29.713 30.069 -0.356 17865
7767 1 12 . 1 1 89 89 ARG H H 114 8.142 8.142 8.537 -0.395 17865
7768 1 12 . 1 1 90 90 LYS N N 115 120.964 120.964 118.465 2.499 17865
7769 1 12 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.090 -0.060 17865
7770 1 12 . 1 1 90 90 LYS C C 115 180.092 180.092 179.113 0.979 17865
7771 1 12 . 1 1 90 90 LYS CA C 115 59.568 59.568 59.225 0.343 17865
7772 1 12 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.249 -0.028 17865
7773 1 12 . 1 1 90 90 LYS H H 115 7.936 7.936 7.549 0.387 17865
7774 1 12 . 1 1 91 91 ASP N N 116 121.690 121.690 118.957 2.733 17865
7775 1 12 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.595 -0.082 17865
7776 1 12 . 1 1 91 91 ASP C C 116 179.419 179.419 178.128 1.291 17865
7777 1 12 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.373 0.864 17865
7778 1 12 . 1 1 91 91 ASP CB C 116 40.648 40.648 40.982 -0.334 17865
7779 1 12 . 1 1 91 91 ASP H H 116 8.558 8.558 7.628 0.930 17865
7780 1 12 . 1 1 92 92 ALA N N 117 122.784 122.784 123.994 -1.210 17865
7781 1 12 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.065 -0.042 17865
7782 1 12 . 1 1 92 92 ALA C C 117 178.789 178.789 179.434 -0.645 17865
7783 1 12 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.120 -0.069 17865
7784 1 12 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.358 0.817 17865
7785 1 12 . 1 1 92 92 ALA H H 117 8.703 8.703 7.827 0.876 17865
7786 1 12 . 1 1 93 93 GLN N N 118 115.510 115.510 116.350 -0.840 17865
7787 1 12 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.143 -0.199 17865
7788 1 12 . 1 1 93 93 GLN C C 118 178.745 178.745 177.391 1.354 17865
7789 1 12 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.769 0.713 17865
7790 1 12 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.259 0.138 17865
7791 1 12 . 1 1 93 93 GLN H H 118 7.664 7.664 8.576 -0.912 17865
7792 1 12 . 1 1 94 94 THR N N 119 110.110 110.110 114.368 -4.258 17865
7793 1 12 . 1 1 94 94 THR HA H 119 4.237 4.237 4.208 0.029 17865
7794 1 12 . 1 1 94 94 THR C C 119 175.861 175.861 175.754 0.107 17865
7795 1 12 . 1 1 94 94 THR CA C 119 64.604 64.604 64.935 -0.331 17865
7796 1 12 . 1 1 94 94 THR CB C 119 69.716 69.716 69.085 0.631 17865
7797 1 12 . 1 1 94 94 THR H H 119 7.726 7.726 7.543 0.183 17865
7798 1 12 . 1 1 95 95 CYS N N 120 118.523 118.523 121.642 -3.119 17865
7799 1 12 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.426 0.307 17865
7800 1 12 . 1 1 95 95 CYS C C 120 175.165 175.165 175.508 -0.343 17865
7801 1 12 . 1 1 95 95 CYS CA C 120 52.973 52.973 59.336 -6.363 17865
7802 1 12 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.494 12.237 17865
7803 1 12 . 1 1 95 95 CYS H H 120 7.756 7.756 7.997 -0.240 17865
7804 1 12 . 1 1 96 96 ASP N N 121 119.081 119.081 123.821 -4.740 17865
7805 1 12 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.469 0.209 17865
7806 1 12 . 1 1 96 96 ASP CA C 121 56.224 56.224 56.694 -0.470 17865
7807 1 12 . 1 1 96 96 ASP CB C 121 42.731 42.731 40.869 1.862 17865
7808 1 12 . 1 1 96 96 ASP H H 121 7.354 7.354 8.515 -1.161 17865
7809 1 12 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.448 -0.873 17865
7810 1 12 . 1 1 97 97 LYS C C 122 175.510 175.510 178.371 -2.861 17865
7811 1 12 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.608 0.231 17865
7812 1 12 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.175 -3.425 17865
7813 1 12 . 1 1 98 98 LYS N N 123 119.980 119.980 119.367 0.613 17865
7814 1 12 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.458 -0.164 17865
7815 1 12 . 1 1 98 98 LYS C C 123 176.968 176.968 178.504 -1.536 17865
7816 1 12 . 1 1 98 98 LYS CA C 123 55.904 55.904 57.839 -1.935 17865
7817 1 12 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.821 -0.589 17865
7818 1 12 . 1 1 98 98 LYS H H 123 7.799 7.799 8.197 -0.398 17865
7819 1 12 . 1 1 99 99 TYR N N 124 122.378 122.378 121.888 0.490 17865
7820 1 12 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.268 -0.373 17865
7821 1 12 . 1 1 99 99 TYR C C 124 177.126 177.126 177.621 -0.495 17865
7822 1 12 . 1 1 99 99 TYR CA C 124 60.211 60.211 61.480 -1.269 17865
7823 1 12 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.726 -0.455 17865
7824 1 12 . 1 1 99 99 TYR H H 124 8.536 8.536 8.218 0.318 17865
7825 1 12 . 1 1 100 100 GLU N N 125 118.610 118.610 119.345 -0.735 17865
7826 1 12 . 1 1 100 100 GLU HA H 125 4.268 4.268 3.976 0.292 17865
7827 1 12 . 1 1 100 100 GLU C C 125 177.387 177.387 178.646 -1.259 17865
7828 1 12 . 1 1 100 100 GLU CA C 125 55.759 55.759 60.084 -4.325 17865
7829 1 12 . 1 1 100 100 GLU CB C 125 27.321 27.321 28.709 -1.388 17865
7830 1 12 . 1 1 100 100 GLU H H 125 8.385 8.385 9.036 -0.651 17865
7831 1 12 . 1 1 101 101 SER N N 126 115.949 115.949 115.298 0.651 17865
7832 1 12 . 1 1 101 101 SER HA H 126 3.959 3.959 4.129 -0.170 17865
7833 1 12 . 1 1 101 101 SER C C 126 176.047 176.047 176.142 -0.095 17865
7834 1 12 . 1 1 101 101 SER CA C 126 62.439 62.439 62.390 0.049 17865
7835 1 12 . 1 1 101 101 SER CB C 126 63.299 63.299 62.745 0.554 17865
7836 1 12 . 1 1 101 101 SER H H 126 7.823 7.823 8.154 -0.331 17865
7837 1 12 . 1 1 102 102 ASP N N 127 120.920 120.920 122.035 -1.115 17865
7838 1 12 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.243 0.164 17865
7839 1 12 . 1 1 102 102 ASP C C 127 178.234 178.234 177.978 0.256 17865
7840 1 12 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.344 0.067 17865
7841 1 12 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.485 -0.769 17865
7842 1 12 . 1 1 102 102 ASP H H 127 8.683 8.683 7.661 1.022 17865
7843 1 12 . 1 1 103 103 LYS N N 128 121.753 121.753 118.181 3.572 17865
7844 1 12 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.066 -0.062 17865
7845 1 12 . 1 1 103 103 LYS C C 128 179.395 179.395 178.572 0.823 17865
7846 1 12 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.236 1.235 17865
7847 1 12 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.767 0.634 17865
7848 1 12 . 1 1 103 103 LYS H H 128 7.771 7.771 7.495 0.276 17865
7849 1 12 . 1 1 104 104 CYS N N 129 120.109 120.109 119.257 0.852 17865
7850 1 12 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.422 -0.228 17865
7851 1 12 . 1 1 104 104 CYS C C 129 176.779 176.779 176.491 0.288 17865
7852 1 12 . 1 1 104 104 CYS CA C 129 59.790 59.790 60.587 -0.797 17865
7853 1 12 . 1 1 104 104 CYS CB C 129 36.879 36.879 26.806 10.073 17865
7854 1 12 . 1 1 104 104 CYS H H 129 7.973 7.973 7.989 -0.016 17865
7855 1 12 . 1 1 105 105 LEU N N 130 121.804 121.804 123.072 -1.268 17865
7856 1 12 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.908 0.182 17865
7857 1 12 . 1 1 105 105 LEU C C 130 179.373 179.373 178.361 1.012 17865
7858 1 12 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.488 -1.120 17865
7859 1 12 . 1 1 105 105 LEU CB C 130 42.098 42.098 42.258 -0.160 17865
7860 1 12 . 1 1 105 105 LEU H H 130 8.666 8.666 8.589 0.077 17865
7861 1 12 . 1 1 106 106 ASN N N 131 118.535 118.535 115.997 2.538 17865
7862 1 12 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.414 -0.176 17865
7863 1 12 . 1 1 106 106 ASN C C 131 177.830 177.830 177.247 0.583 17865
7864 1 12 . 1 1 106 106 ASN CA C 131 56.256 56.256 55.888 0.368 17865
7865 1 12 . 1 1 106 106 ASN CB C 131 37.817 37.817 37.894 -0.077 17865
7866 1 12 . 1 1 106 106 ASN H H 131 8.438 8.438 8.158 0.280 17865
7867 1 12 . 1 1 107 107 ALA N N 132 121.485 121.485 123.142 -1.657 17865
7868 1 12 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.222 -0.003 17865
7869 1 12 . 1 1 107 107 ALA C C 132 180.726 180.726 179.529 1.197 17865
7870 1 12 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.477 0.486 17865
7871 1 12 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.935 -1.114 17865
7872 1 12 . 1 1 107 107 ALA H H 132 7.541 7.541 7.440 0.101 17865
7873 1 12 . 1 1 108 108 ILE N N 133 120.979 120.979 117.400 3.579 17865
7874 1 12 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.775 0.156 17865
7875 1 12 . 1 1 108 108 ILE C C 133 178.114 178.114 177.874 0.240 17865
7876 1 12 . 1 1 108 108 ILE CA C 133 63.353 63.353 63.675 -0.322 17865
7877 1 12 . 1 1 108 108 ILE CB C 133 36.454 36.454 36.747 -0.293 17865
7878 1 12 . 1 1 108 108 ILE H H 133 7.551 7.551 8.549 -0.998 17865
7879 1 12 . 1 1 109 109 LYS N N 134 121.415 121.415 117.606 3.809 17865
7880 1 12 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.240 -0.652 17865
7881 1 12 . 1 1 109 109 LYS C C 134 179.561 179.561 179.114 0.447 17865
7882 1 12 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.358 0.750 17865
7883 1 12 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.478 -0.317 17865
7884 1 12 . 1 1 109 109 LYS H H 134 8.414 8.414 7.634 0.780 17865
7885 1 12 . 1 1 110 110 GLU N N 135 116.099 116.099 119.136 -3.037 17865
7886 1 12 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.228 -0.299 17865
7887 1 12 . 1 1 110 110 GLU C C 135 178.239 178.239 178.770 -0.531 17865
7888 1 12 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.534 0.112 17865
7889 1 12 . 1 1 110 110 GLU CB C 135 29.638 29.638 28.918 0.720 17865
7890 1 12 . 1 1 110 110 GLU H H 135 7.473 7.473 7.928 -0.455 17865
7891 1 12 . 1 1 111 111 LYS N N 136 119.805 119.805 118.967 0.838 17865
7892 1 12 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.030 -0.124 17865
7893 1 12 . 1 1 111 111 LYS C C 136 177.600 177.600 176.649 0.951 17865
7894 1 12 . 1 1 111 111 LYS CA C 136 58.749 58.749 57.449 1.300 17865
7895 1 12 . 1 1 111 111 LYS CB C 136 33.238 33.238 31.976 1.262 17865
7896 1 12 . 1 1 111 111 LYS H H 136 7.540 7.540 7.543 -0.003 17865
7897 1 12 . 1 1 112 112 TYR N N 137 114.768 114.768 117.475 -2.707 17865
7898 1 12 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.616 -0.093 17865
7899 1 12 . 1 1 112 112 TYR C C 137 174.690 174.690 175.352 -0.662 17865
7900 1 12 . 1 1 112 112 TYR CA C 137 58.359 58.359 56.980 1.379 17865
7901 1 12 . 1 1 112 112 TYR CB C 137 38.328 38.328 38.282 0.046 17865
7902 1 12 . 1 1 112 112 TYR H H 137 7.488 7.488 7.492 -0.004 17865
7903 1 12 . 1 1 113 113 LYS N N 138 123.694 123.694 121.201 2.493 17865
7904 1 12 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.798 -0.297 17865
7905 1 12 . 1 1 113 113 LYS CA C 138 55.282 55.282 53.204 2.078 17865
7906 1 12 . 1 1 113 113 LYS CB C 138 32.124 32.124 32.204 -0.080 17865
7907 1 12 . 1 1 113 113 LYS H H 138 7.217 7.217 7.733 -0.516 17865
7908 1 12 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.541 -0.089 17865
7909 1 12 . 1 1 114 114 PRO C C 139 176.974 176.974 176.616 0.358 17865
7910 1 12 . 1 1 114 114 PRO CA C 139 63.189 63.189 62.922 0.267 17865
7911 1 12 . 1 1 114 114 PRO CB C 139 32.251 32.251 30.672 1.579 17865
7912 1 12 . 1 1 115 115 VAL N N 140 121.098 121.098 120.827 0.271 17865
7913 1 12 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.033 0.069 17865
7914 1 12 . 1 1 115 115 VAL C C 140 176.207 176.207 176.028 0.179 17865
7915 1 12 . 1 1 115 115 VAL CA C 140 62.356 62.356 63.506 -1.150 17865
7916 1 12 . 1 1 115 115 VAL CB C 140 33.256 33.256 32.180 1.076 17865
7917 1 12 . 1 1 115 115 VAL H H 140 8.272 8.272 7.975 0.297 17865
7918 1 12 . 1 1 116 116 VAL N N 141 124.167 124.167 122.182 1.985 17865
7919 1 12 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.048 0.074 17865
7920 1 12 . 1 1 116 116 VAL C C 141 175.415 175.415 175.353 0.062 17865
7921 1 12 . 1 1 116 116 VAL CA C 141 61.731 61.731 62.144 -0.413 17865
7922 1 12 . 1 1 116 116 VAL CB C 141 33.145 33.145 30.094 3.051 17865
7923 1 12 . 1 1 116 116 VAL H H 141 8.142 8.142 7.578 0.564 17865
7924 1 12 . 1 1 117 117 ASP N N 142 126.737 126.737 129.365 -2.628 17865
7925 1 12 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.952 -0.140 17865
7926 1 12 . 1 1 117 117 ASP CA C 142 52.217 52.217 51.336 0.881 17865
7927 1 12 . 1 1 117 117 ASP CB C 142 41.368 41.368 43.062 -1.694 17865
7928 1 12 . 1 1 117 117 ASP H H 142 8.419 8.419 8.003 0.416 17865
7929 1 12 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.278 0.133 17865
7930 1 12 . 1 1 118 118 PRO C C 143 176.662 176.662 176.012 0.650 17865
7931 1 12 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.279 -0.032 17865
7932 1 12 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.035 0.275 17865
7933 1 12 . 1 1 119 119 ASN N N 144 119.287 119.287 122.504 -3.217 17865
7934 1 12 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.704 0.243 17865
7935 1 12 . 1 1 119 119 ASN CA C 144 51.633 51.633 52.059 -0.425 17865
7936 1 12 . 1 1 119 119 ASN CB C 144 38.859 38.859 38.444 0.415 17865
7937 1 12 . 1 1 119 119 ASN H H 144 8.432 8.432 8.326 0.106 17865
7938 1 12 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.552 0.128 17865
7939 1 12 . 1 1 120 120 PRO CA C 145 61.640 61.640 62.260 -0.620 17865
7940 1 12 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.166 -0.248 17865
7941 1 12 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.432 -0.055 17865
7942 1 12 . 1 1 121 121 PRO C C 146 175.876 175.876 176.640 -0.764 17865
7943 1 12 . 1 1 121 121 PRO CA C 146 63.174 63.174 62.440 0.734 17865
7944 1 12 . 1 1 121 121 PRO CB C 146 31.939 31.939 31.976 -0.037 17865
7945 1 13 . 1 1 2 2 ASP N N 27 121.041 121.041 119.923 1.118 17865
7946 1 13 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.816 -0.178 17865
7947 1 13 . 1 1 2 2 ASP C C 27 175.878 175.878 174.773 1.105 17865
7948 1 13 . 1 1 2 2 ASP CA C 27 54.382 54.382 54.067 0.315 17865
7949 1 13 . 1 1 2 2 ASP CB C 27 41.729 41.729 41.860 -0.131 17865
7950 1 13 . 1 1 2 2 ASP H H 27 8.639 8.639 8.357 0.282 17865
7951 1 13 . 1 1 3 3 VAL N N 28 119.901 119.901 121.838 -1.937 17865
7952 1 13 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.154 -0.121 17865
7953 1 13 . 1 1 3 3 VAL C C 28 175.521 175.521 174.396 1.125 17865
7954 1 13 . 1 1 3 3 VAL CA C 28 62.216 62.216 62.141 0.075 17865
7955 1 13 . 1 1 3 3 VAL CB C 28 33.003 33.003 33.484 -0.481 17865
7956 1 13 . 1 1 3 3 VAL H H 28 8.113 8.113 8.117 -0.004 17865
7957 1 13 . 1 1 4 4 PHE N N 29 123.707 123.707 124.707 -1.000 17865
7958 1 13 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.791 -0.135 17865
7959 1 13 . 1 1 4 4 PHE C C 29 174.874 174.874 175.526 -0.652 17865
7960 1 13 . 1 1 4 4 PHE CA C 29 57.159 57.159 57.543 -0.384 17865
7961 1 13 . 1 1 4 4 PHE CB C 29 39.795 39.795 40.242 -0.447 17865
7962 1 13 . 1 1 4 4 PHE H H 29 8.255 8.255 8.426 -0.171 17865
7963 1 13 . 1 1 5 5 ASP N N 30 124.203 124.203 123.810 0.393 17865
7964 1 13 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.707 0.131 17865
7965 1 13 . 1 1 5 5 ASP CA C 30 52.385 52.385 52.823 -0.438 17865
7966 1 13 . 1 1 5 5 ASP CB C 30 40.801 40.801 42.018 -1.217 17865
7967 1 13 . 1 1 5 5 ASP H H 30 8.226 8.226 8.463 -0.237 17865
7968 1 13 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.593 -0.056 17865
7969 1 13 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.257 -0.593 17865
7970 1 13 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.445 -0.619 17865
7971 1 13 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.349 0.077 17865
7972 1 13 . 1 1 7 7 PRO C C 32 177.226 177.226 177.097 0.129 17865
7973 1 13 . 1 1 7 7 PRO CA C 32 63.169 63.169 64.079 -0.910 17865
7974 1 13 . 1 1 7 7 PRO CB C 32 31.948 31.948 31.993 -0.045 17865
7975 1 13 . 1 1 8 8 THR N N 33 114.158 114.158 119.937 -5.779 17865
7976 1 13 . 1 1 8 8 THR HA H 33 4.195 4.195 4.134 0.061 17865
7977 1 13 . 1 1 8 8 THR C C 33 174.468 174.468 176.475 -2.007 17865
7978 1 13 . 1 1 8 8 THR CA C 33 62.110 62.110 65.176 -3.066 17865
7979 1 13 . 1 1 8 8 THR CB C 33 69.975 69.975 68.410 1.565 17865
7980 1 13 . 1 1 8 8 THR H H 33 8.096 8.096 8.515 -0.419 17865
7981 1 13 . 1 1 9 9 GLN N N 34 122.411 122.411 118.906 3.505 17865
7982 1 13 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.001 0.262 17865
7983 1 13 . 1 1 9 9 GLN C C 34 175.445 175.445 175.950 -0.505 17865
7984 1 13 . 1 1 9 9 GLN CA C 34 55.763 55.763 56.853 -1.090 17865
7985 1 13 . 1 1 9 9 GLN CB C 34 29.691 29.691 27.210 2.481 17865
7986 1 13 . 1 1 9 9 GLN H H 34 8.278 8.278 8.703 -0.425 17865
7987 1 13 . 1 1 10 10 TYR N N 35 121.048 121.048 117.208 3.840 17865
7988 1 13 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.384 0.136 17865
7989 1 13 . 1 1 10 10 TYR C C 35 176.314 176.314 176.252 0.062 17865
7990 1 13 . 1 1 10 10 TYR CA C 35 57.972 57.972 57.931 0.041 17865
7991 1 13 . 1 1 10 10 TYR CB C 35 38.936 38.936 39.127 -0.191 17865
7992 1 13 . 1 1 10 10 TYR H H 35 8.227 8.227 7.308 0.919 17865
7993 1 13 . 1 1 11 11 GLY N N 36 109.711 109.711 109.375 0.336 17865
7994 1 13 . 1 1 11 11 GLY C C 36 174.128 174.128 174.416 -0.288 17865
7995 1 13 . 1 1 11 11 GLY CA C 36 45.212 45.212 46.393 -1.181 17865
7996 1 13 . 1 1 11 11 GLY H H 36 8.247 8.247 8.075 0.172 17865
7997 1 13 . 1 1 12 12 TYR N N 37 120.302 120.302 120.591 -0.289 17865
7998 1 13 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.867 -0.385 17865
7999 1 13 . 1 1 12 12 TYR C C 37 175.864 175.864 174.643 1.221 17865
8000 1 13 . 1 1 12 12 TYR CA C 37 58.541 58.541 55.452 3.089 17865
8001 1 13 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.966 -1.251 17865
8002 1 13 . 1 1 12 12 TYR H H 37 8.101 8.101 7.236 0.865 17865
8003 1 13 . 1 1 13 13 ASP N N 38 121.883 121.883 120.389 1.494 17865
8004 1 13 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.483 0.003 17865
8005 1 13 . 1 1 13 13 ASP C C 38 176.538 176.538 175.519 1.019 17865
8006 1 13 . 1 1 13 13 ASP CA C 38 54.223 54.223 55.508 -1.285 17865
8007 1 13 . 1 1 13 13 ASP CB C 38 40.988 40.988 41.546 -0.558 17865
8008 1 13 . 1 1 13 13 ASP H H 38 8.266 8.266 7.761 0.505 17865
8009 1 13 . 1 1 14 14 GLY N N 39 107.705 107.705 112.242 -4.537 17865
8010 1 13 . 1 1 14 14 GLY C C 39 173.822 173.822 173.142 0.680 17865
8011 1 13 . 1 1 14 14 GLY CA C 39 45.404 45.404 44.677 0.727 17865
8012 1 13 . 1 1 14 14 GLY H H 39 7.647 7.647 7.835 -0.188 17865
8013 1 13 . 1 1 15 15 LYS N N 40 121.621 121.621 122.550 -0.929 17865
8014 1 13 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.731 -0.156 17865
8015 1 13 . 1 1 15 15 LYS CA C 40 54.100 54.100 52.836 1.264 17865
8016 1 13 . 1 1 15 15 LYS CB C 40 32.510 32.510 33.384 -0.874 17865
8017 1 13 . 1 1 15 15 LYS H H 40 7.908 7.908 7.959 -0.051 17865
8018 1 13 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.700 -0.348 17865
8019 1 13 . 1 1 16 16 PRO C C 41 176.806 176.806 177.766 -0.960 17865
8020 1 13 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.928 -0.170 17865
8021 1 13 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.162 0.152 17865
8022 1 13 . 1 1 17 17 LEU N N 42 123.488 123.488 120.350 3.138 17865
8023 1 13 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.534 -0.485 17865
8024 1 13 . 1 1 17 17 LEU C C 42 174.973 174.973 176.513 -1.540 17865
8025 1 13 . 1 1 17 17 LEU CA C 42 55.436 55.436 55.925 -0.489 17865
8026 1 13 . 1 1 17 17 LEU CB C 42 42.093 42.093 41.217 0.876 17865
8027 1 13 . 1 1 17 17 LEU H H 42 8.499 8.499 8.109 0.390 17865
8028 1 13 . 1 1 18 18 ASP N N 43 123.354 123.354 123.357 -0.003 17865
8029 1 13 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.755 -0.257 17865
8030 1 13 . 1 1 18 18 ASP C C 43 175.947 175.947 177.042 -1.095 17865
8031 1 13 . 1 1 18 18 ASP CA C 43 52.858 52.858 53.428 -0.570 17865
8032 1 13 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.802 -2.581 17865
8033 1 13 . 1 1 18 18 ASP H H 43 7.789 7.789 7.795 -0.006 17865
8034 1 13 . 1 1 19 19 ALA N N 44 120.147 120.147 122.760 -2.613 17865
8035 1 13 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.145 -0.159 17865
8036 1 13 . 1 1 19 19 ALA C C 44 179.476 179.476 179.143 0.333 17865
8037 1 13 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.615 0.548 17865
8038 1 13 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.754 -0.367 17865
8039 1 13 . 1 1 19 19 ALA H H 44 8.561 8.561 8.667 -0.106 17865
8040 1 13 . 1 1 20 20 SER N N 45 115.037 115.037 115.950 -0.913 17865
8041 1 13 . 1 1 20 20 SER HA H 45 4.151 4.151 4.171 -0.020 17865
8042 1 13 . 1 1 20 20 SER C C 45 177.191 177.191 176.721 0.470 17865
8043 1 13 . 1 1 20 20 SER CA C 45 61.629 61.629 61.264 0.365 17865
8044 1 13 . 1 1 20 20 SER CB C 45 62.804 62.804 63.121 -0.317 17865
8045 1 13 . 1 1 20 20 SER H H 45 8.466 8.466 8.222 0.244 17865
8046 1 13 . 1 1 21 21 PHE N N 46 125.030 125.030 122.743 2.287 17865
8047 1 13 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.387 -0.156 17865
8048 1 13 . 1 1 21 21 PHE C C 46 176.850 176.850 175.920 0.930 17865
8049 1 13 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.612 0.194 17865
8050 1 13 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.655 0.226 17865
8051 1 13 . 1 1 21 21 PHE H H 46 8.034 8.034 7.905 0.129 17865
8052 1 13 . 1 1 22 22 CYS N N 47 113.943 113.943 116.669 -2.726 17865
8053 1 13 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.371 -0.120 17865
8054 1 13 . 1 1 22 22 CYS C C 47 176.449 176.449 176.694 -0.245 17865
8055 1 13 . 1 1 22 22 CYS CA C 47 53.600 53.600 58.514 -4.914 17865
8056 1 13 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.398 10.993 17865
8057 1 13 . 1 1 22 22 CYS H H 47 7.691 7.691 7.810 -0.119 17865
8058 1 13 . 1 1 23 23 ARG N N 48 119.958 119.958 121.844 -1.886 17865
8059 1 13 . 1 1 23 23 ARG HA H 48 4.080 4.080 3.966 0.114 17865
8060 1 13 . 1 1 23 23 ARG C C 48 177.904 177.904 177.541 0.363 17865
8061 1 13 . 1 1 23 23 ARG CA C 48 58.907 58.907 59.376 -0.469 17865
8062 1 13 . 1 1 23 23 ARG CB C 48 30.171 30.171 30.066 0.105 17865
8063 1 13 . 1 1 23 23 ARG H H 48 7.628 7.628 7.669 -0.041 17865
8064 1 13 . 1 1 24 24 THR N N 49 106.445 106.445 108.284 -1.839 17865
8065 1 13 . 1 1 24 24 THR HA H 49 4.385 4.385 4.304 0.081 17865
8066 1 13 . 1 1 24 24 THR C C 49 174.758 174.758 175.275 -0.517 17865
8067 1 13 . 1 1 24 24 THR CA C 49 61.573 61.573 62.335 -0.762 17865
8068 1 13 . 1 1 24 24 THR CB C 49 68.794 68.794 68.800 -0.006 17865
8069 1 13 . 1 1 24 24 THR H H 49 7.307 7.307 7.517 -0.210 17865
8070 1 13 . 1 1 25 25 ALA N N 50 122.242 122.242 123.490 -1.248 17865
8071 1 13 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.157 0.247 17865
8072 1 13 . 1 1 25 25 ALA C C 50 178.554 178.554 177.904 0.650 17865
8073 1 13 . 1 1 25 25 ALA CA C 50 52.381 52.381 53.459 -1.078 17865
8074 1 13 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.412 -1.017 17865
8075 1 13 . 1 1 25 25 ALA H H 50 7.401 7.401 7.437 -0.036 17865
8076 1 13 . 1 1 26 26 GLY N N 51 110.604 110.604 106.698 3.906 17865
8077 1 13 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.362 0.660 17865
8078 1 13 . 1 1 26 26 GLY H H 51 8.285 8.285 7.852 0.433 17865
8079 1 13 . 1 1 27 27 SER HA H 52 4.382 4.382 4.348 0.034 17865
8080 1 13 . 1 1 27 27 SER C C 52 175.774 175.774 175.372 0.402 17865
8081 1 13 . 1 1 27 27 SER CA C 52 60.803 60.803 60.339 0.464 17865
8082 1 13 . 1 1 27 27 SER CB C 52 62.827 62.827 63.175 -0.347 17865
8083 1 13 . 1 1 28 28 ARG N N 53 119.682 119.682 118.316 1.366 17865
8084 1 13 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.673 0.207 17865
8085 1 13 . 1 1 28 28 ARG C C 53 175.796 175.796 176.294 -0.498 17865
8086 1 13 . 1 1 28 28 ARG CA C 53 55.738 55.738 55.150 0.588 17865
8087 1 13 . 1 1 28 28 ARG CB C 53 30.237 30.237 29.329 0.908 17865
8088 1 13 . 1 1 28 28 ARG H H 53 7.894 7.894 8.170 -0.276 17865
8089 1 13 . 1 1 29 29 GLU N N 54 122.318 122.318 121.836 0.482 17865
8090 1 13 . 1 1 29 29 GLU HA H 54 3.595 3.595 4.087 -0.492 17865
8091 1 13 . 1 1 29 29 GLU C C 54 177.523 177.523 177.943 -0.420 17865
8092 1 13 . 1 1 29 29 GLU CA C 54 61.223 61.223 60.048 1.175 17865
8093 1 13 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.585 -0.648 17865
8094 1 13 . 1 1 29 29 GLU H H 54 7.730 7.730 7.694 0.036 17865
8095 1 13 . 1 1 30 30 LYS N N 55 118.377 118.377 117.722 0.655 17865
8096 1 13 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.090 -0.262 17865
8097 1 13 . 1 1 30 30 LYS C C 55 179.205 179.205 178.778 0.427 17865
8098 1 13 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.348 1.079 17865
8099 1 13 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.120 -0.518 17865
8100 1 13 . 1 1 30 30 LYS H H 55 8.659 8.659 8.436 0.223 17865
8101 1 13 . 1 1 31 31 ASP N N 56 121.614 121.614 119.646 1.968 17865
8102 1 13 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.535 -0.224 17865
8103 1 13 . 1 1 31 31 ASP C C 56 177.393 177.393 177.861 -0.468 17865
8104 1 13 . 1 1 31 31 ASP CA C 56 57.316 57.316 57.050 0.266 17865
8105 1 13 . 1 1 31 31 ASP CB C 56 40.423 40.423 41.020 -0.597 17865
8106 1 13 . 1 1 31 31 ASP H H 56 7.646 7.646 8.233 -0.587 17865
8107 1 13 . 1 1 32 32 CYS N N 57 120.345 120.345 119.442 0.903 17865
8108 1 13 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.820 -0.219 17865
8109 1 13 . 1 1 32 32 CYS C C 57 175.772 175.772 176.416 -0.644 17865
8110 1 13 . 1 1 32 32 CYS CA C 57 60.197 60.197 60.839 -0.642 17865
8111 1 13 . 1 1 32 32 CYS CB C 57 33.966 33.966 26.027 7.939 17865
8112 1 13 . 1 1 32 32 CYS H H 57 8.042 8.042 7.885 0.157 17865
8113 1 13 . 1 1 33 33 ARG N N 58 120.293 120.293 119.534 0.759 17865
8114 1 13 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.882 -0.206 17865
8115 1 13 . 1 1 33 33 ARG C C 58 179.633 179.633 178.634 0.999 17865
8116 1 13 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.190 1.196 17865
8117 1 13 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.227 0.614 17865
8118 1 13 . 1 1 33 33 ARG H H 58 8.531 8.531 8.324 0.207 17865
8119 1 13 . 1 1 34 34 LYS N N 59 121.166 121.166 119.594 1.572 17865
8120 1 13 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.146 -0.110 17865
8121 1 13 . 1 1 34 34 LYS C C 59 179.220 179.220 178.496 0.724 17865
8122 1 13 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.794 0.736 17865
8123 1 13 . 1 1 34 34 LYS CB C 59 32.110 32.110 32.188 -0.078 17865
8124 1 13 . 1 1 34 34 LYS H H 59 7.633 7.633 7.510 0.123 17865
8125 1 13 . 1 1 35 35 ASP N N 60 122.166 122.166 119.759 2.407 17865
8126 1 13 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.478 -0.047 17865
8127 1 13 . 1 1 35 35 ASP C C 60 179.709 179.709 178.820 0.889 17865
8128 1 13 . 1 1 35 35 ASP CA C 60 57.703 57.703 56.971 0.732 17865
8129 1 13 . 1 1 35 35 ASP CB C 60 40.672 40.672 41.199 -0.527 17865
8130 1 13 . 1 1 35 35 ASP H H 60 8.221 8.221 7.618 0.603 17865
8131 1 13 . 1 1 36 36 VAL N N 61 121.312 121.312 119.352 1.960 17865
8132 1 13 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.771 -0.370 17865
8133 1 13 . 1 1 36 36 VAL C C 61 178.339 178.339 177.250 1.089 17865
8134 1 13 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.092 2.041 17865
8135 1 13 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.995 -0.338 17865
8136 1 13 . 1 1 36 36 VAL H H 61 8.916 8.916 8.372 0.544 17865
8137 1 13 . 1 1 37 37 GLN N N 62 119.166 119.166 116.483 2.683 17865
8138 1 13 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.047 -0.105 17865
8139 1 13 . 1 1 37 37 GLN C C 62 177.293 177.293 177.474 -0.181 17865
8140 1 13 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.374 0.906 17865
8141 1 13 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.145 0.226 17865
8142 1 13 . 1 1 37 37 GLN H H 62 7.697 7.697 7.631 0.066 17865
8143 1 13 . 1 1 38 38 ALA N N 63 118.964 118.964 121.114 -2.150 17865
8144 1 13 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.240 0.002 17865
8145 1 13 . 1 1 38 38 ALA C C 63 177.221 177.221 177.898 -0.677 17865
8146 1 13 . 1 1 38 38 ALA CA C 63 53.137 53.137 53.378 -0.241 17865
8147 1 13 . 1 1 38 38 ALA CB C 63 18.897 18.897 18.988 -0.091 17865
8148 1 13 . 1 1 38 38 ALA H H 63 7.508 7.508 7.455 0.053 17865
8149 1 13 . 1 1 39 39 CYS N N 64 119.081 119.081 119.231 -0.150 17865
8150 1 13 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.416 0.537 17865
8151 1 13 . 1 1 39 39 CYS C C 64 172.052 172.052 175.199 -3.147 17865
8152 1 13 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.202 -6.322 17865
8153 1 13 . 1 1 39 39 CYS CB C 64 34.328 34.328 24.877 9.451 17865
8154 1 13 . 1 1 39 39 CYS H H 64 7.354 7.354 7.602 -0.248 17865
8155 1 13 . 1 1 40 40 ASP N N 65 124.167 124.167 127.214 -3.047 17865
8156 1 13 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.399 -0.074 17865
8157 1 13 . 1 1 40 40 ASP C C 65 176.496 176.496 175.970 0.526 17865
8158 1 13 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.408 0.316 17865
8159 1 13 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.645 -0.332 17865
8160 1 13 . 1 1 40 40 ASP H H 65 8.142 8.142 8.299 -0.157 17865
8161 1 13 . 1 1 41 41 LYS N N 66 118.844 118.844 118.665 0.179 17865
8162 1 13 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.548 -0.024 17865
8163 1 13 . 1 1 41 41 LYS C C 66 175.586 175.586 176.540 -0.954 17865
8164 1 13 . 1 1 41 41 LYS CA C 66 55.275 55.275 55.491 -0.216 17865
8165 1 13 . 1 1 41 41 LYS CB C 66 32.598 32.598 32.594 0.004 17865
8166 1 13 . 1 1 41 41 LYS H H 66 7.858 7.858 8.151 -0.293 17865
8167 1 13 . 1 1 42 42 LYS N N 67 126.081 126.081 122.802 3.279 17865
8168 1 13 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.213 -0.298 17865
8169 1 13 . 1 1 42 42 LYS C C 67 174.665 174.665 175.268 -0.603 17865
8170 1 13 . 1 1 42 42 LYS CA C 67 57.827 57.827 56.823 1.004 17865
8171 1 13 . 1 1 42 42 LYS CB C 67 34.059 34.059 33.021 1.038 17865
8172 1 13 . 1 1 42 42 LYS H H 67 8.790 8.790 8.820 -0.030 17865
8173 1 13 . 1 1 43 43 TYR N N 68 114.138 114.138 116.400 -2.262 17865
8174 1 13 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.814 0.445 17865
8175 1 13 . 1 1 43 43 TYR C C 68 175.767 175.767 175.181 0.586 17865
8176 1 13 . 1 1 43 43 TYR CA C 68 55.880 55.880 56.347 -0.467 17865
8177 1 13 . 1 1 43 43 TYR CB C 68 42.363 42.363 40.589 1.774 17865
8178 1 13 . 1 1 43 43 TYR H H 68 7.294 7.294 7.429 -0.135 17865
8179 1 13 . 1 1 44 44 ASP N N 69 121.807 121.807 122.180 -0.373 17865
8180 1 13 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.616 0.024 17865
8181 1 13 . 1 1 44 44 ASP C C 69 177.812 177.812 177.865 -0.053 17865
8182 1 13 . 1 1 44 44 ASP CA C 69 52.110 52.110 54.102 -1.992 17865
8183 1 13 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.135 -1.695 17865
8184 1 13 . 1 1 44 44 ASP H H 69 8.995 8.995 9.033 -0.038 17865
8185 1 13 . 1 1 45 45 ASP N N 70 116.686 116.686 122.552 -5.866 17865
8186 1 13 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.436 -0.012 17865
8187 1 13 . 1 1 45 45 ASP C C 70 177.054 177.054 176.949 0.105 17865
8188 1 13 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.653 -0.272 17865
8189 1 13 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.749 -0.501 17865
8190 1 13 . 1 1 45 45 ASP H H 70 8.369 8.369 8.796 -0.427 17865
8191 1 13 . 1 1 46 46 GLN N N 71 117.949 117.949 115.757 2.192 17865
8192 1 13 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.423 0.033 17865
8193 1 13 . 1 1 46 46 GLN C C 71 176.273 176.273 176.586 -0.313 17865
8194 1 13 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.529 -0.162 17865
8195 1 13 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.880 -0.549 17865
8196 1 13 . 1 1 46 46 GLN H H 71 8.274 8.274 7.757 0.517 17865
8197 1 13 . 1 1 47 47 GLY N N 72 108.369 108.369 108.059 0.310 17865
8198 1 13 . 1 1 47 47 GLY C C 72 174.145 174.145 173.531 0.614 17865
8199 1 13 . 1 1 47 47 GLY CA C 72 45.823 45.823 44.763 1.060 17865
8200 1 13 . 1 1 47 47 GLY H H 72 8.174 8.174 8.099 0.075 17865
8201 1 13 . 1 1 48 48 ARG N N 73 121.554 121.554 119.441 2.113 17865
8202 1 13 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.563 -0.078 17865
8203 1 13 . 1 1 48 48 ARG C C 73 176.855 176.855 175.594 1.261 17865
8204 1 13 . 1 1 48 48 ARG CA C 73 55.289 55.289 54.448 0.841 17865
8205 1 13 . 1 1 48 48 ARG CB C 73 30.558 30.558 30.743 -0.185 17865
8206 1 13 . 1 1 48 48 ARG H H 73 8.462 8.462 8.016 0.446 17865
8207 1 13 . 1 1 49 49 GLU N N 74 122.784 122.784 123.886 -1.102 17865
8208 1 13 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.321 0.162 17865
8209 1 13 . 1 1 49 49 GLU C C 74 178.098 178.098 176.892 1.206 17865
8210 1 13 . 1 1 49 49 GLU CA C 74 57.184 57.184 57.283 -0.099 17865
8211 1 13 . 1 1 49 49 GLU CB C 74 30.777 30.777 30.099 0.678 17865
8212 1 13 . 1 1 49 49 GLU H H 74 8.703 8.703 8.654 0.049 17865
8213 1 13 . 1 1 50 50 THR N N 75 114.563 114.563 114.921 -0.358 17865
8214 1 13 . 1 1 50 50 THR HA H 75 4.212 4.212 4.408 -0.196 17865
8215 1 13 . 1 1 50 50 THR C C 75 175.170 175.170 175.391 -0.221 17865
8216 1 13 . 1 1 50 50 THR CA C 75 60.589 60.589 60.820 -0.231 17865
8217 1 13 . 1 1 50 50 THR CB C 75 70.952 70.952 70.384 0.568 17865
8218 1 13 . 1 1 50 50 THR H H 75 7.717 7.717 7.871 -0.154 17865
8219 1 13 . 1 1 51 51 ALA N N 76 122.097 122.097 123.359 -1.262 17865
8220 1 13 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.027 0.011 17865
8221 1 13 . 1 1 51 51 ALA C C 76 181.906 181.906 179.479 2.427 17865
8222 1 13 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.200 0.454 17865
8223 1 13 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.256 -0.263 17865
8224 1 13 . 1 1 51 51 ALA H H 76 8.734 8.734 8.662 0.072 17865
8225 1 13 . 1 1 52 52 CYS N N 77 115.347 115.347 115.324 0.023 17865
8226 1 13 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.301 0.179 17865
8227 1 13 . 1 1 52 52 CYS C C 77 176.299 176.299 176.909 -0.610 17865
8228 1 13 . 1 1 52 52 CYS CA C 77 57.701 57.701 59.463 -1.762 17865
8229 1 13 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.756 9.876 17865
8230 1 13 . 1 1 52 52 CYS H H 77 9.073 9.073 8.197 0.876 17865
8231 1 13 . 1 1 53 53 ALA N N 78 128.517 128.517 124.420 4.097 17865
8232 1 13 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.867 -0.012 17865
8233 1 13 . 1 1 53 53 ALA C C 78 178.736 178.736 179.094 -0.358 17865
8234 1 13 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.017 0.616 17865
8235 1 13 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.922 1.269 17865
8236 1 13 . 1 1 53 53 ALA H H 78 7.174 7.174 7.825 -0.651 17865
8237 1 13 . 1 1 54 54 LYS N N 79 118.706 118.706 119.459 -0.753 17865
8238 1 13 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.150 -0.347 17865
8239 1 13 . 1 1 54 54 LYS C C 79 179.611 179.611 178.939 0.672 17865
8240 1 13 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.820 0.905 17865
8241 1 13 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.525 0.128 17865
8242 1 13 . 1 1 54 54 LYS H H 79 8.313 8.313 7.793 0.520 17865
8243 1 13 . 1 1 55 55 GLY N N 80 104.822 104.822 108.339 -3.517 17865
8244 1 13 . 1 1 55 55 GLY C C 80 176.504 176.504 176.021 0.483 17865
8245 1 13 . 1 1 55 55 GLY CA C 80 46.839 46.839 47.050 -0.211 17865
8246 1 13 . 1 1 55 55 GLY H H 80 8.175 8.175 7.723 0.452 17865
8247 1 13 . 1 1 56 56 ILE N N 81 123.697 123.697 123.492 0.205 17865
8248 1 13 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.788 0.007 17865
8249 1 13 . 1 1 56 56 ILE C C 81 177.334 177.334 177.887 -0.553 17865
8250 1 13 . 1 1 56 56 ILE CA C 81 65.281 65.281 65.389 -0.108 17865
8251 1 13 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.881 0.454 17865
8252 1 13 . 1 1 56 56 ILE H H 81 7.590 7.590 8.109 -0.519 17865
8253 1 13 . 1 1 57 57 ARG N N 82 118.161 118.161 118.299 -0.138 17865
8254 1 13 . 1 1 57 57 ARG HA H 82 3.935 3.935 3.900 0.035 17865
8255 1 13 . 1 1 57 57 ARG C C 82 178.662 178.662 177.972 0.690 17865
8256 1 13 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.766 -0.064 17865
8257 1 13 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.518 0.381 17865
8258 1 13 . 1 1 57 57 ARG H H 82 7.569 7.569 7.907 -0.338 17865
8259 1 13 . 1 1 58 58 GLU N N 83 115.085 115.085 119.200 -4.115 17865
8260 1 13 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.209 -0.178 17865
8261 1 13 . 1 1 58 58 GLU C C 83 178.224 178.224 179.364 -1.140 17865
8262 1 13 . 1 1 58 58 GLU CA C 83 58.304 58.304 59.184 -0.880 17865
8263 1 13 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.300 0.731 17865
8264 1 13 . 1 1 58 58 GLU H H 83 7.786 7.786 7.602 0.184 17865
8265 1 13 . 1 1 59 59 LYS N N 84 119.183 119.183 120.356 -1.173 17865
8266 1 13 . 1 1 59 59 LYS HA H 84 3.830 3.830 3.896 -0.066 17865
8267 1 13 . 1 1 59 59 LYS C C 84 177.933 177.933 178.141 -0.208 17865
8268 1 13 . 1 1 59 59 LYS CA C 84 59.043 59.043 59.072 -0.029 17865
8269 1 13 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.569 1.081 17865
8270 1 13 . 1 1 59 59 LYS H H 84 7.968 7.968 8.135 -0.167 17865
8271 1 13 . 1 1 60 60 TYR N N 85 113.663 113.663 115.906 -2.243 17865
8272 1 13 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.767 -0.064 17865
8273 1 13 . 1 1 60 60 TYR C C 85 174.729 174.729 174.330 0.399 17865
8274 1 13 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.402 0.800 17865
8275 1 13 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.197 0.705 17865
8276 1 13 . 1 1 60 60 TYR H H 85 7.562 7.562 8.126 -0.564 17865
8277 1 13 . 1 1 61 61 LYS N N 86 121.862 121.862 121.283 0.579 17865
8278 1 13 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.436 0.076 17865
8279 1 13 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.768 -0.826 17865
8280 1 13 . 1 1 61 61 LYS CB C 86 32.102 32.102 31.790 0.312 17865
8281 1 13 . 1 1 61 61 LYS H H 86 7.222 7.222 7.279 -0.057 17865
8282 1 13 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.533 -0.210 17865
8283 1 13 . 1 1 62 62 PRO C C 87 176.576 176.576 176.520 0.056 17865
8284 1 13 . 1 1 62 62 PRO CA C 87 63.020 63.020 63.183 -0.163 17865
8285 1 13 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.401 -0.161 17865
8286 1 13 . 1 1 63 63 ALA N N 88 125.029 125.029 127.327 -2.298 17865
8287 1 13 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.152 0.102 17865
8288 1 13 . 1 1 63 63 ALA C C 88 177.301 177.301 176.707 0.594 17865
8289 1 13 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.704 -0.423 17865
8290 1 13 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.800 1.402 17865
8291 1 13 . 1 1 63 63 ALA H H 88 8.329 8.329 8.379 -0.050 17865
8292 1 13 . 1 1 64 64 VAL N N 89 121.843 121.843 122.250 -0.407 17865
8293 1 13 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.249 -0.305 17865
8294 1 13 . 1 1 64 64 VAL C C 89 174.791 174.791 173.782 1.009 17865
8295 1 13 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.747 1.234 17865
8296 1 13 . 1 1 64 64 VAL CB C 89 33.485 33.485 34.491 -1.006 17865
8297 1 13 . 1 1 64 64 VAL H H 89 8.075 8.075 7.723 0.352 17865
8298 1 13 . 1 1 65 65 VAL N N 90 125.399 125.399 122.178 3.221 17865
8299 1 13 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.286 -0.148 17865
8300 1 13 . 1 1 65 65 VAL C C 90 174.340 174.340 174.241 0.099 17865
8301 1 13 . 1 1 65 65 VAL CA C 90 61.162 61.162 61.462 -0.300 17865
8302 1 13 . 1 1 65 65 VAL CB C 90 33.866 33.866 31.098 2.768 17865
8303 1 13 . 1 1 65 65 VAL H H 90 8.229 8.229 8.171 0.058 17865
8304 1 13 . 1 1 66 66 TYR N N 91 124.848 124.848 127.135 -2.287 17865
8305 1 13 . 1 1 66 66 TYR HA H 91 4.771 4.771 5.290 -0.519 17865
8306 1 13 . 1 1 66 66 TYR C C 91 176.658 176.658 176.488 0.170 17865
8307 1 13 . 1 1 66 66 TYR CA C 91 58.084 58.084 56.409 1.675 17865
8308 1 13 . 1 1 66 66 TYR CB C 91 41.535 41.535 41.624 -0.090 17865
8309 1 13 . 1 1 66 66 TYR H H 91 9.145 9.145 8.334 0.811 17865
8310 1 13 . 1 1 67 67 GLY N N 92 106.185 106.185 109.040 -2.855 17865
8311 1 13 . 1 1 67 67 GLY C C 92 175.681 175.681 174.499 1.182 17865
8312 1 13 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.389 0.586 17865
8313 1 13 . 1 1 67 67 GLY H H 92 8.730 8.730 9.079 -0.349 17865
8314 1 13 . 1 1 68 68 TYR N N 93 121.815 121.815 119.589 2.226 17865
8315 1 13 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.373 -0.398 17865
8316 1 13 . 1 1 68 68 TYR C C 93 176.035 176.035 175.746 0.289 17865
8317 1 13 . 1 1 68 68 TYR CA C 93 61.046 61.046 60.389 0.657 17865
8318 1 13 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.807 -0.382 17865
8319 1 13 . 1 1 68 68 TYR H H 93 8.711 8.711 8.911 -0.200 17865
8320 1 13 . 1 1 69 69 ASP N N 94 115.507 115.507 116.834 -1.327 17865
8321 1 13 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.573 -0.285 17865
8322 1 13 . 1 1 69 69 ASP C C 94 177.063 177.063 176.982 0.081 17865
8323 1 13 . 1 1 69 69 ASP CA C 94 53.011 53.011 54.548 -1.537 17865
8324 1 13 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.800 -0.633 17865
8325 1 13 . 1 1 69 69 ASP H H 94 8.010 8.010 8.090 -0.080 17865
8326 1 13 . 1 1 70 70 GLY N N 95 107.196 107.196 106.460 0.736 17865
8327 1 13 . 1 1 70 70 GLY C C 95 173.936 173.936 173.832 0.104 17865
8328 1 13 . 1 1 70 70 GLY CA C 95 45.392 45.392 45.006 0.386 17865
8329 1 13 . 1 1 70 70 GLY H H 95 7.986 7.986 7.425 0.561 17865
8330 1 13 . 1 1 71 71 LYS N N 96 121.258 121.258 120.074 1.184 17865
8331 1 13 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.696 0.088 17865
8332 1 13 . 1 1 71 71 LYS CA C 96 54.114 54.114 53.270 0.843 17865
8333 1 13 . 1 1 71 71 LYS CB C 96 31.762 31.762 33.157 -1.395 17865
8334 1 13 . 1 1 71 71 LYS H H 96 7.877 7.877 7.899 -0.022 17865
8335 1 13 . 1 1 72 72 PRO C C 97 177.170 177.170 175.902 1.268 17865
8336 1 13 . 1 1 72 72 PRO CA C 97 63.137 63.137 63.303 -0.166 17865
8337 1 13 . 1 1 72 72 PRO CB C 97 32.240 32.240 31.143 1.097 17865
8338 1 13 . 1 1 73 73 LEU N N 98 123.503 123.503 125.884 -2.381 17865
8339 1 13 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.679 -0.319 17865
8340 1 13 . 1 1 73 73 LEU C C 98 176.354 176.354 175.039 1.315 17865
8341 1 13 . 1 1 73 73 LEU CA C 98 53.927 53.927 53.511 0.416 17865
8342 1 13 . 1 1 73 73 LEU CB C 98 42.272 42.272 46.956 -4.684 17865
8343 1 13 . 1 1 73 73 LEU H H 98 8.850 8.850 7.848 1.002 17865
8344 1 13 . 1 1 74 74 ASP N N 99 122.212 122.212 125.838 -3.626 17865
8345 1 13 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.760 -0.163 17865
8346 1 13 . 1 1 74 74 ASP C C 99 175.819 175.819 175.391 0.428 17865
8347 1 13 . 1 1 74 74 ASP CA C 99 53.856 53.856 55.356 -1.500 17865
8348 1 13 . 1 1 74 74 ASP CB C 99 40.989 40.989 39.080 1.909 17865
8349 1 13 . 1 1 74 74 ASP H H 99 8.517 8.517 8.762 -0.245 17865
8350 1 13 . 1 1 75 75 LEU N N 100 125.874 125.874 120.324 5.550 17865
8351 1 13 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.621 -0.255 17865
8352 1 13 . 1 1 75 75 LEU C C 100 178.426 178.426 178.171 0.255 17865
8353 1 13 . 1 1 75 75 LEU CA C 100 53.631 53.631 55.160 -1.530 17865
8354 1 13 . 1 1 75 75 LEU CB C 100 40.676 40.676 44.282 -3.606 17865
8355 1 13 . 1 1 75 75 LEU H H 100 8.281 8.281 8.159 0.122 17865
8356 1 13 . 1 1 76 76 GLY N N 101 110.604 110.604 110.106 0.498 17865
8357 1 13 . 1 1 76 76 GLY C C 101 176.936 176.936 175.489 1.447 17865
8358 1 13 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.645 0.182 17865
8359 1 13 . 1 1 76 76 GLY H H 101 8.914 8.914 8.146 0.768 17865
8360 1 13 . 1 1 77 77 PHE N N 102 117.639 117.639 118.732 -1.093 17865
8361 1 13 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.817 -0.436 17865
8362 1 13 . 1 1 77 77 PHE C C 102 177.878 177.878 175.577 2.301 17865
8363 1 13 . 1 1 77 77 PHE CA C 102 59.139 59.139 58.126 1.013 17865
8364 1 13 . 1 1 77 77 PHE CB C 102 36.935 36.935 40.418 -3.483 17865
8365 1 13 . 1 1 77 77 PHE H H 102 7.992 7.992 8.056 -0.064 17865
8366 1 13 . 1 1 78 78 CYS N N 103 121.136 121.136 117.853 3.283 17865
8367 1 13 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.652 -0.267 17865
8368 1 13 . 1 1 78 78 CYS C C 103 172.780 172.780 176.799 -4.019 17865
8369 1 13 . 1 1 78 78 CYS CA C 103 53.696 53.696 58.629 -4.933 17865
8370 1 13 . 1 1 78 78 CYS CB C 103 34.237 34.237 28.492 5.745 17865
8371 1 13 . 1 1 78 78 CYS H H 103 7.362 7.362 8.150 -0.788 17865
8372 1 13 . 1 1 79 79 THR N N 104 114.773 114.773 119.127 -4.354 17865
8373 1 13 . 1 1 79 79 THR HA H 104 3.984 3.984 4.024 -0.040 17865
8374 1 13 . 1 1 79 79 THR C C 104 176.624 176.624 175.754 0.870 17865
8375 1 13 . 1 1 79 79 THR CA C 104 65.180 65.180 66.716 -1.536 17865
8376 1 13 . 1 1 79 79 THR CB C 104 69.062 69.062 68.441 0.621 17865
8377 1 13 . 1 1 79 79 THR H H 104 7.864 7.864 8.564 -0.700 17865
8378 1 13 . 1 1 80 80 LEU N N 105 119.785 119.785 119.344 0.441 17865
8379 1 13 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.084 0.247 17865
8380 1 13 . 1 1 80 80 LEU C C 105 177.208 177.208 177.755 -0.547 17865
8381 1 13 . 1 1 80 80 LEU CA C 105 55.453 55.453 56.677 -1.224 17865
8382 1 13 . 1 1 80 80 LEU CB C 105 41.293 41.293 41.175 0.118 17865
8383 1 13 . 1 1 80 80 LEU H H 105 7.238 7.238 7.963 -0.725 17865
8384 1 13 . 1 1 81 81 ALA N N 106 119.309 119.309 118.653 0.656 17865
8385 1 13 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.350 0.177 17865
8386 1 13 . 1 1 81 81 ALA C C 106 178.769 178.769 177.754 1.015 17865
8387 1 13 . 1 1 81 81 ALA CA C 106 52.049 52.049 52.818 -0.769 17865
8388 1 13 . 1 1 81 81 ALA CB C 106 18.820 18.820 20.305 -1.485 17865
8389 1 13 . 1 1 81 81 ALA H H 106 7.432 7.432 7.822 -0.390 17865
8390 1 13 . 1 1 82 82 GLY N N 107 109.793 109.793 107.149 2.644 17865
8391 1 13 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.429 1.690 17865
8392 1 13 . 1 1 82 82 GLY H H 107 7.918 7.918 7.421 0.497 17865
8393 1 13 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.887 0.379 17865
8394 1 13 . 1 1 83 83 ILE CA C 108 63.263 63.263 62.807 0.456 17865
8395 1 13 . 1 1 83 83 ILE CB C 108 38.261 38.261 37.239 1.022 17865
8396 1 13 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.286 0.469 17865
8397 1 13 . 1 1 84 84 ARG C C 109 181.344 181.344 177.755 3.589 17865
8398 1 13 . 1 1 84 84 ARG CA C 109 55.939 55.939 56.008 -0.069 17865
8399 1 13 . 1 1 84 84 ARG CB C 109 30.283 30.283 29.039 1.244 17865
8400 1 13 . 1 1 85 85 GLU N N 110 122.944 122.944 121.225 1.719 17865
8401 1 13 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.128 -0.511 17865
8402 1 13 . 1 1 85 85 GLU C C 110 177.797 177.797 177.604 0.193 17865
8403 1 13 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.406 1.322 17865
8404 1 13 . 1 1 85 85 GLU CB C 110 28.871 28.871 28.471 0.400 17865
8405 1 13 . 1 1 85 85 GLU H H 110 8.003 8.003 8.063 -0.060 17865
8406 1 13 . 1 1 86 86 VAL N N 111 117.101 117.101 119.226 -2.125 17865
8407 1 13 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.683 -0.172 17865
8408 1 13 . 1 1 86 86 VAL C C 111 177.710 177.710 177.088 0.622 17865
8409 1 13 . 1 1 86 86 VAL CA C 111 66.430 66.430 65.460 0.970 17865
8410 1 13 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.650 -0.437 17865
8411 1 13 . 1 1 86 86 VAL H H 111 8.106 8.106 7.520 0.586 17865
8412 1 13 . 1 1 87 87 ASP N N 112 122.242 122.242 119.287 2.955 17865
8413 1 13 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.437 -0.133 17865
8414 1 13 . 1 1 87 87 ASP C C 112 176.912 176.912 178.096 -1.184 17865
8415 1 13 . 1 1 87 87 ASP CA C 112 57.417 57.417 56.849 0.568 17865
8416 1 13 . 1 1 87 87 ASP CB C 112 40.476 40.476 40.853 -0.377 17865
8417 1 13 . 1 1 87 87 ASP H H 112 7.401 7.401 7.639 -0.238 17865
8418 1 13 . 1 1 88 88 CYS N N 113 120.819 120.819 120.393 0.426 17865
8419 1 13 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.206 -0.897 17865
8420 1 13 . 1 1 88 88 CYS C C 113 175.270 175.270 176.805 -1.535 17865
8421 1 13 . 1 1 88 88 CYS CA C 113 59.759 59.759 61.704 -1.945 17865
8422 1 13 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.117 7.718 17865
8423 1 13 . 1 1 88 88 CYS H H 113 7.785 7.785 8.085 -0.300 17865
8424 1 13 . 1 1 89 89 ARG N N 114 118.654 118.654 120.237 -1.583 17865
8425 1 13 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.060 -0.419 17865
8426 1 13 . 1 1 89 89 ARG C C 114 179.018 179.018 178.406 0.612 17865
8427 1 13 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.353 0.840 17865
8428 1 13 . 1 1 89 89 ARG CB C 114 29.713 29.713 29.643 0.070 17865
8429 1 13 . 1 1 89 89 ARG H H 114 8.142 8.142 7.964 0.178 17865
8430 1 13 . 1 1 90 90 LYS N N 115 120.964 120.964 116.987 3.977 17865
8431 1 13 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.216 -0.186 17865
8432 1 13 . 1 1 90 90 LYS C C 115 180.092 180.092 177.890 2.202 17865
8433 1 13 . 1 1 90 90 LYS CA C 115 59.568 59.568 58.816 0.751 17865
8434 1 13 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.469 -0.248 17865
8435 1 13 . 1 1 90 90 LYS H H 115 7.936 7.936 7.637 0.299 17865
8436 1 13 . 1 1 91 91 ASP N N 116 121.690 121.690 118.560 3.130 17865
8437 1 13 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.627 -0.114 17865
8438 1 13 . 1 1 91 91 ASP C C 116 179.419 179.419 178.279 1.140 17865
8439 1 13 . 1 1 91 91 ASP CA C 116 57.237 57.237 57.160 0.077 17865
8440 1 13 . 1 1 91 91 ASP CB C 116 40.648 40.648 41.434 -0.787 17865
8441 1 13 . 1 1 91 91 ASP H H 116 8.558 8.558 7.549 1.009 17865
8442 1 13 . 1 1 92 92 ALA N N 117 122.784 122.784 122.662 0.122 17865
8443 1 13 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.147 -0.124 17865
8444 1 13 . 1 1 92 92 ALA C C 117 178.789 178.789 179.062 -0.273 17865
8445 1 13 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.078 -0.027 17865
8446 1 13 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.772 0.403 17865
8447 1 13 . 1 1 92 92 ALA H H 117 8.703 8.703 8.353 0.350 17865
8448 1 13 . 1 1 93 93 GLN N N 118 115.510 115.510 114.557 0.953 17865
8449 1 13 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.066 -0.122 17865
8450 1 13 . 1 1 93 93 GLN C C 118 178.745 178.745 176.933 1.812 17865
8451 1 13 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.545 0.937 17865
8452 1 13 . 1 1 93 93 GLN CB C 118 28.397 28.397 27.998 0.399 17865
8453 1 13 . 1 1 93 93 GLN H H 118 7.664 7.664 8.555 -0.891 17865
8454 1 13 . 1 1 94 94 THR N N 119 110.110 110.110 114.807 -4.697 17865
8455 1 13 . 1 1 94 94 THR HA H 119 4.237 4.237 4.200 0.037 17865
8456 1 13 . 1 1 94 94 THR C C 119 175.861 175.861 175.778 0.083 17865
8457 1 13 . 1 1 94 94 THR CA C 119 64.604 64.604 65.187 -0.583 17865
8458 1 13 . 1 1 94 94 THR CB C 119 69.716 69.716 69.014 0.702 17865
8459 1 13 . 1 1 94 94 THR H H 119 7.726 7.726 7.429 0.297 17865
8460 1 13 . 1 1 95 95 CYS N N 120 118.523 118.523 121.887 -3.364 17865
8461 1 13 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.319 0.414 17865
8462 1 13 . 1 1 95 95 CYS C C 120 175.165 175.165 174.607 0.558 17865
8463 1 13 . 1 1 95 95 CYS CA C 120 52.973 52.973 59.475 -6.503 17865
8464 1 13 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.577 12.154 17865
8465 1 13 . 1 1 95 95 CYS H H 120 7.756 7.756 7.823 -0.067 17865
8466 1 13 . 1 1 96 96 ASP N N 121 119.081 119.081 122.898 -3.817 17865
8467 1 13 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.315 0.363 17865
8468 1 13 . 1 1 96 96 ASP CA C 121 56.224 56.224 57.167 -0.943 17865
8469 1 13 . 1 1 96 96 ASP CB C 121 42.731 42.731 40.749 1.982 17865
8470 1 13 . 1 1 96 96 ASP H H 121 7.354 7.354 8.538 -1.184 17865
8471 1 13 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.480 -0.905 17865
8472 1 13 . 1 1 97 97 LYS C C 122 175.510 175.510 177.866 -2.356 17865
8473 1 13 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.527 0.312 17865
8474 1 13 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.089 -3.339 17865
8475 1 13 . 1 1 98 98 LYS N N 123 119.980 119.980 118.910 1.070 17865
8476 1 13 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.538 -0.244 17865
8477 1 13 . 1 1 98 98 LYS C C 123 176.968 176.968 178.230 -1.262 17865
8478 1 13 . 1 1 98 98 LYS CA C 123 55.904 55.904 57.348 -1.444 17865
8479 1 13 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.765 -0.533 17865
8480 1 13 . 1 1 98 98 LYS H H 123 7.799 7.799 8.078 -0.279 17865
8481 1 13 . 1 1 99 99 TYR N N 124 122.378 122.378 121.911 0.467 17865
8482 1 13 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.075 -0.180 17865
8483 1 13 . 1 1 99 99 TYR C C 124 177.126 177.126 177.046 0.080 17865
8484 1 13 . 1 1 99 99 TYR CA C 124 60.211 60.211 61.157 -0.946 17865
8485 1 13 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.772 -0.501 17865
8486 1 13 . 1 1 99 99 TYR H H 124 8.536 8.536 8.263 0.273 17865
8487 1 13 . 1 1 100 100 GLU N N 125 118.610 118.610 116.379 2.231 17865
8488 1 13 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.184 0.084 17865
8489 1 13 . 1 1 100 100 GLU C C 125 177.387 177.387 178.400 -1.013 17865
8490 1 13 . 1 1 100 100 GLU CA C 125 55.759 55.759 56.892 -1.133 17865
8491 1 13 . 1 1 100 100 GLU CB C 125 27.321 27.321 29.213 -1.892 17865
8492 1 13 . 1 1 100 100 GLU H H 125 8.385 8.385 8.708 -0.323 17865
8493 1 13 . 1 1 101 101 SER N N 126 115.949 115.949 117.477 -1.528 17865
8494 1 13 . 1 1 101 101 SER HA H 126 3.959 3.959 4.072 -0.113 17865
8495 1 13 . 1 1 101 101 SER C C 126 176.047 176.047 175.820 0.227 17865
8496 1 13 . 1 1 101 101 SER CA C 126 62.439 62.439 62.128 0.311 17865
8497 1 13 . 1 1 101 101 SER CB C 126 63.299 63.299 63.023 0.276 17865
8498 1 13 . 1 1 101 101 SER H H 126 7.823 7.823 7.928 -0.105 17865
8499 1 13 . 1 1 102 102 ASP N N 127 120.920 120.920 121.339 -0.419 17865
8500 1 13 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.277 0.130 17865
8501 1 13 . 1 1 102 102 ASP C C 127 178.234 178.234 178.289 -0.055 17865
8502 1 13 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.605 -0.194 17865
8503 1 13 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.770 -1.054 17865
8504 1 13 . 1 1 102 102 ASP H H 127 8.683 8.683 7.690 0.993 17865
8505 1 13 . 1 1 103 103 LYS N N 128 121.753 121.753 118.662 3.091 17865
8506 1 13 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.003 0.001 17865
8507 1 13 . 1 1 103 103 LYS C C 128 179.395 179.395 178.921 0.474 17865
8508 1 13 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.764 0.707 17865
8509 1 13 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.842 0.559 17865
8510 1 13 . 1 1 103 103 LYS H H 128 7.771 7.771 7.796 -0.025 17865
8511 1 13 . 1 1 104 104 CYS N N 129 120.109 120.109 120.203 -0.094 17865
8512 1 13 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.229 -0.035 17865
8513 1 13 . 1 1 104 104 CYS C C 129 176.779 176.779 177.060 -0.281 17865
8514 1 13 . 1 1 104 104 CYS CA C 129 59.790 59.790 61.820 -2.030 17865
8515 1 13 . 1 1 104 104 CYS CB C 129 36.879 36.879 26.052 10.826 17865
8516 1 13 . 1 1 104 104 CYS H H 129 7.973 7.973 8.246 -0.273 17865
8517 1 13 . 1 1 105 105 LEU N N 130 121.804 121.804 122.069 -0.265 17865
8518 1 13 . 1 1 105 105 LEU HA H 130 4.090 4.090 4.036 0.054 17865
8519 1 13 . 1 1 105 105 LEU C C 130 179.373 179.373 178.769 0.604 17865
8520 1 13 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.353 -0.985 17865
8521 1 13 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.246 0.852 17865
8522 1 13 . 1 1 105 105 LEU H H 130 8.666 8.666 8.443 0.223 17865
8523 1 13 . 1 1 106 106 ASN N N 131 118.535 118.535 117.584 0.951 17865
8524 1 13 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.434 -0.196 17865
8525 1 13 . 1 1 106 106 ASN C C 131 177.830 177.830 177.936 -0.106 17865
8526 1 13 . 1 1 106 106 ASN CA C 131 56.256 56.256 56.154 0.102 17865
8527 1 13 . 1 1 106 106 ASN CB C 131 37.817 37.817 37.955 -0.138 17865
8528 1 13 . 1 1 106 106 ASN H H 131 8.438 8.438 8.062 0.376 17865
8529 1 13 . 1 1 107 107 ALA N N 132 121.485 121.485 122.057 -0.572 17865
8530 1 13 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.505 -0.286 17865
8531 1 13 . 1 1 107 107 ALA C C 132 180.726 180.726 179.046 1.680 17865
8532 1 13 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.396 0.567 17865
8533 1 13 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.754 -0.933 17865
8534 1 13 . 1 1 107 107 ALA H H 132 7.541 7.541 7.911 -0.370 17865
8535 1 13 . 1 1 108 108 ILE N N 133 120.979 120.979 119.431 1.548 17865
8536 1 13 . 1 1 108 108 ILE HA H 133 3.931 3.931 4.003 -0.072 17865
8537 1 13 . 1 1 108 108 ILE C C 133 178.114 178.114 177.713 0.401 17865
8538 1 13 . 1 1 108 108 ILE CA C 133 63.353 63.353 62.961 0.392 17865
8539 1 13 . 1 1 108 108 ILE CB C 133 36.454 36.454 38.024 -1.570 17865
8540 1 13 . 1 1 108 108 ILE H H 133 7.551 7.551 7.506 0.045 17865
8541 1 13 . 1 1 109 109 LYS N N 134 121.415 121.415 119.965 1.450 17865
8542 1 13 . 1 1 109 109 LYS HA H 134 3.588 3.588 3.990 -0.402 17865
8543 1 13 . 1 1 109 109 LYS C C 134 179.561 179.561 177.985 1.576 17865
8544 1 13 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.752 0.356 17865
8545 1 13 . 1 1 109 109 LYS CB C 134 32.161 32.161 31.996 0.165 17865
8546 1 13 . 1 1 109 109 LYS H H 134 8.414 8.414 8.152 0.262 17865
8547 1 13 . 1 1 110 110 GLU N N 135 116.099 116.099 117.271 -1.172 17865
8548 1 13 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.243 -0.314 17865
8549 1 13 . 1 1 110 110 GLU C C 135 178.239 178.239 179.248 -1.009 17865
8550 1 13 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.236 0.410 17865
8551 1 13 . 1 1 110 110 GLU CB C 135 29.638 29.638 29.513 0.125 17865
8552 1 13 . 1 1 110 110 GLU H H 135 7.473 7.473 7.793 -0.320 17865
8553 1 13 . 1 1 111 111 LYS N N 136 119.805 119.805 120.063 -0.258 17865
8554 1 13 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.026 -0.120 17865
8555 1 13 . 1 1 111 111 LYS C C 136 177.600 177.600 178.031 -0.431 17865
8556 1 13 . 1 1 111 111 LYS CA C 136 58.749 58.749 57.717 1.032 17865
8557 1 13 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.199 1.039 17865
8558 1 13 . 1 1 111 111 LYS H H 136 7.540 7.540 7.579 -0.039 17865
8559 1 13 . 1 1 112 112 TYR N N 137 114.768 114.768 117.473 -2.705 17865
8560 1 13 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.568 -0.045 17865
8561 1 13 . 1 1 112 112 TYR C C 137 174.690 174.690 175.618 -0.928 17865
8562 1 13 . 1 1 112 112 TYR CA C 137 58.359 58.359 57.407 0.952 17865
8563 1 13 . 1 1 112 112 TYR CB C 137 38.328 38.328 37.370 0.958 17865
8564 1 13 . 1 1 112 112 TYR H H 137 7.488 7.488 7.542 -0.054 17865
8565 1 13 . 1 1 113 113 LYS N N 138 123.694 123.694 122.534 1.160 17865
8566 1 13 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.539 -0.038 17865
8567 1 13 . 1 1 113 113 LYS CA C 138 55.282 55.282 54.376 0.906 17865
8568 1 13 . 1 1 113 113 LYS CB C 138 32.124 32.124 33.114 -0.990 17865
8569 1 13 . 1 1 113 113 LYS H H 138 7.217 7.217 7.683 -0.466 17865
8570 1 13 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.613 -0.161 17865
8571 1 13 . 1 1 114 114 PRO C C 139 176.974 176.974 176.079 0.895 17865
8572 1 13 . 1 1 114 114 PRO CA C 139 63.189 63.189 62.385 0.804 17865
8573 1 13 . 1 1 114 114 PRO CB C 139 32.251 32.251 30.326 1.925 17865
8574 1 13 . 1 1 115 115 VAL N N 140 121.098 121.098 122.768 -1.670 17865
8575 1 13 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.090 0.012 17865
8576 1 13 . 1 1 115 115 VAL C C 140 176.207 176.207 175.196 1.011 17865
8577 1 13 . 1 1 115 115 VAL CA C 140 62.356 62.356 62.461 -0.105 17865
8578 1 13 . 1 1 115 115 VAL CB C 140 33.256 33.256 30.572 2.684 17865
8579 1 13 . 1 1 115 115 VAL H H 140 8.272 8.272 7.918 0.354 17865
8580 1 13 . 1 1 116 116 VAL N N 141 124.167 124.167 127.733 -3.566 17865
8581 1 13 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.271 -0.149 17865
8582 1 13 . 1 1 116 116 VAL C C 141 175.415 175.415 174.911 0.504 17865
8583 1 13 . 1 1 116 116 VAL CA C 141 61.731 61.731 61.813 -0.082 17865
8584 1 13 . 1 1 116 116 VAL CB C 141 33.145 33.145 32.770 0.375 17865
8585 1 13 . 1 1 116 116 VAL H H 141 8.142 8.142 8.110 0.032 17865
8586 1 13 . 1 1 117 117 ASP N N 142 126.737 126.737 128.273 -1.536 17865
8587 1 13 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.970 -0.158 17865
8588 1 13 . 1 1 117 117 ASP CA C 142 52.217 52.217 52.251 -0.034 17865
8589 1 13 . 1 1 117 117 ASP CB C 142 41.368 41.368 41.819 -0.451 17865
8590 1 13 . 1 1 117 117 ASP H H 142 8.419 8.419 8.473 -0.054 17865
8591 1 13 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.623 -0.212 17865
8592 1 13 . 1 1 118 118 PRO C C 143 176.662 176.662 176.049 0.613 17865
8593 1 13 . 1 1 118 118 PRO CA C 143 63.247 63.247 62.908 0.339 17865
8594 1 13 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.325 -0.015 17865
8595 1 13 . 1 1 119 119 ASN N N 144 119.287 119.287 119.848 -0.561 17865
8596 1 13 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.926 0.021 17865
8597 1 13 . 1 1 119 119 ASN CA C 144 51.633 51.633 51.950 -0.317 17865
8598 1 13 . 1 1 119 119 ASN CB C 144 38.859 38.859 39.883 -1.024 17865
8599 1 13 . 1 1 119 119 ASN H H 144 8.432 8.432 8.327 0.105 17865
8600 1 13 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.862 -0.182 17865
8601 1 13 . 1 1 120 120 PRO CA C 145 61.640 61.640 61.669 -0.029 17865
8602 1 13 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.472 -0.554 17865
8603 1 13 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.426 -0.049 17865
8604 1 13 . 1 1 121 121 PRO C C 146 175.876 175.876 176.665 -0.789 17865
8605 1 13 . 1 1 121 121 PRO CA C 146 63.174 63.174 62.849 0.325 17865
8606 1 13 . 1 1 121 121 PRO CB C 146 31.939 31.939 32.473 -0.534 17865
8607 1 14 . 1 1 2 2 ASP N N 27 121.041 121.041 120.088 0.953 17865
8608 1 14 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.711 -0.073 17865
8609 1 14 . 1 1 2 2 ASP C C 27 175.878 175.878 177.363 -1.485 17865
8610 1 14 . 1 1 2 2 ASP CA C 27 54.382 54.382 54.110 0.272 17865
8611 1 14 . 1 1 2 2 ASP CB C 27 41.729 41.729 41.164 0.565 17865
8612 1 14 . 1 1 2 2 ASP H H 27 8.639 8.639 8.270 0.369 17865
8613 1 14 . 1 1 3 3 VAL N N 28 119.901 119.901 118.953 0.948 17865
8614 1 14 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.114 -0.081 17865
8615 1 14 . 1 1 3 3 VAL C C 28 175.521 175.521 175.491 0.030 17865
8616 1 14 . 1 1 3 3 VAL CA C 28 62.216 62.216 61.696 0.520 17865
8617 1 14 . 1 1 3 3 VAL CB C 28 33.003 33.003 29.268 3.735 17865
8618 1 14 . 1 1 3 3 VAL H H 28 8.113 8.113 7.713 0.400 17865
8619 1 14 . 1 1 4 4 PHE N N 29 123.707 123.707 120.301 3.406 17865
8620 1 14 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.055 0.601 17865
8621 1 14 . 1 1 4 4 PHE C C 29 174.874 174.874 175.495 -0.621 17865
8622 1 14 . 1 1 4 4 PHE CA C 29 57.159 57.159 59.513 -2.354 17865
8623 1 14 . 1 1 4 4 PHE CB C 29 39.795 39.795 39.495 0.300 17865
8624 1 14 . 1 1 4 4 PHE H H 29 8.255 8.255 7.887 0.368 17865
8625 1 14 . 1 1 5 5 ASP N N 30 124.203 124.203 123.065 1.138 17865
8626 1 14 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.661 0.177 17865
8627 1 14 . 1 1 5 5 ASP CA C 30 52.385 52.385 51.560 0.825 17865
8628 1 14 . 1 1 5 5 ASP CB C 30 40.801 40.801 40.960 -0.159 17865
8629 1 14 . 1 1 5 5 ASP H H 30 8.226 8.226 7.233 0.993 17865
8630 1 14 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.522 0.015 17865
8631 1 14 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.382 -0.718 17865
8632 1 14 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.587 -0.761 17865
8633 1 14 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.506 -0.080 17865
8634 1 14 . 1 1 7 7 PRO C C 32 177.226 177.226 175.737 1.489 17865
8635 1 14 . 1 1 7 7 PRO CA C 32 63.169 63.169 62.980 0.189 17865
8636 1 14 . 1 1 7 7 PRO CB C 32 31.948 31.948 31.363 0.585 17865
8637 1 14 . 1 1 8 8 THR N N 33 114.158 114.158 115.876 -1.718 17865
8638 1 14 . 1 1 8 8 THR HA H 33 4.195 4.195 4.463 -0.268 17865
8639 1 14 . 1 1 8 8 THR C C 33 174.468 174.468 172.743 1.725 17865
8640 1 14 . 1 1 8 8 THR CA C 33 62.110 62.110 61.682 0.428 17865
8641 1 14 . 1 1 8 8 THR CB C 33 69.975 69.975 71.493 -1.518 17865
8642 1 14 . 1 1 8 8 THR H H 33 8.096 8.096 7.545 0.551 17865
8643 1 14 . 1 1 9 9 GLN N N 34 122.411 122.411 126.177 -3.766 17865
8644 1 14 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.008 0.255 17865
8645 1 14 . 1 1 9 9 GLN C C 34 175.445 175.445 174.163 1.282 17865
8646 1 14 . 1 1 9 9 GLN CA C 34 55.763 55.763 55.109 0.654 17865
8647 1 14 . 1 1 9 9 GLN CB C 34 29.691 29.691 29.001 0.690 17865
8648 1 14 . 1 1 9 9 GLN H H 34 8.278 8.278 8.357 -0.079 17865
8649 1 14 . 1 1 10 10 TYR N N 35 121.048 121.048 118.529 2.519 17865
8650 1 14 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.947 -0.427 17865
8651 1 14 . 1 1 10 10 TYR C C 35 176.314 176.314 174.051 2.263 17865
8652 1 14 . 1 1 10 10 TYR CA C 35 57.972 57.972 56.165 1.807 17865
8653 1 14 . 1 1 10 10 TYR CB C 35 38.936 38.936 40.182 -1.246 17865
8654 1 14 . 1 1 10 10 TYR H H 35 8.227 8.227 7.341 0.886 17865
8655 1 14 . 1 1 11 11 GLY N N 36 109.711 109.711 108.129 1.582 17865
8656 1 14 . 1 1 11 11 GLY C C 36 174.128 174.128 174.878 -0.750 17865
8657 1 14 . 1 1 11 11 GLY CA C 36 45.212 45.212 45.224 -0.012 17865
8658 1 14 . 1 1 11 11 GLY H H 36 8.247 8.247 8.423 -0.176 17865
8659 1 14 . 1 1 12 12 TYR N N 37 120.302 120.302 118.710 1.592 17865
8660 1 14 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.758 -0.276 17865
8661 1 14 . 1 1 12 12 TYR C C 37 175.864 175.864 174.672 1.192 17865
8662 1 14 . 1 1 12 12 TYR CA C 37 58.541 58.541 56.210 2.331 17865
8663 1 14 . 1 1 12 12 TYR CB C 37 38.715 38.715 38.890 -0.175 17865
8664 1 14 . 1 1 12 12 TYR H H 37 8.101 8.101 8.146 -0.045 17865
8665 1 14 . 1 1 13 13 ASP N N 38 121.883 121.883 119.667 2.216 17865
8666 1 14 . 1 1 13 13 ASP HA H 38 4.486 4.486 3.694 0.792 17865
8667 1 14 . 1 1 13 13 ASP C C 38 176.538 176.538 175.429 1.109 17865
8668 1 14 . 1 1 13 13 ASP CA C 38 54.223 54.223 54.347 -0.124 17865
8669 1 14 . 1 1 13 13 ASP CB C 38 40.988 40.988 40.976 0.012 17865
8670 1 14 . 1 1 13 13 ASP H H 38 8.266 8.266 7.628 0.638 17865
8671 1 14 . 1 1 14 14 GLY N N 39 107.705 107.705 109.523 -1.818 17865
8672 1 14 . 1 1 14 14 GLY C C 39 173.822 173.822 173.674 0.148 17865
8673 1 14 . 1 1 14 14 GLY CA C 39 45.404 45.404 45.215 0.189 17865
8674 1 14 . 1 1 14 14 GLY H H 39 7.647 7.647 7.515 0.132 17865
8675 1 14 . 1 1 15 15 LYS N N 40 121.621 121.621 122.113 -0.492 17865
8676 1 14 . 1 1 15 15 LYS HA H 40 4.575 4.575 5.060 -0.485 17865
8677 1 14 . 1 1 15 15 LYS CA C 40 54.100 54.100 53.004 1.096 17865
8678 1 14 . 1 1 15 15 LYS CB C 40 32.510 32.510 34.021 -1.511 17865
8679 1 14 . 1 1 15 15 LYS H H 40 7.908 7.908 7.505 0.403 17865
8680 1 14 . 1 1 16 16 PRO HA H 41 4.352 4.352 5.041 -0.689 17865
8681 1 14 . 1 1 16 16 PRO C C 41 176.806 176.806 176.677 0.129 17865
8682 1 14 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.463 0.295 17865
8683 1 14 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.719 -0.405 17865
8684 1 14 . 1 1 17 17 LEU N N 42 123.488 123.488 120.695 2.793 17865
8685 1 14 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.163 -0.114 17865
8686 1 14 . 1 1 17 17 LEU C C 42 174.973 174.973 176.188 -1.215 17865
8687 1 14 . 1 1 17 17 LEU CA C 42 55.436 55.436 55.017 0.420 17865
8688 1 14 . 1 1 17 17 LEU CB C 42 42.093 42.093 42.611 -0.518 17865
8689 1 14 . 1 1 17 17 LEU H H 42 8.499 8.499 8.218 0.281 17865
8690 1 14 . 1 1 18 18 ASP N N 43 123.354 123.354 122.948 0.406 17865
8691 1 14 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.842 -0.344 17865
8692 1 14 . 1 1 18 18 ASP C C 43 175.947 175.947 176.895 -0.948 17865
8693 1 14 . 1 1 18 18 ASP CA C 43 52.858 52.858 53.080 -0.222 17865
8694 1 14 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.775 -2.554 17865
8695 1 14 . 1 1 18 18 ASP H H 43 7.789 7.789 8.484 -0.695 17865
8696 1 14 . 1 1 19 19 ALA N N 44 120.147 120.147 124.960 -4.813 17865
8697 1 14 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.169 -0.183 17865
8698 1 14 . 1 1 19 19 ALA C C 44 179.476 179.476 179.061 0.415 17865
8699 1 14 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.419 0.744 17865
8700 1 14 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.803 -0.416 17865
8701 1 14 . 1 1 19 19 ALA H H 44 8.561 8.561 8.682 -0.121 17865
8702 1 14 . 1 1 20 20 SER N N 45 115.037 115.037 116.088 -1.051 17865
8703 1 14 . 1 1 20 20 SER HA H 45 4.151 4.151 4.156 -0.005 17865
8704 1 14 . 1 1 20 20 SER C C 45 177.191 177.191 176.746 0.445 17865
8705 1 14 . 1 1 20 20 SER CA C 45 61.629 61.629 61.172 0.457 17865
8706 1 14 . 1 1 20 20 SER CB C 45 62.804 62.804 62.833 -0.029 17865
8707 1 14 . 1 1 20 20 SER H H 45 8.466 8.466 8.603 -0.137 17865
8708 1 14 . 1 1 21 21 PHE N N 46 125.030 125.030 121.652 3.378 17865
8709 1 14 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.465 -0.234 17865
8710 1 14 . 1 1 21 21 PHE C C 46 176.850 176.850 177.640 -0.790 17865
8711 1 14 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.927 -0.121 17865
8712 1 14 . 1 1 21 21 PHE CB C 46 39.881 39.881 38.533 1.348 17865
8713 1 14 . 1 1 21 21 PHE H H 46 8.034 8.034 7.878 0.156 17865
8714 1 14 . 1 1 22 22 CYS N N 47 113.943 113.943 116.934 -2.991 17865
8715 1 14 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.346 -0.095 17865
8716 1 14 . 1 1 22 22 CYS C C 47 176.449 176.449 176.117 0.332 17865
8717 1 14 . 1 1 22 22 CYS CA C 47 53.600 53.600 59.602 -6.002 17865
8718 1 14 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.492 10.899 17865
8719 1 14 . 1 1 22 22 CYS H H 47 7.691 7.691 7.941 -0.250 17865
8720 1 14 . 1 1 23 23 ARG N N 48 119.958 119.958 120.319 -0.361 17865
8721 1 14 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.328 -0.248 17865
8722 1 14 . 1 1 23 23 ARG C C 48 177.904 177.904 177.709 0.195 17865
8723 1 14 . 1 1 23 23 ARG CA C 48 58.907 58.907 58.880 0.027 17865
8724 1 14 . 1 1 23 23 ARG CB C 48 30.171 30.171 30.191 -0.020 17865
8725 1 14 . 1 1 23 23 ARG H H 48 7.628 7.628 7.403 0.225 17865
8726 1 14 . 1 1 24 24 THR N N 49 106.445 106.445 113.013 -6.568 17865
8727 1 14 . 1 1 24 24 THR HA H 49 4.385 4.385 4.307 0.078 17865
8728 1 14 . 1 1 24 24 THR C C 49 174.758 174.758 174.493 0.265 17865
8729 1 14 . 1 1 24 24 THR CA C 49 61.573 61.573 63.715 -2.142 17865
8730 1 14 . 1 1 24 24 THR CB C 49 68.794 68.794 68.623 0.171 17865
8731 1 14 . 1 1 24 24 THR H H 49 7.307 7.307 7.537 -0.230 17865
8732 1 14 . 1 1 25 25 ALA N N 50 122.242 122.242 122.585 -0.343 17865
8733 1 14 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.272 0.132 17865
8734 1 14 . 1 1 25 25 ALA C C 50 178.554 178.554 177.962 0.592 17865
8735 1 14 . 1 1 25 25 ALA CA C 50 52.381 52.381 53.598 -1.217 17865
8736 1 14 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.774 -1.379 17865
8737 1 14 . 1 1 25 25 ALA H H 50 7.401 7.401 7.406 -0.005 17865
8738 1 14 . 1 1 26 26 GLY N N 51 110.604 110.604 105.692 4.912 17865
8739 1 14 . 1 1 26 26 GLY CA C 51 47.022 47.022 45.390 1.632 17865
8740 1 14 . 1 1 26 26 GLY H H 51 8.285 8.285 7.756 0.529 17865
8741 1 14 . 1 1 27 27 SER HA H 52 4.382 4.382 4.238 0.144 17865
8742 1 14 . 1 1 27 27 SER C C 52 175.774 175.774 176.269 -0.495 17865
8743 1 14 . 1 1 27 27 SER CA C 52 60.803 60.803 60.475 0.328 17865
8744 1 14 . 1 1 27 27 SER CB C 52 62.827 62.827 62.970 -0.143 17865
8745 1 14 . 1 1 28 28 ARG N N 53 119.682 119.682 119.373 0.309 17865
8746 1 14 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.295 0.585 17865
8747 1 14 . 1 1 28 28 ARG C C 53 175.796 175.796 177.462 -1.666 17865
8748 1 14 . 1 1 28 28 ARG CA C 53 55.738 55.738 56.613 -0.875 17865
8749 1 14 . 1 1 28 28 ARG CB C 53 30.237 30.237 28.879 1.358 17865
8750 1 14 . 1 1 28 28 ARG H H 53 7.894 7.894 8.328 -0.434 17865
8751 1 14 . 1 1 29 29 GLU N N 54 122.318 122.318 121.436 0.882 17865
8752 1 14 . 1 1 29 29 GLU HA H 54 3.595 3.595 3.969 -0.374 17865
8753 1 14 . 1 1 29 29 GLU C C 54 177.523 177.523 177.974 -0.451 17865
8754 1 14 . 1 1 29 29 GLU CA C 54 61.223 61.223 59.857 1.366 17865
8755 1 14 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.406 -0.469 17865
8756 1 14 . 1 1 29 29 GLU H H 54 7.730 7.730 8.333 -0.603 17865
8757 1 14 . 1 1 30 30 LYS N N 55 118.377 118.377 117.640 0.737 17865
8758 1 14 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.044 -0.216 17865
8759 1 14 . 1 1 30 30 LYS C C 55 179.205 179.205 179.278 -0.073 17865
8760 1 14 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.153 1.274 17865
8761 1 14 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.407 -0.806 17865
8762 1 14 . 1 1 30 30 LYS H H 55 8.659 8.659 7.496 1.163 17865
8763 1 14 . 1 1 31 31 ASP N N 56 121.614 121.614 120.224 1.390 17865
8764 1 14 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.587 -0.276 17865
8765 1 14 . 1 1 31 31 ASP C C 56 177.393 177.393 178.003 -0.610 17865
8766 1 14 . 1 1 31 31 ASP CA C 56 57.316 57.316 57.879 -0.563 17865
8767 1 14 . 1 1 31 31 ASP CB C 56 40.423 40.423 41.109 -0.686 17865
8768 1 14 . 1 1 31 31 ASP H H 56 7.646 7.646 8.071 -0.425 17865
8769 1 14 . 1 1 32 32 CYS N N 57 120.345 120.345 120.131 0.214 17865
8770 1 14 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.847 -0.246 17865
8771 1 14 . 1 1 32 32 CYS C C 57 175.772 175.772 176.429 -0.657 17865
8772 1 14 . 1 1 32 32 CYS CA C 57 60.197 60.197 60.971 -0.774 17865
8773 1 14 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.734 8.232 17865
8774 1 14 . 1 1 32 32 CYS H H 57 8.042 8.042 8.256 -0.214 17865
8775 1 14 . 1 1 33 33 ARG N N 58 120.293 120.293 119.446 0.847 17865
8776 1 14 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.970 -0.294 17865
8777 1 14 . 1 1 33 33 ARG C C 58 179.633 179.633 178.493 1.140 17865
8778 1 14 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.423 0.963 17865
8779 1 14 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.466 0.375 17865
8780 1 14 . 1 1 33 33 ARG H H 58 8.531 8.531 8.301 0.230 17865
8781 1 14 . 1 1 34 34 LYS N N 59 121.166 121.166 118.992 2.174 17865
8782 1 14 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.164 -0.128 17865
8783 1 14 . 1 1 34 34 LYS C C 59 179.220 179.220 178.719 0.501 17865
8784 1 14 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.583 0.947 17865
8785 1 14 . 1 1 34 34 LYS CB C 59 32.110 32.110 31.768 0.342 17865
8786 1 14 . 1 1 34 34 LYS H H 59 7.633 7.633 7.486 0.147 17865
8787 1 14 . 1 1 35 35 ASP N N 60 122.166 122.166 120.062 2.104 17865
8788 1 14 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.501 -0.070 17865
8789 1 14 . 1 1 35 35 ASP C C 60 179.709 179.709 178.354 1.355 17865
8790 1 14 . 1 1 35 35 ASP CA C 60 57.703 57.703 56.606 1.097 17865
8791 1 14 . 1 1 35 35 ASP CB C 60 40.672 40.672 40.923 -0.251 17865
8792 1 14 . 1 1 35 35 ASP H H 60 8.221 8.221 7.969 0.252 17865
8793 1 14 . 1 1 36 36 VAL N N 61 121.312 121.312 118.719 2.593 17865
8794 1 14 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.729 -0.328 17865
8795 1 14 . 1 1 36 36 VAL C C 61 178.339 178.339 178.333 0.006 17865
8796 1 14 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.722 1.411 17865
8797 1 14 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.882 -0.225 17865
8798 1 14 . 1 1 36 36 VAL H H 61 8.916 8.916 8.309 0.607 17865
8799 1 14 . 1 1 37 37 GLN N N 62 119.166 119.166 119.560 -0.394 17865
8800 1 14 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.109 -0.167 17865
8801 1 14 . 1 1 37 37 GLN C C 62 177.293 177.293 177.045 0.248 17865
8802 1 14 . 1 1 37 37 GLN CA C 62 58.280 58.280 58.228 0.051 17865
8803 1 14 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.666 -0.295 17865
8804 1 14 . 1 1 37 37 GLN H H 62 7.697 7.697 7.631 0.066 17865
8805 1 14 . 1 1 38 38 ALA N N 63 118.964 118.964 120.146 -1.182 17865
8806 1 14 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.348 -0.106 17865
8807 1 14 . 1 1 38 38 ALA C C 63 177.221 177.221 176.491 0.730 17865
8808 1 14 . 1 1 38 38 ALA CA C 63 53.137 53.137 51.694 1.443 17865
8809 1 14 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.319 -0.422 17865
8810 1 14 . 1 1 38 38 ALA H H 63 7.508 7.508 7.723 -0.215 17865
8811 1 14 . 1 1 39 39 CYS N N 64 119.081 119.081 118.870 0.211 17865
8812 1 14 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.604 0.349 17865
8813 1 14 . 1 1 39 39 CYS C C 64 172.052 172.052 174.140 -2.088 17865
8814 1 14 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.700 -6.820 17865
8815 1 14 . 1 1 39 39 CYS CB C 64 34.328 34.328 26.318 8.010 17865
8816 1 14 . 1 1 39 39 CYS H H 64 7.354 7.354 7.600 -0.246 17865
8817 1 14 . 1 1 40 40 ASP N N 65 124.167 124.167 124.844 -0.677 17865
8818 1 14 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.541 -0.216 17865
8819 1 14 . 1 1 40 40 ASP C C 65 176.496 176.496 176.152 0.344 17865
8820 1 14 . 1 1 40 40 ASP CA C 65 56.724 56.724 55.558 1.166 17865
8821 1 14 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.918 -0.605 17865
8822 1 14 . 1 1 40 40 ASP H H 65 8.142 8.142 8.655 -0.513 17865
8823 1 14 . 1 1 41 41 LYS N N 66 118.844 118.844 119.816 -0.972 17865
8824 1 14 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.437 0.087 17865
8825 1 14 . 1 1 41 41 LYS C C 66 175.586 175.586 176.475 -0.889 17865
8826 1 14 . 1 1 41 41 LYS CA C 66 55.275 55.275 55.987 -0.712 17865
8827 1 14 . 1 1 41 41 LYS CB C 66 32.598 32.598 31.096 1.502 17865
8828 1 14 . 1 1 41 41 LYS H H 66 7.858 7.858 8.273 -0.415 17865
8829 1 14 . 1 1 42 42 LYS N N 67 126.081 126.081 120.760 5.321 17865
8830 1 14 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.209 -0.294 17865
8831 1 14 . 1 1 42 42 LYS C C 67 174.665 174.665 174.958 -0.293 17865
8832 1 14 . 1 1 42 42 LYS CA C 67 57.827 57.827 56.736 1.091 17865
8833 1 14 . 1 1 42 42 LYS CB C 67 34.059 34.059 32.882 1.177 17865
8834 1 14 . 1 1 42 42 LYS H H 67 8.790 8.790 8.386 0.404 17865
8835 1 14 . 1 1 43 43 TYR N N 68 114.138 114.138 117.832 -3.694 17865
8836 1 14 . 1 1 43 43 TYR HA H 68 5.259 5.259 5.037 0.222 17865
8837 1 14 . 1 1 43 43 TYR C C 68 175.767 175.767 175.570 0.197 17865
8838 1 14 . 1 1 43 43 TYR CA C 68 55.880 55.880 56.397 -0.517 17865
8839 1 14 . 1 1 43 43 TYR CB C 68 42.363 42.363 41.443 0.920 17865
8840 1 14 . 1 1 43 43 TYR H H 68 7.294 7.294 7.397 -0.103 17865
8841 1 14 . 1 1 44 44 ASP N N 69 121.807 121.807 122.341 -0.534 17865
8842 1 14 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.526 0.114 17865
8843 1 14 . 1 1 44 44 ASP C C 69 177.812 177.812 176.562 1.250 17865
8844 1 14 . 1 1 44 44 ASP CA C 69 52.110 52.110 53.619 -1.509 17865
8845 1 14 . 1 1 44 44 ASP CB C 69 41.440 41.440 42.373 -0.933 17865
8846 1 14 . 1 1 44 44 ASP H H 69 8.995 8.995 8.771 0.224 17865
8847 1 14 . 1 1 45 45 ASP N N 70 116.686 116.686 117.078 -0.392 17865
8848 1 14 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.405 0.019 17865
8849 1 14 . 1 1 45 45 ASP C C 70 177.054 177.054 177.190 -0.136 17865
8850 1 14 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.407 -0.026 17865
8851 1 14 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.976 -0.728 17865
8852 1 14 . 1 1 45 45 ASP H H 70 8.369 8.369 8.511 -0.142 17865
8853 1 14 . 1 1 46 46 GLN N N 71 117.949 117.949 117.275 0.674 17865
8854 1 14 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.282 0.174 17865
8855 1 14 . 1 1 46 46 GLN C C 71 176.273 176.273 177.054 -0.781 17865
8856 1 14 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.995 -0.628 17865
8857 1 14 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.597 -0.267 17865
8858 1 14 . 1 1 46 46 GLN H H 71 8.274 8.274 8.331 -0.057 17865
8859 1 14 . 1 1 47 47 GLY N N 72 108.369 108.369 106.240 2.129 17865
8860 1 14 . 1 1 47 47 GLY C C 72 174.145 174.145 174.412 -0.267 17865
8861 1 14 . 1 1 47 47 GLY CA C 72 45.823 45.823 44.667 1.156 17865
8862 1 14 . 1 1 47 47 GLY H H 72 8.174 8.174 8.257 -0.083 17865
8863 1 14 . 1 1 48 48 ARG N N 73 121.554 121.554 120.497 1.057 17865
8864 1 14 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.676 -0.191 17865
8865 1 14 . 1 1 48 48 ARG C C 73 176.855 176.855 176.129 0.726 17865
8866 1 14 . 1 1 48 48 ARG CA C 73 55.289 55.289 53.253 2.036 17865
8867 1 14 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.521 -0.963 17865
8868 1 14 . 1 1 48 48 ARG H H 73 8.462 8.462 8.799 -0.337 17865
8869 1 14 . 1 1 49 49 GLU N N 74 122.784 122.784 121.215 1.569 17865
8870 1 14 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.261 0.222 17865
8871 1 14 . 1 1 49 49 GLU C C 74 178.098 178.098 176.544 1.554 17865
8872 1 14 . 1 1 49 49 GLU CA C 74 57.184 57.184 57.665 -0.481 17865
8873 1 14 . 1 1 49 49 GLU CB C 74 30.777 30.777 29.945 0.833 17865
8874 1 14 . 1 1 49 49 GLU H H 74 8.703 8.703 8.754 -0.051 17865
8875 1 14 . 1 1 50 50 THR N N 75 114.563 114.563 114.860 -0.297 17865
8876 1 14 . 1 1 50 50 THR HA H 75 4.212 4.212 4.462 -0.250 17865
8877 1 14 . 1 1 50 50 THR C C 75 175.170 175.170 175.450 -0.280 17865
8878 1 14 . 1 1 50 50 THR CA C 75 60.589 60.589 60.684 -0.095 17865
8879 1 14 . 1 1 50 50 THR CB C 75 70.952 70.952 70.381 0.571 17865
8880 1 14 . 1 1 50 50 THR H H 75 7.717 7.717 7.831 -0.114 17865
8881 1 14 . 1 1 51 51 ALA N N 76 122.097 122.097 122.299 -0.202 17865
8882 1 14 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.037 0.001 17865
8883 1 14 . 1 1 51 51 ALA C C 76 181.906 181.906 179.253 2.653 17865
8884 1 14 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.022 0.632 17865
8885 1 14 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.302 -0.309 17865
8886 1 14 . 1 1 51 51 ALA H H 76 8.734 8.734 8.600 0.134 17865
8887 1 14 . 1 1 52 52 CYS N N 77 115.347 115.347 116.249 -0.902 17865
8888 1 14 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.253 0.227 17865
8889 1 14 . 1 1 52 52 CYS C C 77 176.299 176.299 176.532 -0.233 17865
8890 1 14 . 1 1 52 52 CYS CA C 77 57.701 57.701 60.333 -2.632 17865
8891 1 14 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.617 10.014 17865
8892 1 14 . 1 1 52 52 CYS H H 77 9.073 9.073 8.060 1.013 17865
8893 1 14 . 1 1 53 53 ALA N N 78 128.517 128.517 122.556 5.961 17865
8894 1 14 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.874 -0.019 17865
8895 1 14 . 1 1 53 53 ALA C C 78 178.736 178.736 179.271 -0.535 17865
8896 1 14 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.023 0.610 17865
8897 1 14 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.969 1.222 17865
8898 1 14 . 1 1 53 53 ALA H H 78 7.174 7.174 7.722 -0.548 17865
8899 1 14 . 1 1 54 54 LYS N N 79 118.706 118.706 118.773 -0.067 17865
8900 1 14 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.251 -0.448 17865
8901 1 14 . 1 1 54 54 LYS C C 79 179.611 179.611 178.703 0.908 17865
8902 1 14 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.545 1.180 17865
8903 1 14 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.683 -0.030 17865
8904 1 14 . 1 1 54 54 LYS H H 79 8.313 8.313 7.969 0.344 17865
8905 1 14 . 1 1 55 55 GLY N N 80 104.822 104.822 108.325 -3.503 17865
8906 1 14 . 1 1 55 55 GLY C C 80 176.504 176.504 176.123 0.381 17865
8907 1 14 . 1 1 55 55 GLY CA C 80 46.839 46.839 47.034 -0.195 17865
8908 1 14 . 1 1 55 55 GLY H H 80 8.175 8.175 7.578 0.597 17865
8909 1 14 . 1 1 56 56 ILE N N 81 123.697 123.697 122.518 1.179 17865
8910 1 14 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.919 -0.124 17865
8911 1 14 . 1 1 56 56 ILE C C 81 177.334 177.334 177.773 -0.439 17865
8912 1 14 . 1 1 56 56 ILE CA C 81 65.281 65.281 65.163 0.118 17865
8913 1 14 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.914 0.421 17865
8914 1 14 . 1 1 56 56 ILE H H 81 7.590 7.590 8.049 -0.459 17865
8915 1 14 . 1 1 57 57 ARG N N 82 118.161 118.161 117.680 0.481 17865
8916 1 14 . 1 1 57 57 ARG HA H 82 3.935 3.935 4.001 -0.066 17865
8917 1 14 . 1 1 57 57 ARG C C 82 178.662 178.662 177.529 1.133 17865
8918 1 14 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.264 0.438 17865
8919 1 14 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.650 0.249 17865
8920 1 14 . 1 1 57 57 ARG H H 82 7.569 7.569 8.081 -0.512 17865
8921 1 14 . 1 1 58 58 GLU N N 83 115.085 115.085 117.332 -2.247 17865
8922 1 14 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.133 -0.102 17865
8923 1 14 . 1 1 58 58 GLU C C 83 178.224 178.224 177.995 0.229 17865
8924 1 14 . 1 1 58 58 GLU CA C 83 58.304 58.304 57.597 0.707 17865
8925 1 14 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.281 0.750 17865
8926 1 14 . 1 1 58 58 GLU H H 83 7.786 7.786 7.596 0.190 17865
8927 1 14 . 1 1 59 59 LYS N N 84 119.183 119.183 120.542 -1.359 17865
8928 1 14 . 1 1 59 59 LYS HA H 84 3.830 3.830 4.021 -0.191 17865
8929 1 14 . 1 1 59 59 LYS C C 84 177.933 177.933 178.267 -0.334 17865
8930 1 14 . 1 1 59 59 LYS CA C 84 59.043 59.043 58.411 0.632 17865
8931 1 14 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.914 0.736 17865
8932 1 14 . 1 1 59 59 LYS H H 84 7.968 7.968 8.120 -0.152 17865
8933 1 14 . 1 1 60 60 TYR N N 85 113.663 113.663 117.761 -4.098 17865
8934 1 14 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.518 0.185 17865
8935 1 14 . 1 1 60 60 TYR C C 85 174.729 174.729 174.408 0.321 17865
8936 1 14 . 1 1 60 60 TYR CA C 85 57.202 57.202 57.139 0.063 17865
8937 1 14 . 1 1 60 60 TYR CB C 85 37.902 37.902 36.973 0.929 17865
8938 1 14 . 1 1 60 60 TYR H H 85 7.562 7.562 7.939 -0.377 17865
8939 1 14 . 1 1 61 61 LYS N N 86 121.862 121.862 120.341 1.521 17865
8940 1 14 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.077 0.435 17865
8941 1 14 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.495 -0.553 17865
8942 1 14 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.066 0.036 17865
8943 1 14 . 1 1 61 61 LYS H H 86 7.222 7.222 7.092 0.130 17865
8944 1 14 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.464 -0.141 17865
8945 1 14 . 1 1 62 62 PRO C C 87 176.576 176.576 176.056 0.520 17865
8946 1 14 . 1 1 62 62 PRO CA C 87 63.020 63.020 61.545 1.475 17865
8947 1 14 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.841 -0.601 17865
8948 1 14 . 1 1 63 63 ALA N N 88 125.029 125.029 123.947 1.082 17865
8949 1 14 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.166 0.088 17865
8950 1 14 . 1 1 63 63 ALA C C 88 177.301 177.301 176.602 0.699 17865
8951 1 14 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.404 -0.124 17865
8952 1 14 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.411 1.791 17865
8953 1 14 . 1 1 63 63 ALA H H 88 8.329 8.329 8.331 -0.002 17865
8954 1 14 . 1 1 64 64 VAL N N 89 121.843 121.843 120.034 1.809 17865
8955 1 14 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.480 -0.536 17865
8956 1 14 . 1 1 64 64 VAL C C 89 174.791 174.791 174.970 -0.179 17865
8957 1 14 . 1 1 64 64 VAL CA C 89 61.981 61.981 59.834 2.147 17865
8958 1 14 . 1 1 64 64 VAL CB C 89 33.485 33.485 35.749 -2.264 17865
8959 1 14 . 1 1 64 64 VAL H H 89 8.075 8.075 7.640 0.435 17865
8960 1 14 . 1 1 65 65 VAL N N 90 125.399 125.399 118.781 6.618 17865
8961 1 14 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.235 -0.097 17865
8962 1 14 . 1 1 65 65 VAL C C 90 174.340 174.340 174.512 -0.172 17865
8963 1 14 . 1 1 65 65 VAL CA C 90 61.162 61.162 62.974 -1.812 17865
8964 1 14 . 1 1 65 65 VAL CB C 90 33.866 33.866 30.314 3.551 17865
8965 1 14 . 1 1 65 65 VAL H H 90 8.229 8.229 8.310 -0.081 17865
8966 1 14 . 1 1 66 66 TYR N N 91 124.848 124.848 128.650 -3.802 17865
8967 1 14 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.947 -0.176 17865
8968 1 14 . 1 1 66 66 TYR C C 91 176.658 176.658 176.062 0.596 17865
8969 1 14 . 1 1 66 66 TYR CA C 91 58.084 58.084 57.046 1.038 17865
8970 1 14 . 1 1 66 66 TYR CB C 91 41.535 41.535 41.526 0.009 17865
8971 1 14 . 1 1 66 66 TYR H H 91 9.145 9.145 8.301 0.844 17865
8972 1 14 . 1 1 67 67 GLY N N 92 106.185 106.185 111.685 -5.500 17865
8973 1 14 . 1 1 67 67 GLY C C 92 175.681 175.681 174.831 0.850 17865
8974 1 14 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.490 0.485 17865
8975 1 14 . 1 1 67 67 GLY H H 92 8.730 8.730 8.719 0.011 17865
8976 1 14 . 1 1 68 68 TYR N N 93 121.815 121.815 118.807 3.008 17865
8977 1 14 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.104 -0.129 17865
8978 1 14 . 1 1 68 68 TYR C C 93 176.035 176.035 177.146 -1.111 17865
8979 1 14 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.518 1.528 17865
8980 1 14 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.160 0.265 17865
8981 1 14 . 1 1 68 68 TYR H H 93 8.711 8.711 8.240 0.471 17865
8982 1 14 . 1 1 69 69 ASP N N 94 115.507 115.507 118.081 -2.574 17865
8983 1 14 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.543 -0.255 17865
8984 1 14 . 1 1 69 69 ASP C C 94 177.063 177.063 176.796 0.267 17865
8985 1 14 . 1 1 69 69 ASP CA C 94 53.011 53.011 54.329 -1.318 17865
8986 1 14 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.845 -0.678 17865
8987 1 14 . 1 1 69 69 ASP H H 94 8.010 8.010 7.757 0.253 17865
8988 1 14 . 1 1 70 70 GLY N N 95 107.196 107.196 106.834 0.362 17865
8989 1 14 . 1 1 70 70 GLY C C 95 173.936 173.936 173.308 0.628 17865
8990 1 14 . 1 1 70 70 GLY CA C 95 45.392 45.392 44.777 0.615 17865
8991 1 14 . 1 1 70 70 GLY H H 95 7.986 7.986 7.581 0.405 17865
8992 1 14 . 1 1 71 71 LYS N N 96 121.258 121.258 118.949 2.309 17865
8993 1 14 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.425 0.359 17865
8994 1 14 . 1 1 71 71 LYS CA C 96 54.114 54.114 52.968 1.146 17865
8995 1 14 . 1 1 71 71 LYS CB C 96 31.762 31.762 33.177 -1.415 17865
8996 1 14 . 1 1 71 71 LYS H H 96 7.877 7.877 7.528 0.349 17865
8997 1 14 . 1 1 72 72 PRO C C 97 177.170 177.170 175.552 1.618 17865
8998 1 14 . 1 1 72 72 PRO CA C 97 63.137 63.137 62.013 1.124 17865
8999 1 14 . 1 1 72 72 PRO CB C 97 32.240 32.240 30.708 1.532 17865
9000 1 14 . 1 1 73 73 LEU N N 98 123.503 123.503 119.411 4.092 17865
9001 1 14 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.594 -0.234 17865
9002 1 14 . 1 1 73 73 LEU C C 98 176.354 176.354 176.042 0.312 17865
9003 1 14 . 1 1 73 73 LEU CA C 98 53.927 53.927 53.179 0.748 17865
9004 1 14 . 1 1 73 73 LEU CB C 98 42.272 42.272 42.596 -0.324 17865
9005 1 14 . 1 1 73 73 LEU H H 98 8.850 8.850 7.353 1.497 17865
9006 1 14 . 1 1 74 74 ASP N N 99 122.212 122.212 123.841 -1.629 17865
9007 1 14 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.721 -0.124 17865
9008 1 14 . 1 1 74 74 ASP C C 99 175.819 175.819 174.952 0.867 17865
9009 1 14 . 1 1 74 74 ASP CA C 99 53.856 53.856 54.075 -0.219 17865
9010 1 14 . 1 1 74 74 ASP CB C 99 40.989 40.989 39.108 1.881 17865
9011 1 14 . 1 1 74 74 ASP H H 99 8.517 8.517 8.829 -0.312 17865
9012 1 14 . 1 1 75 75 LEU N N 100 125.874 125.874 120.205 5.669 17865
9013 1 14 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.685 -0.319 17865
9014 1 14 . 1 1 75 75 LEU C C 100 178.426 178.426 178.292 0.134 17865
9015 1 14 . 1 1 75 75 LEU CA C 100 53.631 53.631 54.732 -1.101 17865
9016 1 14 . 1 1 75 75 LEU CB C 100 40.676 40.676 44.156 -3.480 17865
9017 1 14 . 1 1 75 75 LEU H H 100 8.281 8.281 7.570 0.711 17865
9018 1 14 . 1 1 76 76 GLY N N 101 110.604 110.604 110.767 -0.163 17865
9019 1 14 . 1 1 76 76 GLY C C 101 176.936 176.936 175.187 1.749 17865
9020 1 14 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.722 0.105 17865
9021 1 14 . 1 1 76 76 GLY H H 101 8.914 8.914 8.016 0.898 17865
9022 1 14 . 1 1 77 77 PHE N N 102 117.639 117.639 118.361 -0.722 17865
9023 1 14 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.856 -0.475 17865
9024 1 14 . 1 1 77 77 PHE C C 102 177.878 177.878 174.966 2.912 17865
9025 1 14 . 1 1 77 77 PHE CA C 102 59.139 59.139 56.560 2.579 17865
9026 1 14 . 1 1 77 77 PHE CB C 102 36.935 36.935 38.963 -2.028 17865
9027 1 14 . 1 1 77 77 PHE H H 102 7.992 7.992 7.952 0.040 17865
9028 1 14 . 1 1 78 78 CYS N N 103 121.136 121.136 117.964 3.172 17865
9029 1 14 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.869 -0.484 17865
9030 1 14 . 1 1 78 78 CYS C C 103 172.780 172.780 176.209 -3.429 17865
9031 1 14 . 1 1 78 78 CYS CA C 103 53.696 53.696 57.901 -4.205 17865
9032 1 14 . 1 1 78 78 CYS CB C 103 34.237 34.237 28.827 5.410 17865
9033 1 14 . 1 1 78 78 CYS H H 103 7.362 7.362 7.943 -0.581 17865
9034 1 14 . 1 1 79 79 THR N N 104 114.773 114.773 117.098 -2.325 17865
9035 1 14 . 1 1 79 79 THR HA H 104 3.984 3.984 4.047 -0.063 17865
9036 1 14 . 1 1 79 79 THR C C 104 176.624 176.624 176.007 0.617 17865
9037 1 14 . 1 1 79 79 THR CA C 104 65.180 65.180 65.687 -0.507 17865
9038 1 14 . 1 1 79 79 THR CB C 104 69.062 69.062 68.593 0.469 17865
9039 1 14 . 1 1 79 79 THR H H 104 7.864 7.864 8.071 -0.207 17865
9040 1 14 . 1 1 80 80 LEU N N 105 119.785 119.785 118.201 1.584 17865
9041 1 14 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.221 0.110 17865
9042 1 14 . 1 1 80 80 LEU C C 105 177.208 177.208 177.403 -0.195 17865
9043 1 14 . 1 1 80 80 LEU CA C 105 55.453 55.453 56.616 -1.163 17865
9044 1 14 . 1 1 80 80 LEU CB C 105 41.293 41.293 40.123 1.170 17865
9045 1 14 . 1 1 80 80 LEU H H 105 7.238 7.238 8.140 -0.902 17865
9046 1 14 . 1 1 81 81 ALA N N 106 119.309 119.309 122.185 -2.876 17865
9047 1 14 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.254 0.273 17865
9048 1 14 . 1 1 81 81 ALA C C 106 178.769 178.769 178.462 0.307 17865
9049 1 14 . 1 1 81 81 ALA CA C 106 52.049 52.049 52.477 -0.428 17865
9050 1 14 . 1 1 81 81 ALA CB C 106 18.820 18.820 19.767 -0.947 17865
9051 1 14 . 1 1 81 81 ALA H H 106 7.432 7.432 7.542 -0.110 17865
9052 1 14 . 1 1 82 82 GLY N N 107 109.793 109.793 106.731 3.062 17865
9053 1 14 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.102 2.017 17865
9054 1 14 . 1 1 82 82 GLY H H 107 7.918 7.918 7.706 0.212 17865
9055 1 14 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.984 0.282 17865
9056 1 14 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.004 0.259 17865
9057 1 14 . 1 1 83 83 ILE CB C 108 38.261 38.261 38.095 0.166 17865
9058 1 14 . 1 1 84 84 ARG HA H 109 4.755 4.755 3.997 0.758 17865
9059 1 14 . 1 1 84 84 ARG C C 109 181.344 181.344 178.059 3.285 17865
9060 1 14 . 1 1 84 84 ARG CA C 109 55.939 55.939 57.853 -1.914 17865
9061 1 14 . 1 1 84 84 ARG CB C 109 30.283 30.283 28.401 1.882 17865
9062 1 14 . 1 1 85 85 GLU N N 110 122.944 122.944 120.987 1.957 17865
9063 1 14 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.092 -0.475 17865
9064 1 14 . 1 1 85 85 GLU C C 110 177.797 177.797 178.850 -1.053 17865
9065 1 14 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.429 1.299 17865
9066 1 14 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.366 -0.495 17865
9067 1 14 . 1 1 85 85 GLU H H 110 8.003 8.003 7.567 0.436 17865
9068 1 14 . 1 1 86 86 VAL N N 111 117.101 117.101 117.487 -0.386 17865
9069 1 14 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.674 -0.163 17865
9070 1 14 . 1 1 86 86 VAL C C 111 177.710 177.710 177.755 -0.045 17865
9071 1 14 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.011 0.419 17865
9072 1 14 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.767 -0.555 17865
9073 1 14 . 1 1 86 86 VAL H H 111 8.106 8.106 7.527 0.579 17865
9074 1 14 . 1 1 87 87 ASP N N 112 122.242 122.242 119.289 2.953 17865
9075 1 14 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.568 -0.264 17865
9076 1 14 . 1 1 87 87 ASP C C 112 176.912 176.912 178.573 -1.661 17865
9077 1 14 . 1 1 87 87 ASP CA C 112 57.417 57.417 57.090 0.327 17865
9078 1 14 . 1 1 87 87 ASP CB C 112 40.476 40.476 41.403 -0.927 17865
9079 1 14 . 1 1 87 87 ASP H H 112 7.401 7.401 7.653 -0.252 17865
9080 1 14 . 1 1 88 88 CYS N N 113 120.819 120.819 117.206 3.613 17865
9081 1 14 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.726 -1.417 17865
9082 1 14 . 1 1 88 88 CYS C C 113 175.270 175.270 177.335 -2.065 17865
9083 1 14 . 1 1 88 88 CYS CA C 113 59.759 59.759 60.018 -0.259 17865
9084 1 14 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.376 7.459 17865
9085 1 14 . 1 1 88 88 CYS H H 113 7.785 7.785 8.421 -0.636 17865
9086 1 14 . 1 1 89 89 ARG N N 114 118.654 118.654 120.218 -1.564 17865
9087 1 14 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.092 -0.451 17865
9088 1 14 . 1 1 89 89 ARG C C 114 179.018 179.018 178.019 0.999 17865
9089 1 14 . 1 1 89 89 ARG CA C 114 60.193 60.193 58.798 1.395 17865
9090 1 14 . 1 1 89 89 ARG CB C 114 29.713 29.713 29.541 0.172 17865
9091 1 14 . 1 1 89 89 ARG H H 114 8.142 8.142 7.671 0.471 17865
9092 1 14 . 1 1 90 90 LYS N N 115 120.964 120.964 119.087 1.877 17865
9093 1 14 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.164 -0.134 17865
9094 1 14 . 1 1 90 90 LYS C C 115 180.092 180.092 177.901 2.191 17865
9095 1 14 . 1 1 90 90 LYS CA C 115 59.568 59.568 59.101 0.467 17865
9096 1 14 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.595 -0.374 17865
9097 1 14 . 1 1 90 90 LYS H H 115 7.936 7.936 7.959 -0.023 17865
9098 1 14 . 1 1 91 91 ASP N N 116 121.690 121.690 117.437 4.253 17865
9099 1 14 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.546 -0.033 17865
9100 1 14 . 1 1 91 91 ASP C C 116 179.419 179.419 177.895 1.524 17865
9101 1 14 . 1 1 91 91 ASP CA C 116 57.237 57.237 55.714 1.524 17865
9102 1 14 . 1 1 91 91 ASP CB C 116 40.648 40.648 40.724 -0.076 17865
9103 1 14 . 1 1 91 91 ASP H H 116 8.558 8.558 7.727 0.831 17865
9104 1 14 . 1 1 92 92 ALA N N 117 122.784 122.784 123.431 -0.647 17865
9105 1 14 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.064 -0.041 17865
9106 1 14 . 1 1 92 92 ALA C C 117 178.789 178.789 179.520 -0.731 17865
9107 1 14 . 1 1 92 92 ALA CA C 117 55.051 55.051 54.847 0.204 17865
9108 1 14 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.219 0.956 17865
9109 1 14 . 1 1 92 92 ALA H H 117 8.703 8.703 7.838 0.865 17865
9110 1 14 . 1 1 93 93 GLN N N 118 115.510 115.510 117.374 -1.864 17865
9111 1 14 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.068 -0.124 17865
9112 1 14 . 1 1 93 93 GLN C C 118 178.745 178.745 176.913 1.832 17865
9113 1 14 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.716 0.766 17865
9114 1 14 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.111 0.286 17865
9115 1 14 . 1 1 93 93 GLN H H 118 7.664 7.664 8.619 -0.955 17865
9116 1 14 . 1 1 94 94 THR N N 119 110.110 110.110 115.882 -5.772 17865
9117 1 14 . 1 1 94 94 THR HA H 119 4.237 4.237 4.139 0.098 17865
9118 1 14 . 1 1 94 94 THR C C 119 175.861 175.861 176.196 -0.335 17865
9119 1 14 . 1 1 94 94 THR CA C 119 64.604 64.604 64.971 -0.367 17865
9120 1 14 . 1 1 94 94 THR CB C 119 69.716 69.716 68.743 0.973 17865
9121 1 14 . 1 1 94 94 THR H H 119 7.726 7.726 7.547 0.179 17865
9122 1 14 . 1 1 95 95 CYS N N 120 118.523 118.523 121.743 -3.220 17865
9123 1 14 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.263 0.470 17865
9124 1 14 . 1 1 95 95 CYS C C 120 175.165 175.165 174.871 0.294 17865
9125 1 14 . 1 1 95 95 CYS CA C 120 52.973 52.973 59.894 -6.921 17865
9126 1 14 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.224 12.507 17865
9127 1 14 . 1 1 95 95 CYS H H 120 7.756 7.756 7.953 -0.197 17865
9128 1 14 . 1 1 96 96 ASP N N 121 119.081 119.081 121.425 -2.344 17865
9129 1 14 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.268 0.410 17865
9130 1 14 . 1 1 96 96 ASP CA C 121 56.224 56.224 57.312 -1.088 17865
9131 1 14 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.603 1.128 17865
9132 1 14 . 1 1 96 96 ASP H H 121 7.354 7.354 8.345 -0.991 17865
9133 1 14 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.373 -0.798 17865
9134 1 14 . 1 1 97 97 LYS C C 122 175.510 175.510 176.181 -0.671 17865
9135 1 14 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.115 0.724 17865
9136 1 14 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.251 -3.501 17865
9137 1 14 . 1 1 98 98 LYS N N 123 119.980 119.980 117.466 2.514 17865
9138 1 14 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.504 -0.210 17865
9139 1 14 . 1 1 98 98 LYS C C 123 176.968 176.968 178.266 -1.298 17865
9140 1 14 . 1 1 98 98 LYS CA C 123 55.904 55.904 57.177 -1.273 17865
9141 1 14 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.479 -0.247 17865
9142 1 14 . 1 1 98 98 LYS H H 123 7.799 7.799 8.139 -0.340 17865
9143 1 14 . 1 1 99 99 TYR N N 124 122.378 122.378 117.746 4.632 17865
9144 1 14 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.303 -0.408 17865
9145 1 14 . 1 1 99 99 TYR C C 124 177.126 177.126 176.323 0.803 17865
9146 1 14 . 1 1 99 99 TYR CA C 124 60.211 60.211 59.302 0.909 17865
9147 1 14 . 1 1 99 99 TYR CB C 124 38.271 38.271 37.515 0.756 17865
9148 1 14 . 1 1 99 99 TYR H H 124 8.536 8.536 7.919 0.617 17865
9149 1 14 . 1 1 100 100 GLU N N 125 118.610 118.610 117.142 1.468 17865
9150 1 14 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.593 -0.325 17865
9151 1 14 . 1 1 100 100 GLU C C 125 177.387 177.387 177.353 0.034 17865
9152 1 14 . 1 1 100 100 GLU CA C 125 55.759 55.759 55.572 0.187 17865
9153 1 14 . 1 1 100 100 GLU CB C 125 27.321 27.321 29.024 -1.703 17865
9154 1 14 . 1 1 100 100 GLU H H 125 8.385 8.385 7.858 0.527 17865
9155 1 14 . 1 1 101 101 SER N N 126 115.949 115.949 117.102 -1.153 17865
9156 1 14 . 1 1 101 101 SER HA H 126 3.959 3.959 4.218 -0.259 17865
9157 1 14 . 1 1 101 101 SER C C 126 176.047 176.047 176.027 0.020 17865
9158 1 14 . 1 1 101 101 SER CA C 126 62.439 62.439 61.124 1.315 17865
9159 1 14 . 1 1 101 101 SER CB C 126 63.299 63.299 62.935 0.364 17865
9160 1 14 . 1 1 101 101 SER H H 126 7.823 7.823 8.172 -0.349 17865
9161 1 14 . 1 1 102 102 ASP N N 127 120.920 120.920 121.156 -0.236 17865
9162 1 14 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.301 0.106 17865
9163 1 14 . 1 1 102 102 ASP C C 127 178.234 178.234 178.357 -0.123 17865
9164 1 14 . 1 1 102 102 ASP CA C 127 57.411 57.411 58.372 -0.961 17865
9165 1 14 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.264 -0.548 17865
9166 1 14 . 1 1 102 102 ASP H H 127 8.683 8.683 8.174 0.509 17865
9167 1 14 . 1 1 103 103 LYS N N 128 121.753 121.753 118.312 3.441 17865
9168 1 14 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.175 -0.171 17865
9169 1 14 . 1 1 103 103 LYS C C 128 179.395 179.395 178.539 0.856 17865
9170 1 14 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.520 0.951 17865
9171 1 14 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.735 0.666 17865
9172 1 14 . 1 1 103 103 LYS H H 128 7.771 7.771 8.335 -0.564 17865
9173 1 14 . 1 1 104 104 CYS N N 129 120.109 120.109 119.691 0.418 17865
9174 1 14 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.309 -0.115 17865
9175 1 14 . 1 1 104 104 CYS C C 129 176.779 176.779 176.971 -0.192 17865
9176 1 14 . 1 1 104 104 CYS CA C 129 59.790 59.790 60.990 -1.200 17865
9177 1 14 . 1 1 104 104 CYS CB C 129 36.879 36.879 26.000 10.879 17865
9178 1 14 . 1 1 104 104 CYS H H 129 7.973 7.973 7.460 0.513 17865
9179 1 14 . 1 1 105 105 LEU N N 130 121.804 121.804 121.765 0.039 17865
9180 1 14 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.924 0.166 17865
9181 1 14 . 1 1 105 105 LEU C C 130 179.373 179.373 178.887 0.486 17865
9182 1 14 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.228 -0.860 17865
9183 1 14 . 1 1 105 105 LEU CB C 130 42.098 42.098 42.109 -0.011 17865
9184 1 14 . 1 1 105 105 LEU H H 130 8.666 8.666 8.546 0.120 17865
9185 1 14 . 1 1 106 106 ASN N N 131 118.535 118.535 116.314 2.221 17865
9186 1 14 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.495 -0.257 17865
9187 1 14 . 1 1 106 106 ASN C C 131 177.830 177.830 177.218 0.612 17865
9188 1 14 . 1 1 106 106 ASN CA C 131 56.256 56.256 55.775 0.481 17865
9189 1 14 . 1 1 106 106 ASN CB C 131 37.817 37.817 38.061 -0.244 17865
9190 1 14 . 1 1 106 106 ASN H H 131 8.438 8.438 8.075 0.363 17865
9191 1 14 . 1 1 107 107 ALA N N 132 121.485 121.485 121.662 -0.177 17865
9192 1 14 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.243 -0.024 17865
9193 1 14 . 1 1 107 107 ALA C C 132 180.726 180.726 178.353 2.373 17865
9194 1 14 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.494 0.469 17865
9195 1 14 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.872 -1.051 17865
9196 1 14 . 1 1 107 107 ALA H H 132 7.541 7.541 7.508 0.033 17865
9197 1 14 . 1 1 108 108 ILE N N 133 120.979 120.979 116.258 4.721 17865
9198 1 14 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.955 -0.024 17865
9199 1 14 . 1 1 108 108 ILE C C 133 178.114 178.114 178.056 0.058 17865
9200 1 14 . 1 1 108 108 ILE CA C 133 63.353 63.353 62.087 1.266 17865
9201 1 14 . 1 1 108 108 ILE CB C 133 36.454 36.454 37.645 -1.191 17865
9202 1 14 . 1 1 108 108 ILE H H 133 7.551 7.551 7.504 0.047 17865
9203 1 14 . 1 1 109 109 LYS N N 134 121.415 121.415 120.259 1.156 17865
9204 1 14 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.220 -0.632 17865
9205 1 14 . 1 1 109 109 LYS C C 134 179.561 179.561 178.639 0.922 17865
9206 1 14 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.767 0.342 17865
9207 1 14 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.335 -0.174 17865
9208 1 14 . 1 1 109 109 LYS H H 134 8.414 8.414 7.587 0.827 17865
9209 1 14 . 1 1 110 110 GLU N N 135 116.099 116.099 118.023 -1.924 17865
9210 1 14 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.152 -0.223 17865
9211 1 14 . 1 1 110 110 GLU C C 135 178.239 178.239 177.885 0.354 17865
9212 1 14 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.617 0.029 17865
9213 1 14 . 1 1 110 110 GLU CB C 135 29.638 29.638 28.837 0.801 17865
9214 1 14 . 1 1 110 110 GLU H H 135 7.473 7.473 7.890 -0.417 17865
9215 1 14 . 1 1 111 111 LYS N N 136 119.805 119.805 118.309 1.496 17865
9216 1 14 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.021 -0.115 17865
9217 1 14 . 1 1 111 111 LYS C C 136 177.600 177.600 177.403 0.197 17865
9218 1 14 . 1 1 111 111 LYS CA C 136 58.749 58.749 57.719 1.030 17865
9219 1 14 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.426 0.812 17865
9220 1 14 . 1 1 111 111 LYS H H 136 7.540 7.540 7.492 0.048 17865
9221 1 14 . 1 1 112 112 TYR N N 137 114.768 114.768 116.997 -2.229 17865
9222 1 14 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.586 -0.063 17865
9223 1 14 . 1 1 112 112 TYR C C 137 174.690 174.690 175.073 -0.383 17865
9224 1 14 . 1 1 112 112 TYR CA C 137 58.359 58.359 56.576 1.783 17865
9225 1 14 . 1 1 112 112 TYR CB C 137 38.328 38.328 37.965 0.363 17865
9226 1 14 . 1 1 112 112 TYR H H 137 7.488 7.488 7.345 0.143 17865
9227 1 14 . 1 1 113 113 LYS N N 138 123.694 123.694 120.948 2.746 17865
9228 1 14 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.468 0.033 17865
9229 1 14 . 1 1 113 113 LYS CA C 138 55.282 55.282 53.846 1.436 17865
9230 1 14 . 1 1 113 113 LYS CB C 138 32.124 32.124 31.579 0.545 17865
9231 1 14 . 1 1 113 113 LYS H H 138 7.217 7.217 7.556 -0.339 17865
9232 1 14 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.371 0.081 17865
9233 1 14 . 1 1 114 114 PRO C C 139 176.974 176.974 176.252 0.722 17865
9234 1 14 . 1 1 114 114 PRO CA C 139 63.189 63.189 63.517 -0.328 17865
9235 1 14 . 1 1 114 114 PRO CB C 139 32.251 32.251 31.937 0.314 17865
9236 1 14 . 1 1 115 115 VAL N N 140 121.098 121.098 120.292 0.806 17865
9237 1 14 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.354 -0.252 17865
9238 1 14 . 1 1 115 115 VAL C C 140 176.207 176.207 175.418 0.789 17865
9239 1 14 . 1 1 115 115 VAL CA C 140 62.356 62.356 61.739 0.617 17865
9240 1 14 . 1 1 115 115 VAL CB C 140 33.256 33.256 32.638 0.618 17865
9241 1 14 . 1 1 115 115 VAL H H 140 8.272 8.272 8.005 0.267 17865
9242 1 14 . 1 1 116 116 VAL N N 141 124.167 124.167 122.087 2.080 17865
9243 1 14 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.274 -0.152 17865
9244 1 14 . 1 1 116 116 VAL C C 141 175.415 175.415 175.326 0.089 17865
9245 1 14 . 1 1 116 116 VAL CA C 141 61.731 61.731 61.419 0.312 17865
9246 1 14 . 1 1 116 116 VAL CB C 141 33.145 33.145 33.208 -0.063 17865
9247 1 14 . 1 1 116 116 VAL H H 141 8.142 8.142 7.598 0.544 17865
9248 1 14 . 1 1 117 117 ASP N N 142 126.737 126.737 128.970 -2.233 17865
9249 1 14 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.821 -0.009 17865
9250 1 14 . 1 1 117 117 ASP CA C 142 52.217 52.217 53.273 -1.056 17865
9251 1 14 . 1 1 117 117 ASP CB C 142 41.368 41.368 41.382 -0.014 17865
9252 1 14 . 1 1 117 117 ASP H H 142 8.419 8.419 8.595 -0.176 17865
9253 1 14 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.376 0.035 17865
9254 1 14 . 1 1 118 118 PRO C C 143 176.662 176.662 176.356 0.306 17865
9255 1 14 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.654 -0.407 17865
9256 1 14 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.334 -0.024 17865
9257 1 14 . 1 1 119 119 ASN N N 144 119.287 119.287 117.267 2.020 17865
9258 1 14 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.974 -0.027 17865
9259 1 14 . 1 1 119 119 ASN CA C 144 51.633 51.633 51.088 0.545 17865
9260 1 14 . 1 1 119 119 ASN CB C 144 38.859 38.859 39.762 -0.903 17865
9261 1 14 . 1 1 119 119 ASN H H 144 8.432 8.432 7.947 0.485 17865
9262 1 14 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.661 0.019 17865
9263 1 14 . 1 1 120 120 PRO CA C 145 61.640 61.640 61.865 -0.226 17865
9264 1 14 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.208 -0.290 17865
9265 1 14 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.335 0.042 17865
9266 1 14 . 1 1 121 121 PRO C C 146 175.876 175.876 176.668 -0.792 17865
9267 1 14 . 1 1 121 121 PRO CA C 146 63.174 63.174 63.135 0.039 17865
9268 1 14 . 1 1 121 121 PRO CB C 146 31.939 31.939 31.890 0.049 17865
9269 1 15 . 1 1 2 2 ASP N N 27 121.041 121.041 122.757 -1.716 17865
9270 1 15 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.511 0.127 17865
9271 1 15 . 1 1 2 2 ASP C C 27 175.878 175.878 175.259 0.619 17865
9272 1 15 . 1 1 2 2 ASP CA C 27 54.382 54.382 54.276 0.106 17865
9273 1 15 . 1 1 2 2 ASP CB C 27 41.729 41.729 41.525 0.204 17865
9274 1 15 . 1 1 2 2 ASP H H 27 8.639 8.639 8.271 0.368 17865
9275 1 15 . 1 1 3 3 VAL N N 28 119.901 119.901 120.490 -0.589 17865
9276 1 15 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.022 0.011 17865
9277 1 15 . 1 1 3 3 VAL C C 28 175.521 175.521 175.527 -0.006 17865
9278 1 15 . 1 1 3 3 VAL CA C 28 62.216 62.216 61.976 0.240 17865
9279 1 15 . 1 1 3 3 VAL CB C 28 33.003 33.003 30.955 2.048 17865
9280 1 15 . 1 1 3 3 VAL H H 28 8.113 8.113 7.820 0.293 17865
9281 1 15 . 1 1 4 4 PHE N N 29 123.707 123.707 120.188 3.519 17865
9282 1 15 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.581 0.075 17865
9283 1 15 . 1 1 4 4 PHE C C 29 174.874 174.874 176.683 -1.809 17865
9284 1 15 . 1 1 4 4 PHE CA C 29 57.159 57.159 57.621 -0.462 17865
9285 1 15 . 1 1 4 4 PHE CB C 29 39.795 39.795 40.137 -0.342 17865
9286 1 15 . 1 1 4 4 PHE H H 29 8.255 8.255 7.507 0.748 17865
9287 1 15 . 1 1 5 5 ASP N N 30 124.203 124.203 121.664 2.539 17865
9288 1 15 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.822 0.016 17865
9289 1 15 . 1 1 5 5 ASP CA C 30 52.385 52.385 52.767 -0.382 17865
9290 1 15 . 1 1 5 5 ASP CB C 30 40.801 40.801 40.934 -0.134 17865
9291 1 15 . 1 1 5 5 ASP H H 30 8.226 8.226 8.390 -0.164 17865
9292 1 15 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.715 -0.178 17865
9293 1 15 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.140 -0.476 17865
9294 1 15 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.767 -0.942 17865
9295 1 15 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.486 -0.060 17865
9296 1 15 . 1 1 7 7 PRO C C 32 177.226 177.226 177.228 -0.002 17865
9297 1 15 . 1 1 7 7 PRO CA C 32 63.169 63.169 62.849 0.320 17865
9298 1 15 . 1 1 7 7 PRO CB C 32 31.948 31.948 32.281 -0.333 17865
9299 1 15 . 1 1 8 8 THR N N 33 114.158 114.158 116.707 -2.549 17865
9300 1 15 . 1 1 8 8 THR HA H 33 4.195 4.195 4.377 -0.182 17865
9301 1 15 . 1 1 8 8 THR C C 33 174.468 174.468 174.194 0.274 17865
9302 1 15 . 1 1 8 8 THR CA C 33 62.110 62.110 62.286 -0.176 17865
9303 1 15 . 1 1 8 8 THR CB C 33 69.975 69.975 69.614 0.361 17865
9304 1 15 . 1 1 8 8 THR H H 33 8.096 8.096 8.363 -0.267 17865
9305 1 15 . 1 1 9 9 GLN N N 34 122.411 122.411 124.566 -2.155 17865
9306 1 15 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.177 0.086 17865
9307 1 15 . 1 1 9 9 GLN C C 34 175.445 175.445 174.742 0.703 17865
9308 1 15 . 1 1 9 9 GLN CA C 34 55.763 55.763 56.936 -1.173 17865
9309 1 15 . 1 1 9 9 GLN CB C 34 29.691 29.691 28.436 1.254 17865
9310 1 15 . 1 1 9 9 GLN H H 34 8.278 8.278 8.740 -0.462 17865
9311 1 15 . 1 1 10 10 TYR N N 35 121.048 121.048 122.159 -1.111 17865
9312 1 15 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.840 -0.320 17865
9313 1 15 . 1 1 10 10 TYR C C 35 176.314 176.314 173.874 2.440 17865
9314 1 15 . 1 1 10 10 TYR CA C 35 57.972 57.972 56.365 1.607 17865
9315 1 15 . 1 1 10 10 TYR CB C 35 38.936 38.936 40.241 -1.305 17865
9316 1 15 . 1 1 10 10 TYR H H 35 8.227 8.227 7.705 0.522 17865
9317 1 15 . 1 1 11 11 GLY N N 36 109.711 109.711 107.929 1.782 17865
9318 1 15 . 1 1 11 11 GLY C C 36 174.128 174.128 172.168 1.960 17865
9319 1 15 . 1 1 11 11 GLY CA C 36 45.212 45.212 45.444 -0.232 17865
9320 1 15 . 1 1 11 11 GLY H H 36 8.247 8.247 8.033 0.214 17865
9321 1 15 . 1 1 12 12 TYR N N 37 120.302 120.302 120.006 0.296 17865
9322 1 15 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.805 -0.323 17865
9323 1 15 . 1 1 12 12 TYR C C 37 175.864 175.864 175.290 0.574 17865
9324 1 15 . 1 1 12 12 TYR CA C 37 58.541 58.541 58.350 0.191 17865
9325 1 15 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.985 -1.270 17865
9326 1 15 . 1 1 12 12 TYR H H 37 8.101 8.101 8.177 -0.076 17865
9327 1 15 . 1 1 13 13 ASP N N 38 121.883 121.883 120.036 1.847 17865
9328 1 15 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.863 -0.377 17865
9329 1 15 . 1 1 13 13 ASP C C 38 176.538 176.538 176.170 0.368 17865
9330 1 15 . 1 1 13 13 ASP CA C 38 54.223 54.223 53.429 0.794 17865
9331 1 15 . 1 1 13 13 ASP CB C 38 40.988 40.988 41.416 -0.429 17865
9332 1 15 . 1 1 13 13 ASP H H 38 8.266 8.266 8.751 -0.484 17865
9333 1 15 . 1 1 14 14 GLY N N 39 107.705 107.705 110.421 -2.716 17865
9334 1 15 . 1 1 14 14 GLY C C 39 173.822 173.822 173.707 0.115 17865
9335 1 15 . 1 1 14 14 GLY CA C 39 45.404 45.404 44.931 0.473 17865
9336 1 15 . 1 1 14 14 GLY H H 39 7.647 7.647 8.195 -0.548 17865
9337 1 15 . 1 1 15 15 LYS N N 40 121.621 121.621 123.831 -2.210 17865
9338 1 15 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.839 -0.264 17865
9339 1 15 . 1 1 15 15 LYS CA C 40 54.100 54.100 53.914 0.186 17865
9340 1 15 . 1 1 15 15 LYS CB C 40 32.510 32.510 32.272 0.238 17865
9341 1 15 . 1 1 15 15 LYS H H 40 7.908 7.908 8.330 -0.422 17865
9342 1 15 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.167 0.185 17865
9343 1 15 . 1 1 16 16 PRO C C 41 176.806 176.806 176.809 -0.003 17865
9344 1 15 . 1 1 16 16 PRO CA C 41 62.758 62.758 64.297 -1.539 17865
9345 1 15 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.220 0.094 17865
9346 1 15 . 1 1 17 17 LEU N N 42 123.488 123.488 119.415 4.073 17865
9347 1 15 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.363 -0.314 17865
9348 1 15 . 1 1 17 17 LEU C C 42 174.973 174.973 174.799 0.174 17865
9349 1 15 . 1 1 17 17 LEU CA C 42 55.436 55.436 54.458 0.978 17865
9350 1 15 . 1 1 17 17 LEU CB C 42 42.093 42.093 43.300 -1.207 17865
9351 1 15 . 1 1 17 17 LEU H H 42 8.499 8.499 7.438 1.061 17865
9352 1 15 . 1 1 18 18 ASP N N 43 123.354 123.354 123.117 0.237 17865
9353 1 15 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.737 -0.239 17865
9354 1 15 . 1 1 18 18 ASP C C 43 175.947 175.947 176.566 -0.619 17865
9355 1 15 . 1 1 18 18 ASP CA C 43 52.858 52.858 52.855 0.003 17865
9356 1 15 . 1 1 18 18 ASP CB C 43 42.221 42.221 43.889 -1.668 17865
9357 1 15 . 1 1 18 18 ASP H H 43 7.789 7.789 8.171 -0.382 17865
9358 1 15 . 1 1 19 19 ALA N N 44 120.147 120.147 122.791 -2.644 17865
9359 1 15 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.099 -0.113 17865
9360 1 15 . 1 1 19 19 ALA C C 44 179.476 179.476 178.786 0.690 17865
9361 1 15 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.550 0.613 17865
9362 1 15 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.805 -0.418 17865
9363 1 15 . 1 1 19 19 ALA H H 44 8.561 8.561 8.582 -0.021 17865
9364 1 15 . 1 1 20 20 SER N N 45 115.037 115.037 114.118 0.919 17865
9365 1 15 . 1 1 20 20 SER HA H 45 4.151 4.151 4.162 -0.011 17865
9366 1 15 . 1 1 20 20 SER C C 45 177.191 177.191 176.247 0.944 17865
9367 1 15 . 1 1 20 20 SER CA C 45 61.629 61.629 61.148 0.481 17865
9368 1 15 . 1 1 20 20 SER CB C 45 62.804 62.804 63.029 -0.225 17865
9369 1 15 . 1 1 20 20 SER H H 45 8.466 8.466 8.153 0.313 17865
9370 1 15 . 1 1 21 21 PHE N N 46 125.030 125.030 121.531 3.499 17865
9371 1 15 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.341 -0.110 17865
9372 1 15 . 1 1 21 21 PHE C C 46 176.850 176.850 177.294 -0.444 17865
9373 1 15 . 1 1 21 21 PHE CA C 46 60.806 60.806 61.407 -0.601 17865
9374 1 15 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.390 0.491 17865
9375 1 15 . 1 1 21 21 PHE H H 46 8.034 8.034 7.747 0.287 17865
9376 1 15 . 1 1 22 22 CYS N N 47 113.943 113.943 116.792 -2.849 17865
9377 1 15 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.229 0.022 17865
9378 1 15 . 1 1 22 22 CYS C C 47 176.449 176.449 176.423 0.026 17865
9379 1 15 . 1 1 22 22 CYS CA C 47 53.600 53.600 60.405 -6.805 17865
9380 1 15 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.679 10.712 17865
9381 1 15 . 1 1 22 22 CYS H H 47 7.691 7.691 8.705 -1.014 17865
9382 1 15 . 1 1 23 23 ARG N N 48 119.958 119.958 119.460 0.498 17865
9383 1 15 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.028 0.052 17865
9384 1 15 . 1 1 23 23 ARG C C 48 177.904 177.904 177.426 0.478 17865
9385 1 15 . 1 1 23 23 ARG CA C 48 58.907 58.907 59.171 -0.264 17865
9386 1 15 . 1 1 23 23 ARG CB C 48 30.171 30.171 30.204 -0.033 17865
9387 1 15 . 1 1 23 23 ARG H H 48 7.628 7.628 7.535 0.093 17865
9388 1 15 . 1 1 24 24 THR N N 49 106.445 106.445 111.803 -5.358 17865
9389 1 15 . 1 1 24 24 THR HA H 49 4.385 4.385 4.261 0.124 17865
9390 1 15 . 1 1 24 24 THR C C 49 174.758 174.758 174.610 0.148 17865
9391 1 15 . 1 1 24 24 THR CA C 49 61.573 61.573 62.919 -1.345 17865
9392 1 15 . 1 1 24 24 THR CB C 49 68.794 68.794 68.334 0.460 17865
9393 1 15 . 1 1 24 24 THR H H 49 7.307 7.307 7.481 -0.174 17865
9394 1 15 . 1 1 25 25 ALA N N 50 122.242 122.242 121.652 0.590 17865
9395 1 15 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.410 -0.006 17865
9396 1 15 . 1 1 25 25 ALA C C 50 178.554 178.554 177.806 0.748 17865
9397 1 15 . 1 1 25 25 ALA CA C 50 52.381 52.381 52.867 -0.486 17865
9398 1 15 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.820 -1.425 17865
9399 1 15 . 1 1 25 25 ALA H H 50 7.401 7.401 7.483 -0.082 17865
9400 1 15 . 1 1 26 26 GLY N N 51 110.604 110.604 107.104 3.500 17865
9401 1 15 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.008 1.014 17865
9402 1 15 . 1 1 26 26 GLY H H 51 8.285 8.285 7.691 0.594 17865
9403 1 15 . 1 1 27 27 SER HA H 52 4.382 4.382 4.232 0.150 17865
9404 1 15 . 1 1 27 27 SER C C 52 175.774 175.774 175.467 0.307 17865
9405 1 15 . 1 1 27 27 SER CA C 52 60.803 60.803 61.122 -0.319 17865
9406 1 15 . 1 1 27 27 SER CB C 52 62.827 62.827 63.193 -0.366 17865
9407 1 15 . 1 1 28 28 ARG N N 53 119.682 119.682 118.240 1.442 17865
9408 1 15 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.750 0.130 17865
9409 1 15 . 1 1 28 28 ARG C C 53 175.796 175.796 176.998 -1.202 17865
9410 1 15 . 1 1 28 28 ARG CA C 53 55.738 55.738 55.542 0.196 17865
9411 1 15 . 1 1 28 28 ARG CB C 53 30.237 30.237 30.155 0.082 17865
9412 1 15 . 1 1 28 28 ARG H H 53 7.894 7.894 7.979 -0.084 17865
9413 1 15 . 1 1 29 29 GLU N N 54 122.318 122.318 122.490 -0.172 17865
9414 1 15 . 1 1 29 29 GLU HA H 54 3.595 3.595 4.127 -0.532 17865
9415 1 15 . 1 1 29 29 GLU C C 54 177.523 177.523 177.645 -0.122 17865
9416 1 15 . 1 1 29 29 GLU CA C 54 61.223 61.223 60.239 0.984 17865
9417 1 15 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.690 -0.753 17865
9418 1 15 . 1 1 29 29 GLU H H 54 7.730 7.730 8.086 -0.356 17865
9419 1 15 . 1 1 30 30 LYS N N 55 118.377 118.377 117.604 0.773 17865
9420 1 15 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.017 -0.189 17865
9421 1 15 . 1 1 30 30 LYS C C 55 179.205 179.205 178.904 0.301 17865
9422 1 15 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.406 1.021 17865
9423 1 15 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.045 -0.444 17865
9424 1 15 . 1 1 30 30 LYS H H 55 8.659 8.659 8.393 0.266 17865
9425 1 15 . 1 1 31 31 ASP N N 56 121.614 121.614 118.682 2.932 17865
9426 1 15 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.562 -0.251 17865
9427 1 15 . 1 1 31 31 ASP C C 56 177.393 177.393 177.935 -0.542 17865
9428 1 15 . 1 1 31 31 ASP CA C 56 57.316 57.316 56.886 0.430 17865
9429 1 15 . 1 1 31 31 ASP CB C 56 40.423 40.423 41.121 -0.698 17865
9430 1 15 . 1 1 31 31 ASP H H 56 7.646 7.646 8.125 -0.479 17865
9431 1 15 . 1 1 32 32 CYS N N 57 120.345 120.345 119.685 0.660 17865
9432 1 15 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.974 -0.373 17865
9433 1 15 . 1 1 32 32 CYS C C 57 175.772 175.772 176.371 -0.599 17865
9434 1 15 . 1 1 32 32 CYS CA C 57 60.197 60.197 61.169 -0.973 17865
9435 1 15 . 1 1 32 32 CYS CB C 57 33.966 33.966 26.184 7.782 17865
9436 1 15 . 1 1 32 32 CYS H H 57 8.042 8.042 8.183 -0.141 17865
9437 1 15 . 1 1 33 33 ARG N N 58 120.293 120.293 119.034 1.259 17865
9438 1 15 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.925 -0.249 17865
9439 1 15 . 1 1 33 33 ARG C C 58 179.633 179.633 178.105 1.528 17865
9440 1 15 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.371 1.015 17865
9441 1 15 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.435 0.406 17865
9442 1 15 . 1 1 33 33 ARG H H 58 8.531 8.531 8.474 0.057 17865
9443 1 15 . 1 1 34 34 LYS N N 59 121.166 121.166 119.345 1.821 17865
9444 1 15 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.150 -0.114 17865
9445 1 15 . 1 1 34 34 LYS C C 59 179.220 179.220 178.308 0.912 17865
9446 1 15 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.495 1.035 17865
9447 1 15 . 1 1 34 34 LYS CB C 59 32.110 32.110 31.955 0.155 17865
9448 1 15 . 1 1 34 34 LYS H H 59 7.633 7.633 7.365 0.268 17865
9449 1 15 . 1 1 35 35 ASP N N 60 122.166 122.166 119.861 2.305 17865
9450 1 15 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.476 -0.045 17865
9451 1 15 . 1 1 35 35 ASP C C 60 179.709 179.709 178.535 1.174 17865
9452 1 15 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.030 0.673 17865
9453 1 15 . 1 1 35 35 ASP CB C 60 40.672 40.672 41.360 -0.688 17865
9454 1 15 . 1 1 35 35 ASP H H 60 8.221 8.221 7.769 0.452 17865
9455 1 15 . 1 1 36 36 VAL N N 61 121.312 121.312 119.354 1.958 17865
9456 1 15 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.579 -0.178 17865
9457 1 15 . 1 1 36 36 VAL C C 61 178.339 178.339 177.300 1.039 17865
9458 1 15 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.276 1.857 17865
9459 1 15 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.740 -0.083 17865
9460 1 15 . 1 1 36 36 VAL H H 61 8.916 8.916 8.296 0.620 17865
9461 1 15 . 1 1 37 37 GLN N N 62 119.166 119.166 116.786 2.380 17865
9462 1 15 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.108 -0.166 17865
9463 1 15 . 1 1 37 37 GLN C C 62 177.293 177.293 177.040 0.253 17865
9464 1 15 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.791 0.489 17865
9465 1 15 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.795 -0.424 17865
9466 1 15 . 1 1 37 37 GLN H H 62 7.697 7.697 7.454 0.243 17865
9467 1 15 . 1 1 38 38 ALA N N 63 118.964 118.964 120.476 -1.512 17865
9468 1 15 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.287 -0.045 17865
9469 1 15 . 1 1 38 38 ALA C C 63 177.221 177.221 177.411 -0.190 17865
9470 1 15 . 1 1 38 38 ALA CA C 63 53.137 53.137 52.518 0.619 17865
9471 1 15 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.089 -0.192 17865
9472 1 15 . 1 1 38 38 ALA H H 63 7.508 7.508 7.569 -0.061 17865
9473 1 15 . 1 1 39 39 CYS N N 64 119.081 119.081 118.083 0.998 17865
9474 1 15 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.592 0.361 17865
9475 1 15 . 1 1 39 39 CYS C C 64 172.052 172.052 175.400 -3.348 17865
9476 1 15 . 1 1 39 39 CYS CA C 64 51.880 51.880 59.200 -7.320 17865
9477 1 15 . 1 1 39 39 CYS CB C 64 34.328 34.328 28.535 5.793 17865
9478 1 15 . 1 1 39 39 CYS H H 64 7.354 7.354 7.604 -0.250 17865
9479 1 15 . 1 1 40 40 ASP N N 65 124.167 124.167 126.170 -2.003 17865
9480 1 15 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.471 -0.146 17865
9481 1 15 . 1 1 40 40 ASP C C 65 176.496 176.496 176.487 0.009 17865
9482 1 15 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.980 -0.256 17865
9483 1 15 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.407 -0.094 17865
9484 1 15 . 1 1 40 40 ASP H H 65 8.142 8.142 8.833 -0.691 17865
9485 1 15 . 1 1 41 41 LYS N N 66 118.844 118.844 119.612 -0.768 17865
9486 1 15 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.652 -0.128 17865
9487 1 15 . 1 1 41 41 LYS C C 66 175.586 175.586 175.809 -0.223 17865
9488 1 15 . 1 1 41 41 LYS CA C 66 55.275 55.275 55.620 -0.345 17865
9489 1 15 . 1 1 41 41 LYS CB C 66 32.598 32.598 34.393 -1.795 17865
9490 1 15 . 1 1 41 41 LYS H H 66 7.858 7.858 8.397 -0.539 17865
9491 1 15 . 1 1 42 42 LYS N N 67 126.081 126.081 122.551 3.530 17865
9492 1 15 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.358 -0.443 17865
9493 1 15 . 1 1 42 42 LYS C C 67 174.665 174.665 175.191 -0.526 17865
9494 1 15 . 1 1 42 42 LYS CA C 67 57.827 57.827 56.065 1.762 17865
9495 1 15 . 1 1 42 42 LYS CB C 67 34.059 34.059 33.065 0.994 17865
9496 1 15 . 1 1 42 42 LYS H H 67 8.790 8.790 8.812 -0.022 17865
9497 1 15 . 1 1 43 43 TYR N N 68 114.138 114.138 116.062 -1.924 17865
9498 1 15 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.864 0.395 17865
9499 1 15 . 1 1 43 43 TYR C C 68 175.767 175.767 174.845 0.922 17865
9500 1 15 . 1 1 43 43 TYR CA C 68 55.880 55.880 57.162 -1.282 17865
9501 1 15 . 1 1 43 43 TYR CB C 68 42.363 42.363 42.038 0.325 17865
9502 1 15 . 1 1 43 43 TYR H H 68 7.294 7.294 7.495 -0.201 17865
9503 1 15 . 1 1 44 44 ASP N N 69 121.807 121.807 122.692 -0.885 17865
9504 1 15 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.736 -0.096 17865
9505 1 15 . 1 1 44 44 ASP C C 69 177.812 177.812 177.266 0.546 17865
9506 1 15 . 1 1 44 44 ASP CA C 69 52.110 52.110 53.261 -1.151 17865
9507 1 15 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.906 -2.466 17865
9508 1 15 . 1 1 44 44 ASP H H 69 8.995 8.995 8.944 0.051 17865
9509 1 15 . 1 1 45 45 ASP N N 70 116.686 116.686 120.739 -4.053 17865
9510 1 15 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.519 -0.095 17865
9511 1 15 . 1 1 45 45 ASP C C 70 177.054 177.054 176.705 0.349 17865
9512 1 15 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.533 -0.152 17865
9513 1 15 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.701 -0.453 17865
9514 1 15 . 1 1 45 45 ASP H H 70 8.369 8.369 8.753 -0.384 17865
9515 1 15 . 1 1 46 46 GLN N N 71 117.949 117.949 117.358 0.591 17865
9516 1 15 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.472 -0.016 17865
9517 1 15 . 1 1 46 46 GLN C C 71 176.273 176.273 176.717 -0.444 17865
9518 1 15 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.117 0.250 17865
9519 1 15 . 1 1 46 46 GLN CB C 71 29.330 29.330 28.919 0.411 17865
9520 1 15 . 1 1 46 46 GLN H H 71 8.274 8.274 7.817 0.457 17865
9521 1 15 . 1 1 47 47 GLY N N 72 108.369 108.369 107.614 0.755 17865
9522 1 15 . 1 1 47 47 GLY C C 72 174.145 174.145 173.892 0.253 17865
9523 1 15 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.394 0.429 17865
9524 1 15 . 1 1 47 47 GLY H H 72 8.174 8.174 8.066 0.108 17865
9525 1 15 . 1 1 48 48 ARG N N 73 121.554 121.554 118.741 2.813 17865
9526 1 15 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.716 -0.231 17865
9527 1 15 . 1 1 48 48 ARG C C 73 176.855 176.855 175.481 1.374 17865
9528 1 15 . 1 1 48 48 ARG CA C 73 55.289 55.289 53.658 1.631 17865
9529 1 15 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.627 -1.069 17865
9530 1 15 . 1 1 48 48 ARG H H 73 8.462 8.462 7.912 0.550 17865
9531 1 15 . 1 1 49 49 GLU N N 74 122.784 122.784 121.324 1.460 17865
9532 1 15 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.065 0.418 17865
9533 1 15 . 1 1 49 49 GLU C C 74 178.098 178.098 176.721 1.377 17865
9534 1 15 . 1 1 49 49 GLU CA C 74 57.184 57.184 57.063 0.121 17865
9535 1 15 . 1 1 49 49 GLU CB C 74 30.777 30.777 30.021 0.756 17865
9536 1 15 . 1 1 49 49 GLU H H 74 8.703 8.703 8.604 0.099 17865
9537 1 15 . 1 1 50 50 THR N N 75 114.563 114.563 114.307 0.256 17865
9538 1 15 . 1 1 50 50 THR HA H 75 4.212 4.212 4.415 -0.203 17865
9539 1 15 . 1 1 50 50 THR C C 75 175.170 175.170 175.504 -0.334 17865
9540 1 15 . 1 1 50 50 THR CA C 75 60.589 60.589 60.809 -0.220 17865
9541 1 15 . 1 1 50 50 THR CB C 75 70.952 70.952 70.920 0.032 17865
9542 1 15 . 1 1 50 50 THR H H 75 7.717 7.717 8.062 -0.345 17865
9543 1 15 . 1 1 51 51 ALA N N 76 122.097 122.097 122.859 -0.762 17865
9544 1 15 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.004 0.034 17865
9545 1 15 . 1 1 51 51 ALA C C 76 181.906 181.906 179.029 2.877 17865
9546 1 15 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.104 0.550 17865
9547 1 15 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.218 -0.225 17865
9548 1 15 . 1 1 51 51 ALA H H 76 8.734 8.734 8.739 -0.005 17865
9549 1 15 . 1 1 52 52 CYS N N 77 115.347 115.347 117.000 -1.653 17865
9550 1 15 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.241 0.239 17865
9551 1 15 . 1 1 52 52 CYS C C 77 176.299 176.299 176.743 -0.444 17865
9552 1 15 . 1 1 52 52 CYS CA C 77 57.701 57.701 60.152 -2.451 17865
9553 1 15 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.691 9.940 17865
9554 1 15 . 1 1 52 52 CYS H H 77 9.073 9.073 7.993 1.080 17865
9555 1 15 . 1 1 53 53 ALA N N 78 128.517 128.517 122.911 5.606 17865
9556 1 15 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.834 0.021 17865
9557 1 15 . 1 1 53 53 ALA C C 78 178.736 178.736 179.377 -0.641 17865
9558 1 15 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.254 0.379 17865
9559 1 15 . 1 1 53 53 ALA CB C 78 19.191 19.191 18.217 0.974 17865
9560 1 15 . 1 1 53 53 ALA H H 78 7.174 7.174 8.210 -1.036 17865
9561 1 15 . 1 1 54 54 LYS N N 79 118.706 118.706 115.854 2.852 17865
9562 1 15 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.223 -0.420 17865
9563 1 15 . 1 1 54 54 LYS C C 79 179.611 179.611 178.753 0.858 17865
9564 1 15 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.319 1.406 17865
9565 1 15 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.137 0.516 17865
9566 1 15 . 1 1 54 54 LYS H H 79 8.313 8.313 7.768 0.545 17865
9567 1 15 . 1 1 55 55 GLY N N 80 104.822 104.822 108.925 -4.103 17865
9568 1 15 . 1 1 55 55 GLY C C 80 176.504 176.504 175.891 0.613 17865
9569 1 15 . 1 1 55 55 GLY CA C 80 46.839 46.839 46.659 0.180 17865
9570 1 15 . 1 1 55 55 GLY H H 80 8.175 8.175 7.648 0.527 17865
9571 1 15 . 1 1 56 56 ILE N N 81 123.697 123.697 123.071 0.626 17865
9572 1 15 . 1 1 56 56 ILE HA H 81 3.795 3.795 4.150 -0.355 17865
9573 1 15 . 1 1 56 56 ILE C C 81 177.334 177.334 177.919 -0.585 17865
9574 1 15 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.934 0.347 17865
9575 1 15 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.995 0.340 17865
9576 1 15 . 1 1 56 56 ILE H H 81 7.590 7.590 7.917 -0.327 17865
9577 1 15 . 1 1 57 57 ARG N N 82 118.161 118.161 119.349 -1.188 17865
9578 1 15 . 1 1 57 57 ARG HA H 82 3.935 3.935 3.942 -0.007 17865
9579 1 15 . 1 1 57 57 ARG C C 82 178.662 178.662 178.910 -0.248 17865
9580 1 15 . 1 1 57 57 ARG CA C 82 59.702 59.702 60.105 -0.403 17865
9581 1 15 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.888 0.011 17865
9582 1 15 . 1 1 57 57 ARG H H 82 7.569 7.569 7.988 -0.419 17865
9583 1 15 . 1 1 58 58 GLU N N 83 115.085 115.085 118.576 -3.491 17865
9584 1 15 . 1 1 58 58 GLU HA H 83 4.031 4.031 3.999 0.032 17865
9585 1 15 . 1 1 58 58 GLU C C 83 178.224 178.224 178.626 -0.402 17865
9586 1 15 . 1 1 58 58 GLU CA C 83 58.304 58.304 59.209 -0.905 17865
9587 1 15 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.052 0.979 17865
9588 1 15 . 1 1 58 58 GLU H H 83 7.786 7.786 8.481 -0.695 17865
9589 1 15 . 1 1 59 59 LYS N N 84 119.183 119.183 120.122 -0.939 17865
9590 1 15 . 1 1 59 59 LYS HA H 84 3.830 3.830 4.103 -0.273 17865
9591 1 15 . 1 1 59 59 LYS C C 84 177.933 177.933 178.686 -0.753 17865
9592 1 15 . 1 1 59 59 LYS CA C 84 59.043 59.043 58.075 0.968 17865
9593 1 15 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.712 0.938 17865
9594 1 15 . 1 1 59 59 LYS H H 84 7.968 7.968 7.477 0.491 17865
9595 1 15 . 1 1 60 60 TYR N N 85 113.663 113.663 118.190 -4.527 17865
9596 1 15 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.490 0.213 17865
9597 1 15 . 1 1 60 60 TYR C C 85 174.729 174.729 175.124 -0.395 17865
9598 1 15 . 1 1 60 60 TYR CA C 85 57.202 57.202 57.920 -0.718 17865
9599 1 15 . 1 1 60 60 TYR CB C 85 37.902 37.902 36.537 1.365 17865
9600 1 15 . 1 1 60 60 TYR H H 85 7.562 7.562 8.064 -0.502 17865
9601 1 15 . 1 1 61 61 LYS N N 86 121.862 121.862 122.615 -0.753 17865
9602 1 15 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.398 0.114 17865
9603 1 15 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.287 -0.345 17865
9604 1 15 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.497 -0.395 17865
9605 1 15 . 1 1 61 61 LYS H H 86 7.222 7.222 7.330 -0.108 17865
9606 1 15 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.258 0.065 17865
9607 1 15 . 1 1 62 62 PRO C C 87 176.576 176.576 176.385 0.191 17865
9608 1 15 . 1 1 62 62 PRO CA C 87 63.020 63.020 64.946 -1.926 17865
9609 1 15 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.203 0.037 17865
9610 1 15 . 1 1 63 63 ALA N N 88 125.029 125.029 121.916 3.113 17865
9611 1 15 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.523 -0.269 17865
9612 1 15 . 1 1 63 63 ALA C C 88 177.301 177.301 175.808 1.493 17865
9613 1 15 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.140 0.141 17865
9614 1 15 . 1 1 63 63 ALA CB C 88 19.202 19.202 19.185 0.017 17865
9615 1 15 . 1 1 63 63 ALA H H 88 8.329 8.329 8.034 0.295 17865
9616 1 15 . 1 1 64 64 VAL N N 89 121.843 121.843 120.029 1.814 17865
9617 1 15 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.541 -0.597 17865
9618 1 15 . 1 1 64 64 VAL C C 89 174.791 174.791 174.421 0.370 17865
9619 1 15 . 1 1 64 64 VAL CA C 89 61.981 61.981 61.167 0.814 17865
9620 1 15 . 1 1 64 64 VAL CB C 89 33.485 33.485 33.856 -0.371 17865
9621 1 15 . 1 1 64 64 VAL H H 89 8.075 8.075 7.959 0.116 17865
9622 1 15 . 1 1 65 65 VAL N N 90 125.399 125.399 122.242 3.157 17865
9623 1 15 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.490 -0.352 17865
9624 1 15 . 1 1 65 65 VAL C C 90 174.340 174.340 174.310 0.030 17865
9625 1 15 . 1 1 65 65 VAL CA C 90 61.162 61.162 62.163 -1.001 17865
9626 1 15 . 1 1 65 65 VAL CB C 90 33.866 33.866 32.445 1.421 17865
9627 1 15 . 1 1 65 65 VAL H H 90 8.229 8.229 8.374 -0.145 17865
9628 1 15 . 1 1 66 66 TYR N N 91 124.848 124.848 125.709 -0.861 17865
9629 1 15 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.703 0.068 17865
9630 1 15 . 1 1 66 66 TYR C C 91 176.658 176.658 175.350 1.308 17865
9631 1 15 . 1 1 66 66 TYR CA C 91 58.084 58.084 57.178 0.906 17865
9632 1 15 . 1 1 66 66 TYR CB C 91 41.535 41.535 42.321 -0.786 17865
9633 1 15 . 1 1 66 66 TYR H H 91 9.145 9.145 8.459 0.686 17865
9634 1 15 . 1 1 67 67 GLY N N 92 106.185 106.185 106.718 -0.533 17865
9635 1 15 . 1 1 67 67 GLY C C 92 175.681 175.681 174.420 1.261 17865
9636 1 15 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.545 0.430 17865
9637 1 15 . 1 1 67 67 GLY H H 92 8.730 8.730 9.075 -0.345 17865
9638 1 15 . 1 1 68 68 TYR N N 93 121.815 121.815 118.344 3.471 17865
9639 1 15 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.347 -0.372 17865
9640 1 15 . 1 1 68 68 TYR C C 93 176.035 176.035 175.900 0.135 17865
9641 1 15 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.161 1.885 17865
9642 1 15 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.248 0.177 17865
9643 1 15 . 1 1 68 68 TYR H H 93 8.711 8.711 8.344 0.367 17865
9644 1 15 . 1 1 69 69 ASP N N 94 115.507 115.507 119.092 -3.585 17865
9645 1 15 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.402 -0.114 17865
9646 1 15 . 1 1 69 69 ASP C C 94 177.063 177.063 176.884 0.179 17865
9647 1 15 . 1 1 69 69 ASP CA C 94 53.011 53.011 52.812 0.199 17865
9648 1 15 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.192 -0.025 17865
9649 1 15 . 1 1 69 69 ASP H H 94 8.010 8.010 7.465 0.545 17865
9650 1 15 . 1 1 70 70 GLY N N 95 107.196 107.196 108.916 -1.720 17865
9651 1 15 . 1 1 70 70 GLY C C 95 173.936 173.936 173.828 0.108 17865
9652 1 15 . 1 1 70 70 GLY CA C 95 45.392 45.392 45.661 -0.269 17865
9653 1 15 . 1 1 70 70 GLY H H 95 7.986 7.986 7.718 0.268 17865
9654 1 15 . 1 1 71 71 LYS N N 96 121.258 121.258 117.575 3.683 17865
9655 1 15 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.884 -0.100 17865
9656 1 15 . 1 1 71 71 LYS CA C 96 54.114 54.114 53.300 0.814 17865
9657 1 15 . 1 1 71 71 LYS CB C 96 31.762 31.762 33.547 -1.784 17865
9658 1 15 . 1 1 71 71 LYS H H 96 7.877 7.877 7.332 0.545 17865
9659 1 15 . 1 1 72 72 PRO C C 97 177.170 177.170 175.711 1.459 17865
9660 1 15 . 1 1 72 72 PRO CA C 97 63.137 63.137 63.418 -0.281 17865
9661 1 15 . 1 1 72 72 PRO CB C 97 32.240 32.240 31.051 1.189 17865
9662 1 15 . 1 1 73 73 LEU N N 98 123.503 123.503 126.349 -2.846 17865
9663 1 15 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.577 -0.217 17865
9664 1 15 . 1 1 73 73 LEU C C 98 176.354 176.354 175.295 1.059 17865
9665 1 15 . 1 1 73 73 LEU CA C 98 53.927 53.927 54.546 -0.619 17865
9666 1 15 . 1 1 73 73 LEU CB C 98 42.272 42.272 45.866 -3.594 17865
9667 1 15 . 1 1 73 73 LEU H H 98 8.850 8.850 8.100 0.750 17865
9668 1 15 . 1 1 74 74 ASP N N 99 122.212 122.212 127.223 -5.011 17865
9669 1 15 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.728 -0.131 17865
9670 1 15 . 1 1 74 74 ASP C C 99 175.819 175.819 176.326 -0.507 17865
9671 1 15 . 1 1 74 74 ASP CA C 99 53.856 53.856 55.075 -1.219 17865
9672 1 15 . 1 1 74 74 ASP CB C 99 40.989 40.989 41.659 -0.670 17865
9673 1 15 . 1 1 74 74 ASP H H 99 8.517 8.517 8.550 -0.033 17865
9674 1 15 . 1 1 75 75 LEU N N 100 125.874 125.874 117.849 8.025 17865
9675 1 15 . 1 1 75 75 LEU HA H 100 4.366 4.366 3.991 0.375 17865
9676 1 15 . 1 1 75 75 LEU C C 100 178.426 178.426 177.743 0.683 17865
9677 1 15 . 1 1 75 75 LEU CA C 100 53.631 53.631 55.291 -1.660 17865
9678 1 15 . 1 1 75 75 LEU CB C 100 40.676 40.676 40.015 0.661 17865
9679 1 15 . 1 1 75 75 LEU H H 100 8.281 8.281 8.729 -0.448 17865
9680 1 15 . 1 1 76 76 GLY N N 101 110.604 110.604 108.080 2.524 17865
9681 1 15 . 1 1 76 76 GLY C C 101 176.936 176.936 175.414 1.522 17865
9682 1 15 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.344 0.482 17865
9683 1 15 . 1 1 76 76 GLY H H 101 8.914 8.914 7.948 0.966 17865
9684 1 15 . 1 1 77 77 PHE N N 102 117.639 117.639 116.331 1.308 17865
9685 1 15 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.808 -0.427 17865
9686 1 15 . 1 1 77 77 PHE C C 102 177.878 177.878 175.242 2.636 17865
9687 1 15 . 1 1 77 77 PHE CA C 102 59.139 59.139 56.927 2.212 17865
9688 1 15 . 1 1 77 77 PHE CB C 102 36.935 36.935 37.721 -0.786 17865
9689 1 15 . 1 1 77 77 PHE H H 102 7.992 7.992 7.858 0.134 17865
9690 1 15 . 1 1 78 78 CYS N N 103 121.136 121.136 118.130 3.006 17865
9691 1 15 . 1 1 78 78 CYS HA H 103 4.385 4.385 5.082 -0.697 17865
9692 1 15 . 1 1 78 78 CYS C C 103 172.780 172.780 176.826 -4.046 17865
9693 1 15 . 1 1 78 78 CYS CA C 103 53.696 53.696 58.178 -4.482 17865
9694 1 15 . 1 1 78 78 CYS CB C 103 34.237 34.237 28.902 5.335 17865
9695 1 15 . 1 1 78 78 CYS H H 103 7.362 7.362 8.261 -0.899 17865
9696 1 15 . 1 1 79 79 THR N N 104 114.773 114.773 117.805 -3.032 17865
9697 1 15 . 1 1 79 79 THR HA H 104 3.984 3.984 4.062 -0.078 17865
9698 1 15 . 1 1 79 79 THR C C 104 176.624 176.624 175.938 0.686 17865
9699 1 15 . 1 1 79 79 THR CA C 104 65.180 65.180 65.283 -0.103 17865
9700 1 15 . 1 1 79 79 THR CB C 104 69.062 69.062 68.540 0.522 17865
9701 1 15 . 1 1 79 79 THR H H 104 7.864 7.864 8.507 -0.643 17865
9702 1 15 . 1 1 80 80 LEU N N 105 119.785 119.785 115.388 4.397 17865
9703 1 15 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.504 -0.173 17865
9704 1 15 . 1 1 80 80 LEU C C 105 177.208 177.208 176.248 0.960 17865
9705 1 15 . 1 1 80 80 LEU CA C 105 55.453 55.453 54.693 0.760 17865
9706 1 15 . 1 1 80 80 LEU CB C 105 41.293 41.293 39.917 1.376 17865
9707 1 15 . 1 1 80 80 LEU H H 105 7.238 7.238 7.911 -0.673 17865
9708 1 15 . 1 1 81 81 ALA N N 106 119.309 119.309 123.644 -4.335 17865
9709 1 15 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.564 -0.037 17865
9710 1 15 . 1 1 81 81 ALA C C 106 178.769 178.769 177.312 1.457 17865
9711 1 15 . 1 1 81 81 ALA CA C 106 52.049 52.049 51.603 0.446 17865
9712 1 15 . 1 1 81 81 ALA CB C 106 18.820 18.820 20.431 -1.611 17865
9713 1 15 . 1 1 81 81 ALA H H 106 7.432 7.432 7.695 -0.263 17865
9714 1 15 . 1 1 82 82 GLY N N 107 109.793 109.793 106.607 3.186 17865
9715 1 15 . 1 1 82 82 GLY CA C 107 47.119 47.119 44.040 3.079 17865
9716 1 15 . 1 1 82 82 GLY H H 107 7.918 7.918 8.131 -0.213 17865
9717 1 15 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.836 0.430 17865
9718 1 15 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.775 -0.512 17865
9719 1 15 . 1 1 83 83 ILE CB C 108 38.261 38.261 38.312 -0.051 17865
9720 1 15 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.033 0.722 17865
9721 1 15 . 1 1 84 84 ARG C C 109 181.344 181.344 177.703 3.641 17865
9722 1 15 . 1 1 84 84 ARG CA C 109 55.939 55.939 58.361 -2.422 17865
9723 1 15 . 1 1 84 84 ARG CB C 109 30.283 30.283 29.112 1.171 17865
9724 1 15 . 1 1 85 85 GLU N N 110 122.944 122.944 120.877 2.067 17865
9725 1 15 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.199 -0.582 17865
9726 1 15 . 1 1 85 85 GLU C C 110 177.797 177.797 178.371 -0.574 17865
9727 1 15 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.107 1.621 17865
9728 1 15 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.072 -0.201 17865
9729 1 15 . 1 1 85 85 GLU H H 110 8.003 8.003 8.230 -0.227 17865
9730 1 15 . 1 1 86 86 VAL N N 111 117.101 117.101 120.273 -3.172 17865
9731 1 15 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.639 -0.128 17865
9732 1 15 . 1 1 86 86 VAL C C 111 177.710 177.710 177.973 -0.263 17865
9733 1 15 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.338 0.092 17865
9734 1 15 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.444 -0.231 17865
9735 1 15 . 1 1 86 86 VAL H H 111 8.106 8.106 7.911 0.195 17865
9736 1 15 . 1 1 87 87 ASP N N 112 122.242 122.242 119.113 3.129 17865
9737 1 15 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.384 -0.080 17865
9738 1 15 . 1 1 87 87 ASP C C 112 176.912 176.912 177.852 -0.940 17865
9739 1 15 . 1 1 87 87 ASP CA C 112 57.417 57.417 57.579 -0.162 17865
9740 1 15 . 1 1 87 87 ASP CB C 112 40.476 40.476 40.948 -0.472 17865
9741 1 15 . 1 1 87 87 ASP H H 112 7.401 7.401 7.906 -0.505 17865
9742 1 15 . 1 1 88 88 CYS N N 113 120.819 120.819 119.268 1.551 17865
9743 1 15 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.112 -0.803 17865
9744 1 15 . 1 1 88 88 CYS C C 113 175.270 175.270 176.576 -1.306 17865
9745 1 15 . 1 1 88 88 CYS CA C 113 59.759 59.759 61.617 -1.858 17865
9746 1 15 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.647 7.188 17865
9747 1 15 . 1 1 88 88 CYS H H 113 7.785 7.785 8.234 -0.449 17865
9748 1 15 . 1 1 89 89 ARG N N 114 118.654 118.654 119.773 -1.119 17865
9749 1 15 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.054 -0.413 17865
9750 1 15 . 1 1 89 89 ARG C C 114 179.018 179.018 178.031 0.987 17865
9751 1 15 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.236 0.957 17865
9752 1 15 . 1 1 89 89 ARG CB C 114 29.713 29.713 30.101 -0.388 17865
9753 1 15 . 1 1 89 89 ARG H H 114 8.142 8.142 7.703 0.439 17865
9754 1 15 . 1 1 90 90 LYS N N 115 120.964 120.964 117.213 3.751 17865
9755 1 15 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.175 -0.145 17865
9756 1 15 . 1 1 90 90 LYS C C 115 180.092 180.092 178.814 1.278 17865
9757 1 15 . 1 1 90 90 LYS CA C 115 59.568 59.568 58.832 0.736 17865
9758 1 15 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.461 -0.240 17865
9759 1 15 . 1 1 90 90 LYS H H 115 7.936 7.936 7.666 0.270 17865
9760 1 15 . 1 1 91 91 ASP N N 116 121.690 121.690 119.278 2.412 17865
9761 1 15 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.615 -0.102 17865
9762 1 15 . 1 1 91 91 ASP C C 116 179.419 179.419 177.748 1.671 17865
9763 1 15 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.635 0.602 17865
9764 1 15 . 1 1 91 91 ASP CB C 116 40.648 40.648 40.816 -0.168 17865
9765 1 15 . 1 1 91 91 ASP H H 116 8.558 8.558 7.565 0.993 17865
9766 1 15 . 1 1 92 92 ALA N N 117 122.784 122.784 123.509 -0.725 17865
9767 1 15 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.039 -0.016 17865
9768 1 15 . 1 1 92 92 ALA C C 117 178.789 178.789 179.306 -0.517 17865
9769 1 15 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.214 -0.163 17865
9770 1 15 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.385 0.790 17865
9771 1 15 . 1 1 92 92 ALA H H 117 8.703 8.703 7.689 1.014 17865
9772 1 15 . 1 1 93 93 GLN N N 118 115.510 115.510 117.275 -1.765 17865
9773 1 15 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.108 -0.164 17865
9774 1 15 . 1 1 93 93 GLN C C 118 178.745 178.745 178.178 0.567 17865
9775 1 15 . 1 1 93 93 GLN CA C 118 58.482 58.482 58.222 0.260 17865
9776 1 15 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.228 0.169 17865
9777 1 15 . 1 1 93 93 GLN H H 118 7.664 7.664 8.631 -0.967 17865
9778 1 15 . 1 1 94 94 THR N N 119 110.110 110.110 115.110 -5.000 17865
9779 1 15 . 1 1 94 94 THR HA H 119 4.237 4.237 4.140 0.097 17865
9780 1 15 . 1 1 94 94 THR C C 119 175.861 175.861 174.847 1.014 17865
9781 1 15 . 1 1 94 94 THR CA C 119 64.604 64.604 65.171 -0.567 17865
9782 1 15 . 1 1 94 94 THR CB C 119 69.716 69.716 68.926 0.790 17865
9783 1 15 . 1 1 94 94 THR H H 119 7.726 7.726 7.613 0.113 17865
9784 1 15 . 1 1 95 95 CYS N N 120 118.523 118.523 120.364 -1.841 17865
9785 1 15 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.655 0.078 17865
9786 1 15 . 1 1 95 95 CYS C C 120 175.165 175.165 175.943 -0.778 17865
9787 1 15 . 1 1 95 95 CYS CA C 120 52.973 52.973 57.541 -4.568 17865
9788 1 15 . 1 1 95 95 CYS CB C 120 36.731 36.731 25.559 11.172 17865
9789 1 15 . 1 1 95 95 CYS H H 120 7.756 7.756 7.986 -0.230 17865
9790 1 15 . 1 1 96 96 ASP N N 121 119.081 119.081 124.767 -5.686 17865
9791 1 15 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.408 0.270 17865
9792 1 15 . 1 1 96 96 ASP CA C 121 56.224 56.224 56.889 -0.665 17865
9793 1 15 . 1 1 96 96 ASP CB C 121 42.731 42.731 40.789 1.942 17865
9794 1 15 . 1 1 96 96 ASP H H 121 7.354 7.354 8.229 -0.875 17865
9795 1 15 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.454 -0.879 17865
9796 1 15 . 1 1 97 97 LYS C C 122 175.510 175.510 177.514 -2.004 17865
9797 1 15 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.199 0.640 17865
9798 1 15 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.311 -3.561 17865
9799 1 15 . 1 1 98 98 LYS N N 123 119.980 119.980 117.606 2.374 17865
9800 1 15 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.437 -0.143 17865
9801 1 15 . 1 1 98 98 LYS C C 123 176.968 176.968 177.793 -0.825 17865
9802 1 15 . 1 1 98 98 LYS CA C 123 55.904 55.904 56.324 -0.420 17865
9803 1 15 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.021 0.211 17865
9804 1 15 . 1 1 98 98 LYS H H 123 7.799 7.799 8.122 -0.323 17865
9805 1 15 . 1 1 99 99 TYR N N 124 122.378 122.378 119.647 2.731 17865
9806 1 15 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.154 -0.259 17865
9807 1 15 . 1 1 99 99 TYR C C 124 177.126 177.126 178.154 -1.028 17865
9808 1 15 . 1 1 99 99 TYR CA C 124 60.211 60.211 61.180 -0.969 17865
9809 1 15 . 1 1 99 99 TYR CB C 124 38.271 38.271 37.985 0.286 17865
9810 1 15 . 1 1 99 99 TYR H H 124 8.536 8.536 8.044 0.492 17865
9811 1 15 . 1 1 100 100 GLU N N 125 118.610 118.610 116.258 2.352 17865
9812 1 15 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.481 -0.213 17865
9813 1 15 . 1 1 100 100 GLU C C 125 177.387 177.387 178.180 -0.793 17865
9814 1 15 . 1 1 100 100 GLU CA C 125 55.759 55.759 56.843 -1.085 17865
9815 1 15 . 1 1 100 100 GLU CB C 125 27.321 27.321 29.206 -1.885 17865
9816 1 15 . 1 1 100 100 GLU H H 125 8.385 8.385 8.570 -0.185 17865
9817 1 15 . 1 1 101 101 SER N N 126 115.949 115.949 117.487 -1.538 17865
9818 1 15 . 1 1 101 101 SER HA H 126 3.959 3.959 4.250 -0.291 17865
9819 1 15 . 1 1 101 101 SER C C 126 176.047 176.047 176.299 -0.252 17865
9820 1 15 . 1 1 101 101 SER CA C 126 62.439 62.439 62.509 -0.070 17865
9821 1 15 . 1 1 101 101 SER CB C 126 63.299 63.299 63.099 0.200 17865
9822 1 15 . 1 1 101 101 SER H H 126 7.823 7.823 7.842 -0.019 17865
9823 1 15 . 1 1 102 102 ASP N N 127 120.920 120.920 120.602 0.318 17865
9824 1 15 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.299 0.108 17865
9825 1 15 . 1 1 102 102 ASP C C 127 178.234 178.234 178.099 0.135 17865
9826 1 15 . 1 1 102 102 ASP CA C 127 57.411 57.411 58.121 -0.710 17865
9827 1 15 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.448 -0.732 17865
9828 1 15 . 1 1 102 102 ASP H H 127 8.683 8.683 7.742 0.941 17865
9829 1 15 . 1 1 103 103 LYS N N 128 121.753 121.753 119.059 2.694 17865
9830 1 15 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.207 -0.203 17865
9831 1 15 . 1 1 103 103 LYS C C 128 179.395 179.395 178.722 0.673 17865
9832 1 15 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.400 1.071 17865
9833 1 15 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.878 0.523 17865
9834 1 15 . 1 1 103 103 LYS H H 128 7.771 7.771 7.995 -0.224 17865
9835 1 15 . 1 1 104 104 CYS N N 129 120.109 120.109 120.598 -0.489 17865
9836 1 15 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.223 -0.029 17865
9837 1 15 . 1 1 104 104 CYS C C 129 176.779 176.779 176.623 0.156 17865
9838 1 15 . 1 1 104 104 CYS CA C 129 59.790 59.790 62.100 -2.310 17865
9839 1 15 . 1 1 104 104 CYS CB C 129 36.879 36.879 25.824 11.055 17865
9840 1 15 . 1 1 104 104 CYS H H 129 7.973 7.973 8.647 -0.674 17865
9841 1 15 . 1 1 105 105 LEU N N 130 121.804 121.804 121.851 -0.047 17865
9842 1 15 . 1 1 105 105 LEU HA H 130 4.090 4.090 4.005 0.085 17865
9843 1 15 . 1 1 105 105 LEU C C 130 179.373 179.373 178.597 0.776 17865
9844 1 15 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.282 -0.914 17865
9845 1 15 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.944 0.153 17865
9846 1 15 . 1 1 105 105 LEU H H 130 8.666 8.666 8.639 0.027 17865
9847 1 15 . 1 1 106 106 ASN N N 131 118.535 118.535 116.907 1.628 17865
9848 1 15 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.427 -0.189 17865
9849 1 15 . 1 1 106 106 ASN C C 131 177.830 177.830 177.545 0.285 17865
9850 1 15 . 1 1 106 106 ASN CA C 131 56.256 56.256 55.959 0.297 17865
9851 1 15 . 1 1 106 106 ASN CB C 131 37.817 37.817 37.814 0.003 17865
9852 1 15 . 1 1 106 106 ASN H H 131 8.438 8.438 7.825 0.613 17865
9853 1 15 . 1 1 107 107 ALA N N 132 121.485 121.485 123.648 -2.163 17865
9854 1 15 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.198 0.021 17865
9855 1 15 . 1 1 107 107 ALA C C 132 180.726 180.726 179.515 1.211 17865
9856 1 15 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.711 0.252 17865
9857 1 15 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.815 -0.994 17865
9858 1 15 . 1 1 107 107 ALA H H 132 7.541 7.541 7.081 0.460 17865
9859 1 15 . 1 1 108 108 ILE N N 133 120.979 120.979 118.514 2.465 17865
9860 1 15 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.612 0.319 17865
9861 1 15 . 1 1 108 108 ILE C C 133 178.114 178.114 178.444 -0.330 17865
9862 1 15 . 1 1 108 108 ILE CA C 133 63.353 63.353 63.900 -0.547 17865
9863 1 15 . 1 1 108 108 ILE CB C 133 36.454 36.454 36.628 -0.174 17865
9864 1 15 . 1 1 108 108 ILE H H 133 7.551 7.551 8.728 -1.177 17865
9865 1 15 . 1 1 109 109 LYS N N 134 121.415 121.415 118.334 3.081 17865
9866 1 15 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.184 -0.596 17865
9867 1 15 . 1 1 109 109 LYS C C 134 179.561 179.561 179.186 0.375 17865
9868 1 15 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.472 0.636 17865
9869 1 15 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.270 -0.109 17865
9870 1 15 . 1 1 109 109 LYS H H 134 8.414 8.414 7.793 0.621 17865
9871 1 15 . 1 1 110 110 GLU N N 135 116.099 116.099 119.314 -3.215 17865
9872 1 15 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.205 -0.276 17865
9873 1 15 . 1 1 110 110 GLU C C 135 178.239 178.239 179.052 -0.813 17865
9874 1 15 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.561 0.085 17865
9875 1 15 . 1 1 110 110 GLU CB C 135 29.638 29.638 28.981 0.657 17865
9876 1 15 . 1 1 110 110 GLU H H 135 7.473 7.473 7.930 -0.457 17865
9877 1 15 . 1 1 111 111 LYS N N 136 119.805 119.805 120.473 -0.668 17865
9878 1 15 . 1 1 111 111 LYS HA H 136 3.906 3.906 3.977 -0.071 17865
9879 1 15 . 1 1 111 111 LYS C C 136 177.600 177.600 177.763 -0.163 17865
9880 1 15 . 1 1 111 111 LYS CA C 136 58.749 58.749 58.011 0.738 17865
9881 1 15 . 1 1 111 111 LYS CB C 136 33.238 33.238 31.971 1.267 17865
9882 1 15 . 1 1 111 111 LYS H H 136 7.540 7.540 8.193 -0.652 17865
9883 1 15 . 1 1 112 112 TYR N N 137 114.768 114.768 117.599 -2.831 17865
9884 1 15 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.629 -0.106 17865
9885 1 15 . 1 1 112 112 TYR C C 137 174.690 174.690 174.921 -0.231 17865
9886 1 15 . 1 1 112 112 TYR CA C 137 58.359 58.359 56.133 2.225 17865
9887 1 15 . 1 1 112 112 TYR CB C 137 38.328 38.328 38.005 0.323 17865
9888 1 15 . 1 1 112 112 TYR H H 137 7.488 7.488 7.476 0.012 17865
9889 1 15 . 1 1 113 113 LYS N N 138 123.694 123.694 121.827 1.867 17865
9890 1 15 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.604 -0.103 17865
9891 1 15 . 1 1 113 113 LYS CA C 138 55.282 55.282 54.309 0.973 17865
9892 1 15 . 1 1 113 113 LYS CB C 138 32.124 32.124 31.992 0.132 17865
9893 1 15 . 1 1 113 113 LYS H H 138 7.217 7.217 7.507 -0.290 17865
9894 1 15 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.397 0.055 17865
9895 1 15 . 1 1 114 114 PRO C C 139 176.974 176.974 176.572 0.402 17865
9896 1 15 . 1 1 114 114 PRO CA C 139 63.189 63.189 63.295 -0.106 17865
9897 1 15 . 1 1 114 114 PRO CB C 139 32.251 32.251 30.776 1.475 17865
9898 1 15 . 1 1 115 115 VAL N N 140 121.098 121.098 119.795 1.303 17865
9899 1 15 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.227 -0.125 17865
9900 1 15 . 1 1 115 115 VAL C C 140 176.207 176.207 176.149 0.058 17865
9901 1 15 . 1 1 115 115 VAL CA C 140 62.356 62.356 62.299 0.057 17865
9902 1 15 . 1 1 115 115 VAL CB C 140 33.256 33.256 32.113 1.143 17865
9903 1 15 . 1 1 115 115 VAL H H 140 8.272 8.272 7.965 0.307 17865
9904 1 15 . 1 1 116 116 VAL N N 141 124.167 124.167 121.868 2.299 17865
9905 1 15 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.303 -0.181 17865
9906 1 15 . 1 1 116 116 VAL C C 141 175.415 175.415 175.057 0.358 17865
9907 1 15 . 1 1 116 116 VAL CA C 141 61.731 61.731 61.797 -0.066 17865
9908 1 15 . 1 1 116 116 VAL CB C 141 33.145 33.145 33.755 -0.611 17865
9909 1 15 . 1 1 116 116 VAL H H 141 8.142 8.142 7.571 0.571 17865
9910 1 15 . 1 1 117 117 ASP N N 142 126.737 126.737 127.761 -1.024 17865
9911 1 15 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.899 -0.087 17865
9912 1 15 . 1 1 117 117 ASP CA C 142 52.217 52.217 51.595 0.622 17865
9913 1 15 . 1 1 117 117 ASP CB C 142 41.368 41.368 40.737 0.631 17865
9914 1 15 . 1 1 117 117 ASP H H 142 8.419 8.419 8.250 0.169 17865
9915 1 15 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.448 -0.037 17865
9916 1 15 . 1 1 118 118 PRO C C 143 176.662 176.662 175.967 0.695 17865
9917 1 15 . 1 1 118 118 PRO CA C 143 63.247 63.247 62.332 0.915 17865
9918 1 15 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.306 0.005 17865
9919 1 15 . 1 1 119 119 ASN N N 144 119.287 119.287 118.016 1.271 17865
9920 1 15 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.799 0.148 17865
9921 1 15 . 1 1 119 119 ASN CA C 144 51.633 51.633 52.273 -0.640 17865
9922 1 15 . 1 1 119 119 ASN CB C 144 38.859 38.859 38.201 0.658 17865
9923 1 15 . 1 1 119 119 ASN H H 144 8.432 8.432 8.411 0.021 17865
9924 1 15 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.566 0.114 17865
9925 1 15 . 1 1 120 120 PRO CA C 145 61.640 61.640 62.502 -0.862 17865
9926 1 15 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.474 -0.557 17865
9927 1 15 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.929 -0.552 17865
9928 1 15 . 1 1 121 121 PRO C C 146 175.876 175.876 176.137 -0.261 17865
9929 1 15 . 1 1 121 121 PRO CA C 146 63.174 63.174 62.423 0.751 17865
9930 1 15 . 1 1 121 121 PRO CB C 146 31.939 31.939 32.594 -0.655 17865
9931 1 16 . 1 1 2 2 ASP N N 27 121.041 121.041 121.045 -0.004 17865
9932 1 16 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.930 -0.292 17865
9933 1 16 . 1 1 2 2 ASP C C 27 175.878 175.878 174.839 1.039 17865
9934 1 16 . 1 1 2 2 ASP CA C 27 54.382 54.382 54.465 -0.083 17865
9935 1 16 . 1 1 2 2 ASP CB C 27 41.729 41.729 42.805 -1.076 17865
9936 1 16 . 1 1 2 2 ASP H H 27 8.639 8.639 8.449 0.190 17865
9937 1 16 . 1 1 3 3 VAL N N 28 119.901 119.901 122.550 -2.649 17865
9938 1 16 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.039 -0.006 17865
9939 1 16 . 1 1 3 3 VAL C C 28 175.521 175.521 174.284 1.237 17865
9940 1 16 . 1 1 3 3 VAL CA C 28 62.216 62.216 62.368 -0.152 17865
9941 1 16 . 1 1 3 3 VAL CB C 28 33.003 33.003 32.679 0.323 17865
9942 1 16 . 1 1 3 3 VAL H H 28 8.113 8.113 8.214 -0.101 17865
9943 1 16 . 1 1 4 4 PHE N N 29 123.707 123.707 118.106 5.601 17865
9944 1 16 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.262 0.394 17865
9945 1 16 . 1 1 4 4 PHE C C 29 174.874 174.874 174.378 0.496 17865
9946 1 16 . 1 1 4 4 PHE CA C 29 57.159 57.159 57.505 -0.346 17865
9947 1 16 . 1 1 4 4 PHE CB C 29 39.795 39.795 37.953 1.843 17865
9948 1 16 . 1 1 4 4 PHE H H 29 8.255 8.255 8.002 0.253 17865
9949 1 16 . 1 1 5 5 ASP N N 30 124.203 124.203 125.019 -0.816 17865
9950 1 16 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.597 0.241 17865
9951 1 16 . 1 1 5 5 ASP CA C 30 52.385 52.385 53.229 -0.844 17865
9952 1 16 . 1 1 5 5 ASP CB C 30 40.801 40.801 41.238 -0.437 17865
9953 1 16 . 1 1 5 5 ASP H H 30 8.226 8.226 8.376 -0.150 17865
9954 1 16 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.695 -0.158 17865
9955 1 16 . 1 1 6 6 PRO CA C 31 61.664 61.664 61.708 -0.043 17865
9956 1 16 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.219 -0.393 17865
9957 1 16 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.419 0.007 17865
9958 1 16 . 1 1 7 7 PRO C C 32 177.226 177.226 176.273 0.953 17865
9959 1 16 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.596 -0.427 17865
9960 1 16 . 1 1 7 7 PRO CB C 32 31.948 31.948 31.246 0.702 17865
9961 1 16 . 1 1 8 8 THR N N 33 114.158 114.158 121.079 -6.921 17865
9962 1 16 . 1 1 8 8 THR HA H 33 4.195 4.195 4.499 -0.304 17865
9963 1 16 . 1 1 8 8 THR C C 33 174.468 174.468 174.149 0.319 17865
9964 1 16 . 1 1 8 8 THR CA C 33 62.110 62.110 62.421 -0.311 17865
9965 1 16 . 1 1 8 8 THR CB C 33 69.975 69.975 68.149 1.826 17865
9966 1 16 . 1 1 8 8 THR H H 33 8.096 8.096 8.407 -0.311 17865
9967 1 16 . 1 1 9 9 GLN N N 34 122.411 122.411 124.230 -1.819 17865
9968 1 16 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.322 -0.059 17865
9969 1 16 . 1 1 9 9 GLN C C 34 175.445 175.445 175.290 0.155 17865
9970 1 16 . 1 1 9 9 GLN CA C 34 55.763 55.763 55.403 0.360 17865
9971 1 16 . 1 1 9 9 GLN CB C 34 29.691 29.691 29.013 0.678 17865
9972 1 16 . 1 1 9 9 GLN H H 34 8.278 8.278 8.002 0.276 17865
9973 1 16 . 1 1 10 10 TYR N N 35 121.048 121.048 117.700 3.348 17865
9974 1 16 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.279 0.241 17865
9975 1 16 . 1 1 10 10 TYR C C 35 176.314 176.314 175.865 0.449 17865
9976 1 16 . 1 1 10 10 TYR CA C 35 57.972 57.972 58.597 -0.625 17865
9977 1 16 . 1 1 10 10 TYR CB C 35 38.936 38.936 39.344 -0.408 17865
9978 1 16 . 1 1 10 10 TYR H H 35 8.227 8.227 7.751 0.476 17865
9979 1 16 . 1 1 11 11 GLY N N 36 109.711 109.711 104.772 4.939 17865
9980 1 16 . 1 1 11 11 GLY C C 36 174.128 174.128 173.696 0.432 17865
9981 1 16 . 1 1 11 11 GLY CA C 36 45.212 45.212 45.736 -0.524 17865
9982 1 16 . 1 1 11 11 GLY H H 36 8.247 8.247 7.603 0.644 17865
9983 1 16 . 1 1 12 12 TYR N N 37 120.302 120.302 118.430 1.872 17865
9984 1 16 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.762 -0.280 17865
9985 1 16 . 1 1 12 12 TYR C C 37 175.864 175.864 174.750 1.114 17865
9986 1 16 . 1 1 12 12 TYR CA C 37 58.541 58.541 57.568 0.973 17865
9987 1 16 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.998 -1.283 17865
9988 1 16 . 1 1 12 12 TYR H H 37 8.101 8.101 7.464 0.637 17865
9989 1 16 . 1 1 13 13 ASP N N 38 121.883 121.883 117.701 4.182 17865
9990 1 16 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.770 -0.284 17865
9991 1 16 . 1 1 13 13 ASP C C 38 176.538 176.538 176.479 0.059 17865
9992 1 16 . 1 1 13 13 ASP CA C 38 54.223 54.223 52.953 1.270 17865
9993 1 16 . 1 1 13 13 ASP CB C 38 40.988 40.988 41.495 -0.506 17865
9994 1 16 . 1 1 13 13 ASP H H 38 8.266 8.266 6.789 1.477 17865
9995 1 16 . 1 1 14 14 GLY N N 39 107.705 107.705 106.116 1.589 17865
9996 1 16 . 1 1 14 14 GLY C C 39 173.822 173.822 173.652 0.170 17865
9997 1 16 . 1 1 14 14 GLY CA C 39 45.404 45.404 45.852 -0.448 17865
9998 1 16 . 1 1 14 14 GLY H H 39 7.647 7.647 7.976 -0.329 17865
9999 1 16 . 1 1 15 15 LYS N N 40 121.621 121.621 118.867 2.754 17865
10000 1 16 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.400 0.175 17865
10001 1 16 . 1 1 15 15 LYS CA C 40 54.100 54.100 52.951 1.149 17865
10002 1 16 . 1 1 15 15 LYS CB C 40 32.510 32.510 33.787 -1.277 17865
10003 1 16 . 1 1 15 15 LYS H H 40 7.908 7.908 7.011 0.897 17865
10004 1 16 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.549 -0.197 17865
10005 1 16 . 1 1 16 16 PRO C C 41 176.806 176.806 176.559 0.247 17865
10006 1 16 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.091 0.667 17865
10007 1 16 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.697 -0.383 17865
10008 1 16 . 1 1 17 17 LEU N N 42 123.488 123.488 117.887 5.601 17865
10009 1 16 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.511 -0.463 17865
10010 1 16 . 1 1 17 17 LEU C C 42 174.973 174.973 176.268 -1.295 17865
10011 1 16 . 1 1 17 17 LEU CA C 42 55.436 55.436 55.873 -0.437 17865
10012 1 16 . 1 1 17 17 LEU CB C 42 42.093 42.093 42.058 0.035 17865
10013 1 16 . 1 1 17 17 LEU H H 42 8.499 8.499 8.264 0.235 17865
10014 1 16 . 1 1 18 18 ASP N N 43 123.354 123.354 122.869 0.485 17865
10015 1 16 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.788 -0.290 17865
10016 1 16 . 1 1 18 18 ASP C C 43 175.947 175.947 176.412 -0.465 17865
10017 1 16 . 1 1 18 18 ASP CA C 43 52.858 52.858 52.825 0.033 17865
10018 1 16 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.758 -2.537 17865
10019 1 16 . 1 1 18 18 ASP H H 43 7.789 7.789 8.088 -0.299 17865
10020 1 16 . 1 1 19 19 ALA N N 44 120.147 120.147 124.666 -4.519 17865
10021 1 16 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.110 -0.124 17865
10022 1 16 . 1 1 19 19 ALA C C 44 179.476 179.476 178.085 1.391 17865
10023 1 16 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.453 0.710 17865
10024 1 16 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.759 -0.372 17865
10025 1 16 . 1 1 19 19 ALA H H 44 8.561 8.561 8.663 -0.102 17865
10026 1 16 . 1 1 20 20 SER N N 45 115.037 115.037 113.859 1.178 17865
10027 1 16 . 1 1 20 20 SER HA H 45 4.151 4.151 4.240 -0.089 17865
10028 1 16 . 1 1 20 20 SER C C 45 177.191 177.191 176.577 0.614 17865
10029 1 16 . 1 1 20 20 SER CA C 45 61.629 61.629 61.565 0.064 17865
10030 1 16 . 1 1 20 20 SER CB C 45 62.804 62.804 63.300 -0.496 17865
10031 1 16 . 1 1 20 20 SER H H 45 8.466 8.466 8.580 -0.114 17865
10032 1 16 . 1 1 21 21 PHE N N 46 125.030 125.030 123.310 1.720 17865
10033 1 16 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.320 -0.089 17865
10034 1 16 . 1 1 21 21 PHE C C 46 176.850 176.850 176.524 0.326 17865
10035 1 16 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.624 0.182 17865
10036 1 16 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.117 0.764 17865
10037 1 16 . 1 1 21 21 PHE H H 46 8.034 8.034 7.861 0.173 17865
10038 1 16 . 1 1 22 22 CYS N N 47 113.943 113.943 116.648 -2.705 17865
10039 1 16 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.187 0.064 17865
10040 1 16 . 1 1 22 22 CYS C C 47 176.449 176.449 175.852 0.597 17865
10041 1 16 . 1 1 22 22 CYS CA C 47 53.600 53.600 59.095 -5.495 17865
10042 1 16 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.184 11.207 17865
10043 1 16 . 1 1 22 22 CYS H H 47 7.691 7.691 8.467 -0.776 17865
10044 1 16 . 1 1 23 23 ARG N N 48 119.958 119.958 120.989 -1.031 17865
10045 1 16 . 1 1 23 23 ARG HA H 48 4.080 4.080 3.998 0.082 17865
10046 1 16 . 1 1 23 23 ARG C C 48 177.904 177.904 177.535 0.369 17865
10047 1 16 . 1 1 23 23 ARG CA C 48 58.907 58.907 58.873 0.034 17865
10048 1 16 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.545 0.626 17865
10049 1 16 . 1 1 23 23 ARG H H 48 7.628 7.628 7.386 0.242 17865
10050 1 16 . 1 1 24 24 THR N N 49 106.445 106.445 110.631 -4.186 17865
10051 1 16 . 1 1 24 24 THR HA H 49 4.385 4.385 4.218 0.167 17865
10052 1 16 . 1 1 24 24 THR C C 49 174.758 174.758 175.500 -0.742 17865
10053 1 16 . 1 1 24 24 THR CA C 49 61.573 61.573 63.977 -2.404 17865
10054 1 16 . 1 1 24 24 THR CB C 49 68.794 68.794 68.696 0.098 17865
10055 1 16 . 1 1 24 24 THR H H 49 7.307 7.307 7.369 -0.062 17865
10056 1 16 . 1 1 25 25 ALA N N 50 122.242 122.242 122.621 -0.379 17865
10057 1 16 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.112 0.292 17865
10058 1 16 . 1 1 25 25 ALA C C 50 178.554 178.554 178.427 0.127 17865
10059 1 16 . 1 1 25 25 ALA CA C 50 52.381 52.381 53.544 -1.163 17865
10060 1 16 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.068 -0.673 17865
10061 1 16 . 1 1 25 25 ALA H H 50 7.401 7.401 7.371 0.030 17865
10062 1 16 . 1 1 26 26 GLY N N 51 110.604 110.604 106.711 3.893 17865
10063 1 16 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.474 0.548 17865
10064 1 16 . 1 1 26 26 GLY H H 51 8.285 8.285 7.380 0.905 17865
10065 1 16 . 1 1 27 27 SER HA H 52 4.382 4.382 4.197 0.185 17865
10066 1 16 . 1 1 27 27 SER C C 52 175.774 175.774 176.178 -0.404 17865
10067 1 16 . 1 1 27 27 SER CA C 52 60.803 60.803 60.654 0.149 17865
10068 1 16 . 1 1 27 27 SER CB C 52 62.827 62.827 63.169 -0.342 17865
10069 1 16 . 1 1 28 28 ARG N N 53 119.682 119.682 119.469 0.213 17865
10070 1 16 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.846 0.034 17865
10071 1 16 . 1 1 28 28 ARG C C 53 175.796 175.796 176.837 -1.041 17865
10072 1 16 . 1 1 28 28 ARG CA C 53 55.738 55.738 56.300 -0.562 17865
10073 1 16 . 1 1 28 28 ARG CB C 53 30.237 30.237 29.775 0.462 17865
10074 1 16 . 1 1 28 28 ARG H H 53 7.894 7.894 7.887 0.007 17865
10075 1 16 . 1 1 29 29 GLU N N 54 122.318 122.318 122.438 -0.120 17865
10076 1 16 . 1 1 29 29 GLU HA H 54 3.595 3.595 3.925 -0.330 17865
10077 1 16 . 1 1 29 29 GLU C C 54 177.523 177.523 177.209 0.314 17865
10078 1 16 . 1 1 29 29 GLU CA C 54 61.223 61.223 59.607 1.616 17865
10079 1 16 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.474 -0.537 17865
10080 1 16 . 1 1 29 29 GLU H H 54 7.730 7.730 7.848 -0.118 17865
10081 1 16 . 1 1 30 30 LYS N N 55 118.377 118.377 119.130 -0.753 17865
10082 1 16 . 1 1 30 30 LYS HA H 55 3.828 3.828 3.981 -0.153 17865
10083 1 16 . 1 1 30 30 LYS C C 55 179.205 179.205 178.542 0.663 17865
10084 1 16 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.492 0.935 17865
10085 1 16 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.284 -0.683 17865
10086 1 16 . 1 1 30 30 LYS H H 55 8.659 8.659 7.566 1.093 17865
10087 1 16 . 1 1 31 31 ASP N N 56 121.614 121.614 119.012 2.602 17865
10088 1 16 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.580 -0.269 17865
10089 1 16 . 1 1 31 31 ASP C C 56 177.393 177.393 177.697 -0.304 17865
10090 1 16 . 1 1 31 31 ASP CA C 56 57.316 57.316 57.632 -0.316 17865
10091 1 16 . 1 1 31 31 ASP CB C 56 40.423 40.423 41.232 -0.809 17865
10092 1 16 . 1 1 31 31 ASP H H 56 7.646 7.646 7.817 -0.171 17865
10093 1 16 . 1 1 32 32 CYS N N 57 120.345 120.345 120.220 0.125 17865
10094 1 16 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.423 0.178 17865
10095 1 16 . 1 1 32 32 CYS C C 57 175.772 175.772 176.161 -0.389 17865
10096 1 16 . 1 1 32 32 CYS CA C 57 60.197 60.197 61.656 -1.459 17865
10097 1 16 . 1 1 32 32 CYS CB C 57 33.966 33.966 26.082 7.884 17865
10098 1 16 . 1 1 32 32 CYS H H 57 8.042 8.042 7.825 0.217 17865
10099 1 16 . 1 1 33 33 ARG N N 58 120.293 120.293 119.095 1.198 17865
10100 1 16 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.973 -0.297 17865
10101 1 16 . 1 1 33 33 ARG C C 58 179.633 179.633 178.656 0.977 17865
10102 1 16 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.246 1.140 17865
10103 1 16 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.380 0.461 17865
10104 1 16 . 1 1 33 33 ARG H H 58 8.531 8.531 8.338 0.193 17865
10105 1 16 . 1 1 34 34 LYS N N 59 121.166 121.166 119.465 1.701 17865
10106 1 16 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.141 -0.105 17865
10107 1 16 . 1 1 34 34 LYS C C 59 179.220 179.220 178.702 0.518 17865
10108 1 16 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.699 0.831 17865
10109 1 16 . 1 1 34 34 LYS CB C 59 32.110 32.110 31.952 0.158 17865
10110 1 16 . 1 1 34 34 LYS H H 59 7.633 7.633 7.568 0.065 17865
10111 1 16 . 1 1 35 35 ASP N N 60 122.166 122.166 119.754 2.412 17865
10112 1 16 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.437 -0.006 17865
10113 1 16 . 1 1 35 35 ASP C C 60 179.709 179.709 177.934 1.775 17865
10114 1 16 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.056 0.647 17865
10115 1 16 . 1 1 35 35 ASP CB C 60 40.672 40.672 41.042 -0.370 17865
10116 1 16 . 1 1 35 35 ASP H H 60 8.221 8.221 7.909 0.312 17865
10117 1 16 . 1 1 36 36 VAL N N 61 121.312 121.312 118.871 2.441 17865
10118 1 16 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.790 -0.389 17865
10119 1 16 . 1 1 36 36 VAL C C 61 178.339 178.339 177.104 1.235 17865
10120 1 16 . 1 1 36 36 VAL CA C 61 67.133 67.133 64.861 2.273 17865
10121 1 16 . 1 1 36 36 VAL CB C 61 31.657 31.657 32.428 -0.771 17865
10122 1 16 . 1 1 36 36 VAL H H 61 8.916 8.916 8.185 0.731 17865
10123 1 16 . 1 1 37 37 GLN N N 62 119.166 119.166 117.089 2.077 17865
10124 1 16 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.180 -0.238 17865
10125 1 16 . 1 1 37 37 GLN C C 62 177.293 177.293 176.811 0.482 17865
10126 1 16 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.840 0.440 17865
10127 1 16 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.858 -0.487 17865
10128 1 16 . 1 1 37 37 GLN H H 62 7.697 7.697 7.524 0.173 17865
10129 1 16 . 1 1 38 38 ALA N N 63 118.964 118.964 120.480 -1.516 17865
10130 1 16 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.428 -0.186 17865
10131 1 16 . 1 1 38 38 ALA C C 63 177.221 177.221 176.763 0.458 17865
10132 1 16 . 1 1 38 38 ALA CA C 63 53.137 53.137 51.718 1.419 17865
10133 1 16 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.061 -0.164 17865
10134 1 16 . 1 1 38 38 ALA H H 63 7.508 7.508 7.468 0.040 17865
10135 1 16 . 1 1 39 39 CYS N N 64 119.081 119.081 119.436 -0.355 17865
10136 1 16 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.723 0.230 17865
10137 1 16 . 1 1 39 39 CYS C C 64 172.052 172.052 174.365 -2.313 17865
10138 1 16 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.382 -6.502 17865
10139 1 16 . 1 1 39 39 CYS CB C 64 34.328 34.328 27.620 6.708 17865
10140 1 16 . 1 1 39 39 CYS H H 64 7.354 7.354 7.543 -0.189 17865
10141 1 16 . 1 1 40 40 ASP N N 65 124.167 124.167 126.450 -2.283 17865
10142 1 16 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.449 -0.124 17865
10143 1 16 . 1 1 40 40 ASP C C 65 176.496 176.496 175.952 0.544 17865
10144 1 16 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.169 0.555 17865
10145 1 16 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.352 -0.039 17865
10146 1 16 . 1 1 40 40 ASP H H 65 8.142 8.142 8.848 -0.706 17865
10147 1 16 . 1 1 41 41 LYS N N 66 118.844 118.844 119.027 -0.183 17865
10148 1 16 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.517 0.007 17865
10149 1 16 . 1 1 41 41 LYS C C 66 175.586 175.586 176.292 -0.706 17865
10150 1 16 . 1 1 41 41 LYS CA C 66 55.275 55.275 55.846 -0.571 17865
10151 1 16 . 1 1 41 41 LYS CB C 66 32.598 32.598 31.575 1.023 17865
10152 1 16 . 1 1 41 41 LYS H H 66 7.858 7.858 8.214 -0.356 17865
10153 1 16 . 1 1 42 42 LYS N N 67 126.081 126.081 121.602 4.479 17865
10154 1 16 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.272 -0.357 17865
10155 1 16 . 1 1 42 42 LYS C C 67 174.665 174.665 175.153 -0.488 17865
10156 1 16 . 1 1 42 42 LYS CA C 67 57.827 57.827 56.385 1.442 17865
10157 1 16 . 1 1 42 42 LYS CB C 67 34.059 34.059 33.157 0.902 17865
10158 1 16 . 1 1 42 42 LYS H H 67 8.790 8.790 8.459 0.331 17865
10159 1 16 . 1 1 43 43 TYR N N 68 114.138 114.138 117.530 -3.392 17865
10160 1 16 . 1 1 43 43 TYR HA H 68 5.259 5.259 5.146 0.113 17865
10161 1 16 . 1 1 43 43 TYR C C 68 175.767 175.767 174.437 1.330 17865
10162 1 16 . 1 1 43 43 TYR CA C 68 55.880 55.880 57.019 -1.139 17865
10163 1 16 . 1 1 43 43 TYR CB C 68 42.363 42.363 41.995 0.368 17865
10164 1 16 . 1 1 43 43 TYR H H 68 7.294 7.294 7.380 -0.086 17865
10165 1 16 . 1 1 44 44 ASP N N 69 121.807 121.807 121.859 -0.052 17865
10166 1 16 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.700 -0.060 17865
10167 1 16 . 1 1 44 44 ASP C C 69 177.812 177.812 176.992 0.820 17865
10168 1 16 . 1 1 44 44 ASP CA C 69 52.110 52.110 54.286 -2.176 17865
10169 1 16 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.464 -2.024 17865
10170 1 16 . 1 1 44 44 ASP H H 69 8.995 8.995 8.661 0.334 17865
10171 1 16 . 1 1 45 45 ASP N N 70 116.686 116.686 118.479 -1.793 17865
10172 1 16 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.495 -0.071 17865
10173 1 16 . 1 1 45 45 ASP C C 70 177.054 177.054 177.528 -0.474 17865
10174 1 16 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.492 -0.111 17865
10175 1 16 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.982 -0.734 17865
10176 1 16 . 1 1 45 45 ASP H H 70 8.369 8.369 8.606 -0.237 17865
10177 1 16 . 1 1 46 46 GLN N N 71 117.949 117.949 118.111 -0.162 17865
10178 1 16 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.354 0.102 17865
10179 1 16 . 1 1 46 46 GLN C C 71 176.273 176.273 176.171 0.102 17865
10180 1 16 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.321 0.046 17865
10181 1 16 . 1 1 46 46 GLN CB C 71 29.330 29.330 28.611 0.719 17865
10182 1 16 . 1 1 46 46 GLN H H 71 8.274 8.274 8.171 0.103 17865
10183 1 16 . 1 1 47 47 GLY N N 72 108.369 108.369 106.905 1.464 17865
10184 1 16 . 1 1 47 47 GLY C C 72 174.145 174.145 173.866 0.279 17865
10185 1 16 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.163 0.660 17865
10186 1 16 . 1 1 47 47 GLY H H 72 8.174 8.174 7.664 0.510 17865
10187 1 16 . 1 1 48 48 ARG N N 73 121.554 121.554 118.464 3.090 17865
10188 1 16 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.642 -0.157 17865
10189 1 16 . 1 1 48 48 ARG C C 73 176.855 176.855 175.621 1.234 17865
10190 1 16 . 1 1 48 48 ARG CA C 73 55.289 55.289 53.470 1.819 17865
10191 1 16 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.547 -0.989 17865
10192 1 16 . 1 1 48 48 ARG H H 73 8.462 8.462 7.961 0.501 17865
10193 1 16 . 1 1 49 49 GLU N N 74 122.784 122.784 120.950 1.834 17865
10194 1 16 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.322 0.161 17865
10195 1 16 . 1 1 49 49 GLU C C 74 178.098 178.098 177.006 1.092 17865
10196 1 16 . 1 1 49 49 GLU CA C 74 57.184 57.184 56.410 0.774 17865
10197 1 16 . 1 1 49 49 GLU CB C 74 30.777 30.777 30.395 0.382 17865
10198 1 16 . 1 1 49 49 GLU H H 74 8.703 8.703 8.564 0.139 17865
10199 1 16 . 1 1 50 50 THR N N 75 114.563 114.563 114.773 -0.210 17865
10200 1 16 . 1 1 50 50 THR HA H 75 4.212 4.212 4.489 -0.277 17865
10201 1 16 . 1 1 50 50 THR C C 75 175.170 175.170 175.516 -0.346 17865
10202 1 16 . 1 1 50 50 THR CA C 75 60.589 60.589 60.487 0.102 17865
10203 1 16 . 1 1 50 50 THR CB C 75 70.952 70.952 70.424 0.528 17865
10204 1 16 . 1 1 50 50 THR H H 75 7.717 7.717 8.188 -0.471 17865
10205 1 16 . 1 1 51 51 ALA N N 76 122.097 122.097 121.849 0.248 17865
10206 1 16 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.070 -0.032 17865
10207 1 16 . 1 1 51 51 ALA C C 76 181.906 181.906 179.068 2.838 17865
10208 1 16 . 1 1 51 51 ALA CA C 76 55.654 55.654 54.771 0.883 17865
10209 1 16 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.253 -0.260 17865
10210 1 16 . 1 1 51 51 ALA H H 76 8.734 8.734 8.573 0.161 17865
10211 1 16 . 1 1 52 52 CYS N N 77 115.347 115.347 116.638 -1.291 17865
10212 1 16 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.252 0.228 17865
10213 1 16 . 1 1 52 52 CYS C C 77 176.299 176.299 176.676 -0.377 17865
10214 1 16 . 1 1 52 52 CYS CA C 77 57.701 57.701 60.125 -2.424 17865
10215 1 16 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.698 9.933 17865
10216 1 16 . 1 1 52 52 CYS H H 77 9.073 9.073 7.962 1.111 17865
10217 1 16 . 1 1 53 53 ALA N N 78 128.517 128.517 122.931 5.586 17865
10218 1 16 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.845 0.010 17865
10219 1 16 . 1 1 53 53 ALA C C 78 178.736 178.736 179.261 -0.525 17865
10220 1 16 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.182 0.451 17865
10221 1 16 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.902 1.289 17865
10222 1 16 . 1 1 53 53 ALA H H 78 7.174 7.174 7.954 -0.780 17865
10223 1 16 . 1 1 54 54 LYS N N 79 118.706 118.706 118.363 0.343 17865
10224 1 16 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.249 -0.446 17865
10225 1 16 . 1 1 54 54 LYS C C 79 179.611 179.611 178.556 1.055 17865
10226 1 16 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.337 1.388 17865
10227 1 16 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.477 0.176 17865
10228 1 16 . 1 1 54 54 LYS H H 79 8.313 8.313 7.839 0.474 17865
10229 1 16 . 1 1 55 55 GLY N N 80 104.822 104.822 108.086 -3.264 17865
10230 1 16 . 1 1 55 55 GLY C C 80 176.504 176.504 176.233 0.271 17865
10231 1 16 . 1 1 55 55 GLY CA C 80 46.839 46.839 46.907 -0.068 17865
10232 1 16 . 1 1 55 55 GLY H H 80 8.175 8.175 7.468 0.707 17865
10233 1 16 . 1 1 56 56 ILE N N 81 123.697 123.697 122.546 1.151 17865
10234 1 16 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.947 -0.152 17865
10235 1 16 . 1 1 56 56 ILE C C 81 177.334 177.334 177.396 -0.062 17865
10236 1 16 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.808 0.473 17865
10237 1 16 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.979 0.356 17865
10238 1 16 . 1 1 56 56 ILE H H 81 7.590 7.590 7.957 -0.367 17865
10239 1 16 . 1 1 57 57 ARG N N 82 118.161 118.161 120.434 -2.273 17865
10240 1 16 . 1 1 57 57 ARG HA H 82 3.935 3.935 4.021 -0.086 17865
10241 1 16 . 1 1 57 57 ARG C C 82 178.662 178.662 178.029 0.633 17865
10242 1 16 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.266 0.436 17865
10243 1 16 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.999 -0.100 17865
10244 1 16 . 1 1 57 57 ARG H H 82 7.569 7.569 7.698 -0.129 17865
10245 1 16 . 1 1 58 58 GLU N N 83 115.085 115.085 116.013 -0.928 17865
10246 1 16 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.110 -0.079 17865
10247 1 16 . 1 1 58 58 GLU C C 83 178.224 178.224 178.231 -0.007 17865
10248 1 16 . 1 1 58 58 GLU CA C 83 58.304 58.304 58.100 0.204 17865
10249 1 16 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.579 0.452 17865
10250 1 16 . 1 1 58 58 GLU H H 83 7.786 7.786 8.206 -0.420 17865
10251 1 16 . 1 1 59 59 LYS N N 84 119.183 119.183 117.851 1.332 17865
10252 1 16 . 1 1 59 59 LYS HA H 84 3.830 3.830 3.930 -0.100 17865
10253 1 16 . 1 1 59 59 LYS C C 84 177.933 177.933 178.129 -0.196 17865
10254 1 16 . 1 1 59 59 LYS CA C 84 59.043 59.043 58.033 1.010 17865
10255 1 16 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.755 0.895 17865
10256 1 16 . 1 1 59 59 LYS H H 84 7.968 7.968 7.358 0.610 17865
10257 1 16 . 1 1 60 60 TYR N N 85 113.663 113.663 115.664 -2.001 17865
10258 1 16 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.755 -0.052 17865
10259 1 16 . 1 1 60 60 TYR C C 85 174.729 174.729 174.115 0.614 17865
10260 1 16 . 1 1 60 60 TYR CA C 85 57.202 57.202 55.833 1.369 17865
10261 1 16 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.349 0.553 17865
10262 1 16 . 1 1 60 60 TYR H H 85 7.562 7.562 7.986 -0.424 17865
10263 1 16 . 1 1 61 61 LYS N N 86 121.862 121.862 121.985 -0.123 17865
10264 1 16 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.551 -0.039 17865
10265 1 16 . 1 1 61 61 LYS CA C 86 54.942 54.942 54.895 0.047 17865
10266 1 16 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.325 -0.223 17865
10267 1 16 . 1 1 61 61 LYS H H 86 7.222 7.222 7.613 -0.391 17865
10268 1 16 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.441 -0.118 17865
10269 1 16 . 1 1 62 62 PRO C C 87 176.576 176.576 176.448 0.128 17865
10270 1 16 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.559 0.461 17865
10271 1 16 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.514 -0.274 17865
10272 1 16 . 1 1 63 63 ALA N N 88 125.029 125.029 125.621 -0.592 17865
10273 1 16 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.214 0.040 17865
10274 1 16 . 1 1 63 63 ALA C C 88 177.301 177.301 176.576 0.725 17865
10275 1 16 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.352 -0.071 17865
10276 1 16 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.804 1.398 17865
10277 1 16 . 1 1 63 63 ALA H H 88 8.329 8.329 8.345 -0.016 17865
10278 1 16 . 1 1 64 64 VAL N N 89 121.843 121.843 121.088 0.755 17865
10279 1 16 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.468 -0.524 17865
10280 1 16 . 1 1 64 64 VAL C C 89 174.791 174.791 174.881 -0.090 17865
10281 1 16 . 1 1 64 64 VAL CA C 89 61.981 61.981 59.757 2.224 17865
10282 1 16 . 1 1 64 64 VAL CB C 89 33.485 33.485 34.928 -1.443 17865
10283 1 16 . 1 1 64 64 VAL H H 89 8.075 8.075 7.604 0.471 17865
10284 1 16 . 1 1 65 65 VAL N N 90 125.399 125.399 119.466 5.933 17865
10285 1 16 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.346 -0.208 17865
10286 1 16 . 1 1 65 65 VAL C C 90 174.340 174.340 175.001 -0.661 17865
10287 1 16 . 1 1 65 65 VAL CA C 90 61.162 61.162 62.163 -1.001 17865
10288 1 16 . 1 1 65 65 VAL CB C 90 33.866 33.866 31.123 2.743 17865
10289 1 16 . 1 1 65 65 VAL H H 90 8.229 8.229 8.077 0.152 17865
10290 1 16 . 1 1 66 66 TYR N N 91 124.848 124.848 126.489 -1.641 17865
10291 1 16 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.719 0.052 17865
10292 1 16 . 1 1 66 66 TYR C C 91 176.658 176.658 176.265 0.393 17865
10293 1 16 . 1 1 66 66 TYR CA C 91 58.084 58.084 56.830 1.254 17865
10294 1 16 . 1 1 66 66 TYR CB C 91 41.535 41.535 42.068 -0.533 17865
10295 1 16 . 1 1 66 66 TYR H H 91 9.145 9.145 8.000 1.145 17865
10296 1 16 . 1 1 67 67 GLY N N 92 106.185 106.185 107.662 -1.477 17865
10297 1 16 . 1 1 67 67 GLY C C 92 175.681 175.681 175.001 0.680 17865
10298 1 16 . 1 1 67 67 GLY CA C 92 43.975 43.975 44.041 -0.066 17865
10299 1 16 . 1 1 67 67 GLY H H 92 8.730 8.730 8.707 0.023 17865
10300 1 16 . 1 1 68 68 TYR N N 93 121.815 121.815 117.197 4.618 17865
10301 1 16 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.507 -0.532 17865
10302 1 16 . 1 1 68 68 TYR C C 93 176.035 176.035 175.927 0.108 17865
10303 1 16 . 1 1 68 68 TYR CA C 93 61.046 61.046 58.515 2.531 17865
10304 1 16 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.227 0.198 17865
10305 1 16 . 1 1 68 68 TYR H H 93 8.711 8.711 8.707 0.004 17865
10306 1 16 . 1 1 69 69 ASP N N 94 115.507 115.507 119.877 -4.370 17865
10307 1 16 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.438 -0.150 17865
10308 1 16 . 1 1 69 69 ASP C C 94 177.063 177.063 176.924 0.139 17865
10309 1 16 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.729 -0.718 17865
10310 1 16 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.782 -0.615 17865
10311 1 16 . 1 1 69 69 ASP H H 94 8.010 8.010 7.754 0.256 17865
10312 1 16 . 1 1 70 70 GLY N N 95 107.196 107.196 107.023 0.173 17865
10313 1 16 . 1 1 70 70 GLY C C 95 173.936 173.936 172.596 1.340 17865
10314 1 16 . 1 1 70 70 GLY CA C 95 45.392 45.392 45.412 -0.020 17865
10315 1 16 . 1 1 70 70 GLY H H 95 7.986 7.986 7.706 0.280 17865
10316 1 16 . 1 1 71 71 LYS N N 96 121.258 121.258 119.088 2.170 17865
10317 1 16 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.517 0.267 17865
10318 1 16 . 1 1 71 71 LYS CA C 96 54.114 54.114 52.096 2.018 17865
10319 1 16 . 1 1 71 71 LYS CB C 96 31.762 31.762 34.611 -2.849 17865
10320 1 16 . 1 1 71 71 LYS H H 96 7.877 7.877 7.639 0.238 17865
10321 1 16 . 1 1 72 72 PRO C C 97 177.170 177.170 175.659 1.511 17865
10322 1 16 . 1 1 72 72 PRO CA C 97 63.137 63.137 63.678 -0.541 17865
10323 1 16 . 1 1 72 72 PRO CB C 97 32.240 32.240 30.553 1.687 17865
10324 1 16 . 1 1 73 73 LEU N N 98 123.503 123.503 122.667 0.836 17865
10325 1 16 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.770 -0.410 17865
10326 1 16 . 1 1 73 73 LEU C C 98 176.354 176.354 175.261 1.093 17865
10327 1 16 . 1 1 73 73 LEU CA C 98 53.927 53.927 53.265 0.662 17865
10328 1 16 . 1 1 73 73 LEU CB C 98 42.272 42.272 46.312 -4.040 17865
10329 1 16 . 1 1 73 73 LEU H H 98 8.850 8.850 8.128 0.722 17865
10330 1 16 . 1 1 74 74 ASP N N 99 122.212 122.212 122.626 -0.414 17865
10331 1 16 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.797 -0.200 17865
10332 1 16 . 1 1 74 74 ASP C C 99 175.819 175.819 175.421 0.398 17865
10333 1 16 . 1 1 74 74 ASP CA C 99 53.856 53.856 53.545 0.311 17865
10334 1 16 . 1 1 74 74 ASP CB C 99 40.989 40.989 39.533 1.456 17865
10335 1 16 . 1 1 74 74 ASP H H 99 8.517 8.517 8.670 -0.153 17865
10336 1 16 . 1 1 75 75 LEU N N 100 125.874 125.874 116.747 9.127 17865
10337 1 16 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.676 -0.309 17865
10338 1 16 . 1 1 75 75 LEU C C 100 178.426 178.426 176.697 1.729 17865
10339 1 16 . 1 1 75 75 LEU CA C 100 53.631 53.631 55.139 -1.508 17865
10340 1 16 . 1 1 75 75 LEU CB C 100 40.676 40.676 41.299 -0.623 17865
10341 1 16 . 1 1 75 75 LEU H H 100 8.281 8.281 7.473 0.808 17865
10342 1 16 . 1 1 76 76 GLY N N 101 110.604 110.604 110.901 -0.297 17865
10343 1 16 . 1 1 76 76 GLY C C 101 176.936 176.936 175.341 1.595 17865
10344 1 16 . 1 1 76 76 GLY CA C 101 47.827 47.827 48.068 -0.241 17865
10345 1 16 . 1 1 76 76 GLY H H 101 8.914 8.914 8.742 0.172 17865
10346 1 16 . 1 1 77 77 PHE N N 102 117.639 117.639 115.155 2.484 17865
10347 1 16 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.887 -0.506 17865
10348 1 16 . 1 1 77 77 PHE C C 102 177.878 177.878 176.056 1.822 17865
10349 1 16 . 1 1 77 77 PHE CA C 102 59.139 59.139 55.603 3.536 17865
10350 1 16 . 1 1 77 77 PHE CB C 102 36.935 36.935 38.472 -1.537 17865
10351 1 16 . 1 1 77 77 PHE H H 102 7.992 7.992 7.515 0.477 17865
10352 1 16 . 1 1 78 78 CYS N N 103 121.136 121.136 121.108 0.028 17865
10353 1 16 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.152 0.233 17865
10354 1 16 . 1 1 78 78 CYS C C 103 172.780 172.780 176.413 -3.633 17865
10355 1 16 . 1 1 78 78 CYS CA C 103 53.696 53.696 60.437 -6.740 17865
10356 1 16 . 1 1 78 78 CYS CB C 103 34.237 34.237 25.793 8.444 17865
10357 1 16 . 1 1 78 78 CYS H H 103 7.362 7.362 7.599 -0.237 17865
10358 1 16 . 1 1 79 79 THR N N 104 114.773 114.773 116.662 -1.889 17865
10359 1 16 . 1 1 79 79 THR HA H 104 3.984 3.984 4.189 -0.205 17865
10360 1 16 . 1 1 79 79 THR C C 104 176.624 176.624 174.923 1.701 17865
10361 1 16 . 1 1 79 79 THR CA C 104 65.180 65.180 65.652 -0.472 17865
10362 1 16 . 1 1 79 79 THR CB C 104 69.062 69.062 68.258 0.804 17865
10363 1 16 . 1 1 79 79 THR H H 104 7.864 7.864 7.705 0.159 17865
10364 1 16 . 1 1 80 80 LEU N N 105 119.785 119.785 118.517 1.268 17865
10365 1 16 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.190 0.141 17865
10366 1 16 . 1 1 80 80 LEU C C 105 177.208 177.208 176.987 0.221 17865
10367 1 16 . 1 1 80 80 LEU CA C 105 55.453 55.453 55.889 -0.437 17865
10368 1 16 . 1 1 80 80 LEU CB C 105 41.293 41.293 41.639 -0.346 17865
10369 1 16 . 1 1 80 80 LEU H H 105 7.238 7.238 7.288 -0.050 17865
10370 1 16 . 1 1 81 81 ALA N N 106 119.309 119.309 118.915 0.394 17865
10371 1 16 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.424 0.103 17865
10372 1 16 . 1 1 81 81 ALA C C 106 178.769 178.769 178.445 0.324 17865
10373 1 16 . 1 1 81 81 ALA CA C 106 52.049 52.049 52.946 -0.897 17865
10374 1 16 . 1 1 81 81 ALA CB C 106 18.820 18.820 20.635 -1.815 17865
10375 1 16 . 1 1 81 81 ALA H H 106 7.432 7.432 8.009 -0.577 17865
10376 1 16 . 1 1 82 82 GLY N N 107 109.793 109.793 107.251 2.542 17865
10377 1 16 . 1 1 82 82 GLY CA C 107 47.119 47.119 46.312 0.807 17865
10378 1 16 . 1 1 82 82 GLY H H 107 7.918 7.918 8.592 -0.674 17865
10379 1 16 . 1 1 83 83 ILE HA H 108 4.266 4.266 4.058 0.208 17865
10380 1 16 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.388 -0.125 17865
10381 1 16 . 1 1 83 83 ILE CB C 108 38.261 38.261 38.334 -0.073 17865
10382 1 16 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.268 0.487 17865
10383 1 16 . 1 1 84 84 ARG C C 109 181.344 181.344 177.084 4.260 17865
10384 1 16 . 1 1 84 84 ARG CA C 109 55.939 55.939 58.058 -2.119 17865
10385 1 16 . 1 1 84 84 ARG CB C 109 30.283 30.283 29.833 0.450 17865
10386 1 16 . 1 1 85 85 GLU N N 110 122.944 122.944 119.408 3.536 17865
10387 1 16 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.093 -0.476 17865
10388 1 16 . 1 1 85 85 GLU C C 110 177.797 177.797 178.070 -0.273 17865
10389 1 16 . 1 1 85 85 GLU CA C 110 60.728 60.728 58.630 2.098 17865
10390 1 16 . 1 1 85 85 GLU CB C 110 28.871 28.871 28.968 -0.097 17865
10391 1 16 . 1 1 85 85 GLU H H 110 8.003 8.003 8.396 -0.393 17865
10392 1 16 . 1 1 86 86 VAL N N 111 117.101 117.101 119.448 -2.347 17865
10393 1 16 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.609 -0.098 17865
10394 1 16 . 1 1 86 86 VAL C C 111 177.710 177.710 177.386 0.324 17865
10395 1 16 . 1 1 86 86 VAL CA C 111 66.430 66.430 65.731 0.699 17865
10396 1 16 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.655 -0.442 17865
10397 1 16 . 1 1 86 86 VAL H H 111 8.106 8.106 7.253 0.853 17865
10398 1 16 . 1 1 87 87 ASP N N 112 122.242 122.242 118.790 3.452 17865
10399 1 16 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.520 -0.216 17865
10400 1 16 . 1 1 87 87 ASP C C 112 176.912 176.912 177.977 -1.065 17865
10401 1 16 . 1 1 87 87 ASP CA C 112 57.417 57.417 56.838 0.579 17865
10402 1 16 . 1 1 87 87 ASP CB C 112 40.476 40.476 41.401 -0.925 17865
10403 1 16 . 1 1 87 87 ASP H H 112 7.401 7.401 8.047 -0.646 17865
10404 1 16 . 1 1 88 88 CYS N N 113 120.819 120.819 117.160 3.659 17865
10405 1 16 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.308 -0.999 17865
10406 1 16 . 1 1 88 88 CYS C C 113 175.270 175.270 177.006 -1.736 17865
10407 1 16 . 1 1 88 88 CYS CA C 113 59.759 59.759 60.592 -0.833 17865
10408 1 16 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.360 7.475 17865
10409 1 16 . 1 1 88 88 CYS H H 113 7.785 7.785 7.645 0.140 17865
10410 1 16 . 1 1 89 89 ARG N N 114 118.654 118.654 120.370 -1.716 17865
10411 1 16 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.030 -0.389 17865
10412 1 16 . 1 1 89 89 ARG C C 114 179.018 179.018 178.509 0.509 17865
10413 1 16 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.222 0.971 17865
10414 1 16 . 1 1 89 89 ARG CB C 114 29.713 29.713 29.884 -0.171 17865
10415 1 16 . 1 1 89 89 ARG H H 114 8.142 8.142 7.703 0.439 17865
10416 1 16 . 1 1 90 90 LYS N N 115 120.964 120.964 118.629 2.335 17865
10417 1 16 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.230 -0.200 17865
10418 1 16 . 1 1 90 90 LYS C C 115 180.092 180.092 178.935 1.157 17865
10419 1 16 . 1 1 90 90 LYS CA C 115 59.568 59.568 58.698 0.870 17865
10420 1 16 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.457 -0.236 17865
10421 1 16 . 1 1 90 90 LYS H H 115 7.936 7.936 7.669 0.267 17865
10422 1 16 . 1 1 91 91 ASP N N 116 121.690 121.690 120.310 1.380 17865
10423 1 16 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.627 -0.114 17865
10424 1 16 . 1 1 91 91 ASP C C 116 179.419 179.419 178.418 1.001 17865
10425 1 16 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.981 0.256 17865
10426 1 16 . 1 1 91 91 ASP CB C 116 40.648 40.648 41.026 -0.378 17865
10427 1 16 . 1 1 91 91 ASP H H 116 8.558 8.558 7.632 0.926 17865
10428 1 16 . 1 1 92 92 ALA N N 117 122.784 122.784 123.623 -0.839 17865
10429 1 16 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.164 -0.141 17865
10430 1 16 . 1 1 92 92 ALA C C 117 178.789 178.789 178.865 -0.076 17865
10431 1 16 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.362 -0.312 17865
10432 1 16 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.576 0.599 17865
10433 1 16 . 1 1 92 92 ALA H H 117 8.703 8.703 8.415 0.288 17865
10434 1 16 . 1 1 93 93 GLN N N 118 115.510 115.510 117.052 -1.542 17865
10435 1 16 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.147 -0.203 17865
10436 1 16 . 1 1 93 93 GLN C C 118 178.745 178.745 177.001 1.744 17865
10437 1 16 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.940 0.542 17865
10438 1 16 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.585 -0.188 17865
10439 1 16 . 1 1 93 93 GLN H H 118 7.664 7.664 8.296 -0.632 17865
10440 1 16 . 1 1 94 94 THR N N 119 110.110 110.110 114.182 -4.072 17865
10441 1 16 . 1 1 94 94 THR HA H 119 4.237 4.237 4.301 -0.064 17865
10442 1 16 . 1 1 94 94 THR C C 119 175.861 175.861 175.878 -0.017 17865
10443 1 16 . 1 1 94 94 THR CA C 119 64.604 64.604 65.693 -1.089 17865
10444 1 16 . 1 1 94 94 THR CB C 119 69.716 69.716 68.712 1.004 17865
10445 1 16 . 1 1 94 94 THR H H 119 7.726 7.726 7.469 0.257 17865
10446 1 16 . 1 1 95 95 CYS N N 120 118.523 118.523 120.270 -1.747 17865
10447 1 16 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.344 0.389 17865
10448 1 16 . 1 1 95 95 CYS C C 120 175.165 175.165 175.041 0.124 17865
10449 1 16 . 1 1 95 95 CYS CA C 120 52.973 52.973 59.304 -6.331 17865
10450 1 16 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.828 11.903 17865
10451 1 16 . 1 1 95 95 CYS H H 120 7.756 7.756 8.384 -0.628 17865
10452 1 16 . 1 1 96 96 ASP N N 121 119.081 119.081 123.653 -4.572 17865
10453 1 16 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.372 0.306 17865
10454 1 16 . 1 1 96 96 ASP CA C 121 56.224 56.224 57.041 -0.818 17865
10455 1 16 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.053 1.678 17865
10456 1 16 . 1 1 96 96 ASP H H 121 7.354 7.354 8.628 -1.274 17865
10457 1 16 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.497 -0.922 17865
10458 1 16 . 1 1 97 97 LYS C C 122 175.510 175.510 177.340 -1.830 17865
10459 1 16 . 1 1 97 97 LYS CA C 122 57.839 57.839 56.578 1.262 17865
10460 1 16 . 1 1 97 97 LYS CB C 122 30.750 30.750 33.531 -2.781 17865
10461 1 16 . 1 1 98 98 LYS N N 123 119.980 119.980 118.170 1.810 17865
10462 1 16 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.483 -0.189 17865
10463 1 16 . 1 1 98 98 LYS C C 123 176.968 176.968 177.857 -0.889 17865
10464 1 16 . 1 1 98 98 LYS CA C 123 55.904 55.904 57.318 -1.414 17865
10465 1 16 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.623 -0.391 17865
10466 1 16 . 1 1 98 98 LYS H H 123 7.799 7.799 8.294 -0.495 17865
10467 1 16 . 1 1 99 99 TYR N N 124 122.378 122.378 122.230 0.148 17865
10468 1 16 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.150 -0.255 17865
10469 1 16 . 1 1 99 99 TYR C C 124 177.126 177.126 177.283 -0.157 17865
10470 1 16 . 1 1 99 99 TYR CA C 124 60.211 60.211 61.188 -0.977 17865
10471 1 16 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.707 -0.436 17865
10472 1 16 . 1 1 99 99 TYR H H 124 8.536 8.536 8.313 0.223 17865
10473 1 16 . 1 1 100 100 GLU N N 125 118.610 118.610 117.296 1.314 17865
10474 1 16 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.083 0.185 17865
10475 1 16 . 1 1 100 100 GLU C C 125 177.387 177.387 178.295 -0.908 17865
10476 1 16 . 1 1 100 100 GLU CA C 125 55.759 55.759 56.648 -0.889 17865
10477 1 16 . 1 1 100 100 GLU CB C 125 27.321 27.321 29.279 -1.958 17865
10478 1 16 . 1 1 100 100 GLU H H 125 8.385 8.385 8.593 -0.208 17865
10479 1 16 . 1 1 101 101 SER N N 126 115.949 115.949 116.635 -0.686 17865
10480 1 16 . 1 1 101 101 SER HA H 126 3.959 3.959 4.099 -0.140 17865
10481 1 16 . 1 1 101 101 SER C C 126 176.047 176.047 176.077 -0.030 17865
10482 1 16 . 1 1 101 101 SER CA C 126 62.439 62.439 61.642 0.797 17865
10483 1 16 . 1 1 101 101 SER CB C 126 63.299 63.299 62.886 0.412 17865
10484 1 16 . 1 1 101 101 SER H H 126 7.823 7.823 7.613 0.210 17865
10485 1 16 . 1 1 102 102 ASP N N 127 120.920 120.920 120.908 0.012 17865
10486 1 16 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.280 0.127 17865
10487 1 16 . 1 1 102 102 ASP C C 127 178.234 178.234 178.507 -0.273 17865
10488 1 16 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.629 -0.218 17865
10489 1 16 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.422 -0.706 17865
10490 1 16 . 1 1 102 102 ASP H H 127 8.683 8.683 7.728 0.955 17865
10491 1 16 . 1 1 103 103 LYS N N 128 121.753 121.753 118.917 2.836 17865
10492 1 16 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.075 -0.071 17865
10493 1 16 . 1 1 103 103 LYS C C 128 179.395 179.395 178.901 0.494 17865
10494 1 16 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.556 0.915 17865
10495 1 16 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.900 0.501 17865
10496 1 16 . 1 1 103 103 LYS H H 128 7.771 7.771 7.825 -0.054 17865
10497 1 16 . 1 1 104 104 CYS N N 129 120.109 120.109 120.284 -0.175 17865
10498 1 16 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.220 -0.026 17865
10499 1 16 . 1 1 104 104 CYS C C 129 176.779 176.779 176.613 0.166 17865
10500 1 16 . 1 1 104 104 CYS CA C 129 59.790 59.790 61.790 -2.000 17865
10501 1 16 . 1 1 104 104 CYS CB C 129 36.879 36.879 25.869 11.010 17865
10502 1 16 . 1 1 104 104 CYS H H 129 7.973 7.973 8.047 -0.074 17865
10503 1 16 . 1 1 105 105 LEU N N 130 121.804 121.804 122.230 -0.426 17865
10504 1 16 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.861 0.229 17865
10505 1 16 . 1 1 105 105 LEU C C 130 179.373 179.373 178.570 0.803 17865
10506 1 16 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.465 -1.097 17865
10507 1 16 . 1 1 105 105 LEU CB C 130 42.098 42.098 42.021 0.077 17865
10508 1 16 . 1 1 105 105 LEU H H 130 8.666 8.666 8.597 0.069 17865
10509 1 16 . 1 1 106 106 ASN N N 131 118.535 118.535 116.485 2.050 17865
10510 1 16 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.397 -0.159 17865
10511 1 16 . 1 1 106 106 ASN C C 131 177.830 177.830 177.406 0.424 17865
10512 1 16 . 1 1 106 106 ASN CA C 131 56.256 56.256 55.987 0.269 17865
10513 1 16 . 1 1 106 106 ASN CB C 131 37.817 37.817 37.918 -0.101 17865
10514 1 16 . 1 1 106 106 ASN H H 131 8.438 8.438 7.827 0.611 17865
10515 1 16 . 1 1 107 107 ALA N N 132 121.485 121.485 123.802 -2.317 17865
10516 1 16 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.304 -0.085 17865
10517 1 16 . 1 1 107 107 ALA C C 132 180.726 180.726 179.341 1.385 17865
10518 1 16 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.408 0.555 17865
10519 1 16 . 1 1 107 107 ALA CB C 132 17.821 17.821 19.036 -1.215 17865
10520 1 16 . 1 1 107 107 ALA H H 132 7.541 7.541 7.177 0.364 17865
10521 1 16 . 1 1 108 108 ILE N N 133 120.979 120.979 118.750 2.229 17865
10522 1 16 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.366 0.565 17865
10523 1 16 . 1 1 108 108 ILE C C 133 178.114 178.114 177.858 0.256 17865
10524 1 16 . 1 1 108 108 ILE CA C 133 63.353 63.353 64.465 -1.112 17865
10525 1 16 . 1 1 108 108 ILE CB C 133 36.454 36.454 36.840 -0.386 17865
10526 1 16 . 1 1 108 108 ILE H H 133 7.551 7.551 8.602 -1.051 17865
10527 1 16 . 1 1 109 109 LYS N N 134 121.415 121.415 118.048 3.367 17865
10528 1 16 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.062 -0.474 17865
10529 1 16 . 1 1 109 109 LYS C C 134 179.561 179.561 177.245 2.316 17865
10530 1 16 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.199 0.909 17865
10531 1 16 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.162 -0.001 17865
10532 1 16 . 1 1 109 109 LYS H H 134 8.414 8.414 7.536 0.878 17865
10533 1 16 . 1 1 110 110 GLU N N 135 116.099 116.099 118.364 -2.265 17865
10534 1 16 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.175 -0.246 17865
10535 1 16 . 1 1 110 110 GLU C C 135 178.239 178.239 179.413 -1.174 17865
10536 1 16 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.268 0.378 17865
10537 1 16 . 1 1 110 110 GLU CB C 135 29.638 29.638 29.166 0.472 17865
10538 1 16 . 1 1 110 110 GLU H H 135 7.473 7.473 7.488 -0.015 17865
10539 1 16 . 1 1 111 111 LYS N N 136 119.805 119.805 120.591 -0.786 17865
10540 1 16 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.034 -0.128 17865
10541 1 16 . 1 1 111 111 LYS C C 136 177.600 177.600 178.081 -0.481 17865
10542 1 16 . 1 1 111 111 LYS CA C 136 58.749 58.749 58.528 0.221 17865
10543 1 16 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.472 0.766 17865
10544 1 16 . 1 1 111 111 LYS H H 136 7.540 7.540 8.224 -0.684 17865
10545 1 16 . 1 1 112 112 TYR N N 137 114.768 114.768 114.930 -0.162 17865
10546 1 16 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.608 -0.085 17865
10547 1 16 . 1 1 112 112 TYR C C 137 174.690 174.690 175.186 -0.496 17865
10548 1 16 . 1 1 112 112 TYR CA C 137 58.359 58.359 56.256 2.103 17865
10549 1 16 . 1 1 112 112 TYR CB C 137 38.328 38.328 36.865 1.463 17865
10550 1 16 . 1 1 112 112 TYR H H 137 7.488 7.488 7.173 0.315 17865
10551 1 16 . 1 1 113 113 LYS N N 138 123.694 123.694 123.212 0.482 17865
10552 1 16 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.456 0.045 17865
10553 1 16 . 1 1 113 113 LYS CA C 138 55.282 55.282 54.866 0.416 17865
10554 1 16 . 1 1 113 113 LYS CB C 138 32.124 32.124 33.278 -1.154 17865
10555 1 16 . 1 1 113 113 LYS H H 138 7.217 7.217 7.194 0.023 17865
10556 1 16 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.575 -0.123 17865
10557 1 16 . 1 1 114 114 PRO C C 139 176.974 176.974 176.188 0.786 17865
10558 1 16 . 1 1 114 114 PRO CA C 139 63.189 63.189 62.734 0.455 17865
10559 1 16 . 1 1 114 114 PRO CB C 139 32.251 32.251 30.130 2.121 17865
10560 1 16 . 1 1 115 115 VAL N N 140 121.098 121.098 118.034 3.064 17865
10561 1 16 . 1 1 115 115 VAL HA H 140 4.102 4.102 3.830 0.272 17865
10562 1 16 . 1 1 115 115 VAL C C 140 176.207 176.207 176.355 -0.148 17865
10563 1 16 . 1 1 115 115 VAL CA C 140 62.356 62.356 63.709 -1.353 17865
10564 1 16 . 1 1 115 115 VAL CB C 140 33.256 33.256 31.706 1.550 17865
10565 1 16 . 1 1 115 115 VAL H H 140 8.272 8.272 7.795 0.477 17865
10566 1 16 . 1 1 116 116 VAL N N 141 124.167 124.167 120.379 3.788 17865
10567 1 16 . 1 1 116 116 VAL HA H 141 4.122 4.122 3.925 0.197 17865
10568 1 16 . 1 1 116 116 VAL C C 141 175.415 175.415 176.155 -0.740 17865
10569 1 16 . 1 1 116 116 VAL CA C 141 61.731 61.731 62.830 -1.099 17865
10570 1 16 . 1 1 116 116 VAL CB C 141 33.145 33.145 32.063 1.082 17865
10571 1 16 . 1 1 116 116 VAL H H 141 8.142 8.142 7.720 0.422 17865
10572 1 16 . 1 1 117 117 ASP N N 142 126.737 126.737 126.439 0.298 17865
10573 1 16 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.648 0.164 17865
10574 1 16 . 1 1 117 117 ASP CA C 142 52.217 52.217 52.283 -0.066 17865
10575 1 16 . 1 1 117 117 ASP CB C 142 41.368 41.368 40.423 0.945 17865
10576 1 16 . 1 1 117 117 ASP H H 142 8.419 8.419 8.202 0.217 17865
10577 1 16 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.340 0.071 17865
10578 1 16 . 1 1 118 118 PRO C C 143 176.662 176.662 176.424 0.238 17865
10579 1 16 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.575 -0.328 17865
10580 1 16 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.123 0.187 17865
10581 1 16 . 1 1 119 119 ASN N N 144 119.287 119.287 120.544 -1.257 17865
10582 1 16 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.719 0.228 17865
10583 1 16 . 1 1 119 119 ASN CA C 144 51.633 51.633 52.297 -0.664 17865
10584 1 16 . 1 1 119 119 ASN CB C 144 38.859 38.859 38.738 0.121 17865
10585 1 16 . 1 1 119 119 ASN H H 144 8.432 8.432 8.390 0.042 17865
10586 1 16 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.584 0.096 17865
10587 1 16 . 1 1 120 120 PRO CA C 145 61.640 61.640 62.281 -0.641 17865
10588 1 16 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.063 -0.145 17865
10589 1 16 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.477 -0.100 17865
10590 1 16 . 1 1 121 121 PRO C C 146 175.876 175.876 175.679 0.197 17865
10591 1 16 . 1 1 121 121 PRO CA C 146 63.174 63.174 62.766 0.408 17865
10592 1 16 . 1 1 121 121 PRO CB C 146 31.939 31.939 32.542 -0.603 17865
10593 1 17 . 1 1 2 2 ASP N N 27 121.041 121.041 122.798 -1.757 17865
10594 1 17 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.862 -0.224 17865
10595 1 17 . 1 1 2 2 ASP C C 27 175.878 175.878 175.026 0.852 17865
10596 1 17 . 1 1 2 2 ASP CA C 27 54.382 54.382 54.196 0.186 17865
10597 1 17 . 1 1 2 2 ASP CB C 27 41.729 41.729 41.172 0.556 17865
10598 1 17 . 1 1 2 2 ASP H H 27 8.639 8.639 8.479 0.160 17865
10599 1 17 . 1 1 3 3 VAL N N 28 119.901 119.901 122.992 -3.091 17865
10600 1 17 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.089 -0.056 17865
10601 1 17 . 1 1 3 3 VAL C C 28 175.521 175.521 174.158 1.363 17865
10602 1 17 . 1 1 3 3 VAL CA C 28 62.216 62.216 62.578 -0.362 17865
10603 1 17 . 1 1 3 3 VAL CB C 28 33.003 33.003 34.085 -1.082 17865
10604 1 17 . 1 1 3 3 VAL H H 28 8.113 8.113 8.111 0.002 17865
10605 1 17 . 1 1 4 4 PHE N N 29 123.707 123.707 125.949 -2.242 17865
10606 1 17 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.706 -0.050 17865
10607 1 17 . 1 1 4 4 PHE C C 29 174.874 174.874 175.529 -0.655 17865
10608 1 17 . 1 1 4 4 PHE CA C 29 57.159 57.159 57.111 0.048 17865
10609 1 17 . 1 1 4 4 PHE CB C 29 39.795 39.795 39.897 -0.102 17865
10610 1 17 . 1 1 4 4 PHE H H 29 8.255 8.255 8.391 -0.136 17865
10611 1 17 . 1 1 5 5 ASP N N 30 124.203 124.203 126.344 -2.141 17865
10612 1 17 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.698 0.140 17865
10613 1 17 . 1 1 5 5 ASP CA C 30 52.385 52.385 52.794 -0.409 17865
10614 1 17 . 1 1 5 5 ASP CB C 30 40.801 40.801 42.234 -1.433 17865
10615 1 17 . 1 1 5 5 ASP H H 30 8.226 8.226 8.478 -0.252 17865
10616 1 17 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.594 -0.057 17865
10617 1 17 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.071 -0.407 17865
10618 1 17 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.366 -0.540 17865
10619 1 17 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.384 0.042 17865
10620 1 17 . 1 1 7 7 PRO C C 32 177.226 177.226 176.667 0.559 17865
10621 1 17 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.383 -0.214 17865
10622 1 17 . 1 1 7 7 PRO CB C 32 31.948 31.948 32.196 -0.248 17865
10623 1 17 . 1 1 8 8 THR N N 33 114.158 114.158 116.259 -2.101 17865
10624 1 17 . 1 1 8 8 THR HA H 33 4.195 4.195 4.568 -0.373 17865
10625 1 17 . 1 1 8 8 THR C C 33 174.468 174.468 173.730 0.738 17865
10626 1 17 . 1 1 8 8 THR CA C 33 62.110 62.110 61.342 0.768 17865
10627 1 17 . 1 1 8 8 THR CB C 33 69.975 69.975 72.128 -2.153 17865
10628 1 17 . 1 1 8 8 THR H H 33 8.096 8.096 8.084 0.012 17865
10629 1 17 . 1 1 9 9 GLN N N 34 122.411 122.411 123.643 -1.232 17865
10630 1 17 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.465 -0.202 17865
10631 1 17 . 1 1 9 9 GLN C C 34 175.445 175.445 174.293 1.152 17865
10632 1 17 . 1 1 9 9 GLN CA C 34 55.763 55.763 55.171 0.592 17865
10633 1 17 . 1 1 9 9 GLN CB C 34 29.691 29.691 27.650 2.041 17865
10634 1 17 . 1 1 9 9 GLN H H 34 8.278 8.278 8.633 -0.355 17865
10635 1 17 . 1 1 10 10 TYR N N 35 121.048 121.048 119.979 1.069 17865
10636 1 17 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.518 0.002 17865
10637 1 17 . 1 1 10 10 TYR C C 35 176.314 176.314 173.970 2.344 17865
10638 1 17 . 1 1 10 10 TYR CA C 35 57.972 57.972 56.494 1.478 17865
10639 1 17 . 1 1 10 10 TYR CB C 35 38.936 38.936 40.414 -1.478 17865
10640 1 17 . 1 1 10 10 TYR H H 35 8.227 8.227 7.412 0.815 17865
10641 1 17 . 1 1 11 11 GLY N N 36 109.711 109.711 109.227 0.484 17865
10642 1 17 . 1 1 11 11 GLY C C 36 174.128 174.128 172.569 1.559 17865
10643 1 17 . 1 1 11 11 GLY CA C 36 45.212 45.212 44.561 0.651 17865
10644 1 17 . 1 1 11 11 GLY H H 36 8.247 8.247 7.257 0.990 17865
10645 1 17 . 1 1 12 12 TYR N N 37 120.302 120.302 115.726 4.576 17865
10646 1 17 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.910 -0.428 17865
10647 1 17 . 1 1 12 12 TYR C C 37 175.864 175.864 174.317 1.547 17865
10648 1 17 . 1 1 12 12 TYR CA C 37 58.541 58.541 54.293 4.248 17865
10649 1 17 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.565 -0.850 17865
10650 1 17 . 1 1 12 12 TYR H H 37 8.101 8.101 6.865 1.236 17865
10651 1 17 . 1 1 13 13 ASP N N 38 121.883 121.883 121.958 -0.075 17865
10652 1 17 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.576 -0.090 17865
10653 1 17 . 1 1 13 13 ASP C C 38 176.538 176.538 176.550 -0.012 17865
10654 1 17 . 1 1 13 13 ASP CA C 38 54.223 54.223 53.851 0.372 17865
10655 1 17 . 1 1 13 13 ASP CB C 38 40.988 40.988 39.909 1.079 17865
10656 1 17 . 1 1 13 13 ASP H H 38 8.266 8.266 8.644 -0.378 17865
10657 1 17 . 1 1 14 14 GLY N N 39 107.705 107.705 115.548 -7.843 17865
10658 1 17 . 1 1 14 14 GLY C C 39 173.822 173.822 173.297 0.525 17865
10659 1 17 . 1 1 14 14 GLY CA C 39 45.404 45.404 44.864 0.540 17865
10660 1 17 . 1 1 14 14 GLY H H 39 7.647 7.647 8.055 -0.408 17865
10661 1 17 . 1 1 15 15 LYS N N 40 121.621 121.621 122.134 -0.513 17865
10662 1 17 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.986 -0.411 17865
10663 1 17 . 1 1 15 15 LYS CA C 40 54.100 54.100 53.959 0.141 17865
10664 1 17 . 1 1 15 15 LYS CB C 40 32.510 32.510 34.923 -2.413 17865
10665 1 17 . 1 1 15 15 LYS H H 40 7.908 7.908 8.650 -0.742 17865
10666 1 17 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.169 0.183 17865
10667 1 17 . 1 1 16 16 PRO C C 41 176.806 176.806 176.978 -0.172 17865
10668 1 17 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.810 -0.052 17865
10669 1 17 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.447 -0.133 17865
10670 1 17 . 1 1 17 17 LEU N N 42 123.488 123.488 123.738 -0.250 17865
10671 1 17 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.150 -0.101 17865
10672 1 17 . 1 1 17 17 LEU C C 42 174.973 174.973 176.479 -1.506 17865
10673 1 17 . 1 1 17 17 LEU CA C 42 55.436 55.436 56.032 -0.596 17865
10674 1 17 . 1 1 17 17 LEU CB C 42 42.093 42.093 40.615 1.478 17865
10675 1 17 . 1 1 17 17 LEU H H 42 8.499 8.499 8.340 0.159 17865
10676 1 17 . 1 1 18 18 ASP N N 43 123.354 123.354 125.001 -1.647 17865
10677 1 17 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.796 -0.298 17865
10678 1 17 . 1 1 18 18 ASP C C 43 175.947 175.947 176.221 -0.274 17865
10679 1 17 . 1 1 18 18 ASP CA C 43 52.858 52.858 53.149 -0.291 17865
10680 1 17 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.748 -2.527 17865
10681 1 17 . 1 1 18 18 ASP H H 43 7.789 7.789 8.758 -0.969 17865
10682 1 17 . 1 1 19 19 ALA N N 44 120.147 120.147 122.557 -2.410 17865
10683 1 17 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.155 -0.169 17865
10684 1 17 . 1 1 19 19 ALA C C 44 179.476 179.476 179.419 0.057 17865
10685 1 17 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.305 0.858 17865
10686 1 17 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.862 -0.475 17865
10687 1 17 . 1 1 19 19 ALA H H 44 8.561 8.561 8.542 0.019 17865
10688 1 17 . 1 1 20 20 SER N N 45 115.037 115.037 115.682 -0.645 17865
10689 1 17 . 1 1 20 20 SER HA H 45 4.151 4.151 4.017 0.134 17865
10690 1 17 . 1 1 20 20 SER C C 45 177.191 177.191 176.445 0.746 17865
10691 1 17 . 1 1 20 20 SER CA C 45 61.629 61.629 60.861 0.768 17865
10692 1 17 . 1 1 20 20 SER CB C 45 62.804 62.804 62.635 0.169 17865
10693 1 17 . 1 1 20 20 SER H H 45 8.466 8.466 8.125 0.341 17865
10694 1 17 . 1 1 21 21 PHE N N 46 125.030 125.030 120.398 4.632 17865
10695 1 17 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.465 -0.234 17865
10696 1 17 . 1 1 21 21 PHE C C 46 176.850 176.850 177.122 -0.272 17865
10697 1 17 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.454 0.352 17865
10698 1 17 . 1 1 21 21 PHE CB C 46 39.881 39.881 38.662 1.219 17865
10699 1 17 . 1 1 21 21 PHE H H 46 8.034 8.034 7.489 0.545 17865
10700 1 17 . 1 1 22 22 CYS N N 47 113.943 113.943 116.120 -2.177 17865
10701 1 17 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.420 -0.169 17865
10702 1 17 . 1 1 22 22 CYS C C 47 176.449 176.449 175.872 0.577 17865
10703 1 17 . 1 1 22 22 CYS CA C 47 53.600 53.600 58.725 -5.125 17865
10704 1 17 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.928 10.463 17865
10705 1 17 . 1 1 22 22 CYS H H 47 7.691 7.691 7.890 -0.199 17865
10706 1 17 . 1 1 23 23 ARG N N 48 119.958 119.958 121.296 -1.338 17865
10707 1 17 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.088 -0.008 17865
10708 1 17 . 1 1 23 23 ARG C C 48 177.904 177.904 177.857 0.047 17865
10709 1 17 . 1 1 23 23 ARG CA C 48 58.907 58.907 58.414 0.493 17865
10710 1 17 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.352 0.819 17865
10711 1 17 . 1 1 23 23 ARG H H 48 7.628 7.628 7.507 0.121 17865
10712 1 17 . 1 1 24 24 THR N N 49 106.445 106.445 112.842 -6.397 17865
10713 1 17 . 1 1 24 24 THR HA H 49 4.385 4.385 4.242 0.143 17865
10714 1 17 . 1 1 24 24 THR C C 49 174.758 174.758 174.654 0.104 17865
10715 1 17 . 1 1 24 24 THR CA C 49 61.573 61.573 64.166 -2.593 17865
10716 1 17 . 1 1 24 24 THR CB C 49 68.794 68.794 68.606 0.188 17865
10717 1 17 . 1 1 24 24 THR H H 49 7.307 7.307 7.718 -0.411 17865
10718 1 17 . 1 1 25 25 ALA N N 50 122.242 122.242 121.311 0.931 17865
10719 1 17 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.276 0.128 17865
10720 1 17 . 1 1 25 25 ALA C C 50 178.554 178.554 178.983 -0.429 17865
10721 1 17 . 1 1 25 25 ALA CA C 50 52.381 52.381 53.527 -1.146 17865
10722 1 17 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.344 -0.949 17865
10723 1 17 . 1 1 25 25 ALA H H 50 7.401 7.401 7.196 0.205 17865
10724 1 17 . 1 1 26 26 GLY N N 51 110.604 110.604 106.844 3.760 17865
10725 1 17 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.874 0.148 17865
10726 1 17 . 1 1 26 26 GLY H H 51 8.285 8.285 7.935 0.350 17865
10727 1 17 . 1 1 27 27 SER HA H 52 4.382 4.382 4.397 -0.015 17865
10728 1 17 . 1 1 27 27 SER C C 52 175.774 175.774 175.106 0.668 17865
10729 1 17 . 1 1 27 27 SER CA C 52 60.803 60.803 60.617 0.186 17865
10730 1 17 . 1 1 27 27 SER CB C 52 62.827 62.827 62.926 -0.099 17865
10731 1 17 . 1 1 28 28 ARG N N 53 119.682 119.682 117.356 2.326 17865
10732 1 17 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.976 -0.096 17865
10733 1 17 . 1 1 28 28 ARG C C 53 175.796 175.796 175.875 -0.079 17865
10734 1 17 . 1 1 28 28 ARG CA C 53 55.738 55.738 55.080 0.658 17865
10735 1 17 . 1 1 28 28 ARG CB C 53 30.237 30.237 30.050 0.187 17865
10736 1 17 . 1 1 28 28 ARG H H 53 7.894 7.894 7.929 -0.035 17865
10737 1 17 . 1 1 29 29 GLU N N 54 122.318 122.318 122.359 -0.041 17865
10738 1 17 . 1 1 29 29 GLU HA H 54 3.595 3.595 4.063 -0.468 17865
10739 1 17 . 1 1 29 29 GLU C C 54 177.523 177.523 177.747 -0.224 17865
10740 1 17 . 1 1 29 29 GLU CA C 54 61.223 61.223 60.268 0.955 17865
10741 1 17 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.579 -0.642 17865
10742 1 17 . 1 1 29 29 GLU H H 54 7.730 7.730 8.026 -0.296 17865
10743 1 17 . 1 1 30 30 LYS N N 55 118.377 118.377 118.422 -0.045 17865
10744 1 17 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.006 -0.178 17865
10745 1 17 . 1 1 30 30 LYS C C 55 179.205 179.205 179.028 0.177 17865
10746 1 17 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.836 0.591 17865
10747 1 17 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.114 -0.513 17865
10748 1 17 . 1 1 30 30 LYS H H 55 8.659 8.659 8.176 0.483 17865
10749 1 17 . 1 1 31 31 ASP N N 56 121.614 121.614 119.892 1.722 17865
10750 1 17 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.451 -0.140 17865
10751 1 17 . 1 1 31 31 ASP C C 56 177.393 177.393 178.141 -0.748 17865
10752 1 17 . 1 1 31 31 ASP CA C 56 57.316 57.316 58.144 -0.828 17865
10753 1 17 . 1 1 31 31 ASP CB C 56 40.423 40.423 40.464 -0.041 17865
10754 1 17 . 1 1 31 31 ASP H H 56 7.646 7.646 8.062 -0.416 17865
10755 1 17 . 1 1 32 32 CYS N N 57 120.345 120.345 119.690 0.655 17865
10756 1 17 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.807 -0.206 17865
10757 1 17 . 1 1 32 32 CYS C C 57 175.772 175.772 176.514 -0.742 17865
10758 1 17 . 1 1 32 32 CYS CA C 57 60.197 60.197 61.412 -1.215 17865
10759 1 17 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.938 8.028 17865
10760 1 17 . 1 1 32 32 CYS H H 57 8.042 8.042 7.947 0.095 17865
10761 1 17 . 1 1 33 33 ARG N N 58 120.293 120.293 119.392 0.901 17865
10762 1 17 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.959 -0.283 17865
10763 1 17 . 1 1 33 33 ARG C C 58 179.633 179.633 178.653 0.980 17865
10764 1 17 . 1 1 33 33 ARG CA C 58 60.386 60.386 58.992 1.394 17865
10765 1 17 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.370 0.471 17865
10766 1 17 . 1 1 33 33 ARG H H 58 8.531 8.531 8.563 -0.032 17865
10767 1 17 . 1 1 34 34 LYS N N 59 121.166 121.166 120.014 1.152 17865
10768 1 17 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.137 -0.101 17865
10769 1 17 . 1 1 34 34 LYS C C 59 179.220 179.220 178.553 0.667 17865
10770 1 17 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.884 0.646 17865
10771 1 17 . 1 1 34 34 LYS CB C 59 32.110 32.110 32.286 -0.176 17865
10772 1 17 . 1 1 34 34 LYS H H 59 7.633 7.633 7.692 -0.059 17865
10773 1 17 . 1 1 35 35 ASP N N 60 122.166 122.166 119.627 2.539 17865
10774 1 17 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.489 -0.058 17865
10775 1 17 . 1 1 35 35 ASP C C 60 179.709 179.709 178.706 1.003 17865
10776 1 17 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.026 0.677 17865
10777 1 17 . 1 1 35 35 ASP CB C 60 40.672 40.672 41.007 -0.335 17865
10778 1 17 . 1 1 35 35 ASP H H 60 8.221 8.221 8.276 -0.055 17865
10779 1 17 . 1 1 36 36 VAL N N 61 121.312 121.312 117.406 3.906 17865
10780 1 17 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.815 -0.414 17865
10781 1 17 . 1 1 36 36 VAL C C 61 178.339 178.339 178.390 -0.051 17865
10782 1 17 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.812 1.321 17865
10783 1 17 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.478 0.179 17865
10784 1 17 . 1 1 36 36 VAL H H 61 8.916 8.916 8.170 0.746 17865
10785 1 17 . 1 1 37 37 GLN N N 62 119.166 119.166 118.563 0.603 17865
10786 1 17 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.138 -0.196 17865
10787 1 17 . 1 1 37 37 GLN C C 62 177.293 177.293 177.168 0.125 17865
10788 1 17 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.367 0.913 17865
10789 1 17 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.080 0.291 17865
10790 1 17 . 1 1 37 37 GLN H H 62 7.697 7.697 7.556 0.141 17865
10791 1 17 . 1 1 38 38 ALA N N 63 118.964 118.964 119.856 -0.892 17865
10792 1 17 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.269 -0.027 17865
10793 1 17 . 1 1 38 38 ALA C C 63 177.221 177.221 177.160 0.061 17865
10794 1 17 . 1 1 38 38 ALA CA C 63 53.137 53.137 52.600 0.537 17865
10795 1 17 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.103 -0.206 17865
10796 1 17 . 1 1 38 38 ALA H H 63 7.508 7.508 7.592 -0.084 17865
10797 1 17 . 1 1 39 39 CYS N N 64 119.081 119.081 118.650 0.431 17865
10798 1 17 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.589 0.364 17865
10799 1 17 . 1 1 39 39 CYS C C 64 172.052 172.052 174.880 -2.828 17865
10800 1 17 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.991 -7.111 17865
10801 1 17 . 1 1 39 39 CYS CB C 64 34.328 34.328 26.753 7.575 17865
10802 1 17 . 1 1 39 39 CYS H H 64 7.354 7.354 7.517 -0.163 17865
10803 1 17 . 1 1 40 40 ASP N N 65 124.167 124.167 126.180 -2.013 17865
10804 1 17 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.528 -0.203 17865
10805 1 17 . 1 1 40 40 ASP C C 65 176.496 176.496 176.986 -0.490 17865
10806 1 17 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.552 0.172 17865
10807 1 17 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.353 -0.040 17865
10808 1 17 . 1 1 40 40 ASP H H 65 8.142 8.142 8.686 -0.544 17865
10809 1 17 . 1 1 41 41 LYS N N 66 118.844 118.844 121.000 -2.156 17865
10810 1 17 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.447 0.077 17865
10811 1 17 . 1 1 41 41 LYS C C 66 175.586 175.586 176.602 -1.016 17865
10812 1 17 . 1 1 41 41 LYS CA C 66 55.275 55.275 55.990 -0.715 17865
10813 1 17 . 1 1 41 41 LYS CB C 66 32.598 32.598 31.268 1.330 17865
10814 1 17 . 1 1 41 41 LYS H H 66 7.858 7.858 8.333 -0.475 17865
10815 1 17 . 1 1 42 42 LYS N N 67 126.081 126.081 120.686 5.395 17865
10816 1 17 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.134 -0.219 17865
10817 1 17 . 1 1 42 42 LYS C C 67 174.665 174.665 174.972 -0.307 17865
10818 1 17 . 1 1 42 42 LYS CA C 67 57.827 57.827 56.997 0.830 17865
10819 1 17 . 1 1 42 42 LYS CB C 67 34.059 34.059 33.023 1.036 17865
10820 1 17 . 1 1 42 42 LYS H H 67 8.790 8.790 7.914 0.876 17865
10821 1 17 . 1 1 43 43 TYR N N 68 114.138 114.138 116.861 -2.723 17865
10822 1 17 . 1 1 43 43 TYR HA H 68 5.259 5.259 5.125 0.134 17865
10823 1 17 . 1 1 43 43 TYR C C 68 175.767 175.767 174.622 1.145 17865
10824 1 17 . 1 1 43 43 TYR CA C 68 55.880 55.880 56.489 -0.609 17865
10825 1 17 . 1 1 43 43 TYR CB C 68 42.363 42.363 41.978 0.385 17865
10826 1 17 . 1 1 43 43 TYR H H 68 7.294 7.294 7.374 -0.080 17865
10827 1 17 . 1 1 44 44 ASP N N 69 121.807 121.807 121.423 0.384 17865
10828 1 17 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.707 -0.067 17865
10829 1 17 . 1 1 44 44 ASP C C 69 177.812 177.812 177.335 0.477 17865
10830 1 17 . 1 1 44 44 ASP CA C 69 52.110 52.110 52.889 -0.779 17865
10831 1 17 . 1 1 44 44 ASP CB C 69 41.440 41.440 42.575 -1.135 17865
10832 1 17 . 1 1 44 44 ASP H H 69 8.995 8.995 9.083 -0.088 17865
10833 1 17 . 1 1 45 45 ASP N N 70 116.686 116.686 118.591 -1.905 17865
10834 1 17 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.524 -0.100 17865
10835 1 17 . 1 1 45 45 ASP C C 70 177.054 177.054 176.598 0.456 17865
10836 1 17 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.472 -0.091 17865
10837 1 17 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.664 -0.416 17865
10838 1 17 . 1 1 45 45 ASP H H 70 8.369 8.369 8.710 -0.341 17865
10839 1 17 . 1 1 46 46 GLN N N 71 117.949 117.949 117.354 0.595 17865
10840 1 17 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.469 -0.013 17865
10841 1 17 . 1 1 46 46 GLN C C 71 176.273 176.273 176.510 -0.237 17865
10842 1 17 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.005 0.362 17865
10843 1 17 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.597 -0.267 17865
10844 1 17 . 1 1 46 46 GLN H H 71 8.274 8.274 8.146 0.128 17865
10845 1 17 . 1 1 47 47 GLY N N 72 108.369 108.369 106.581 1.788 17865
10846 1 17 . 1 1 47 47 GLY C C 72 174.145 174.145 174.554 -0.409 17865
10847 1 17 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.261 0.562 17865
10848 1 17 . 1 1 47 47 GLY H H 72 8.174 8.174 7.732 0.442 17865
10849 1 17 . 1 1 48 48 ARG N N 73 121.554 121.554 118.724 2.830 17865
10850 1 17 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.879 -0.394 17865
10851 1 17 . 1 1 48 48 ARG C C 73 176.855 176.855 175.157 1.698 17865
10852 1 17 . 1 1 48 48 ARG CA C 73 55.289 55.289 53.022 2.267 17865
10853 1 17 . 1 1 48 48 ARG CB C 73 30.558 30.558 32.417 -1.859 17865
10854 1 17 . 1 1 48 48 ARG H H 73 8.462 8.462 9.327 -0.865 17865
10855 1 17 . 1 1 49 49 GLU N N 74 122.784 122.784 119.859 2.925 17865
10856 1 17 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.334 0.149 17865
10857 1 17 . 1 1 49 49 GLU C C 74 178.098 178.098 177.080 1.018 17865
10858 1 17 . 1 1 49 49 GLU CA C 74 57.184 57.184 56.655 0.529 17865
10859 1 17 . 1 1 49 49 GLU CB C 74 30.777 30.777 29.919 0.858 17865
10860 1 17 . 1 1 49 49 GLU H H 74 8.703 8.703 8.617 0.086 17865
10861 1 17 . 1 1 50 50 THR N N 75 114.563 114.563 114.332 0.231 17865
10862 1 17 . 1 1 50 50 THR HA H 75 4.212 4.212 4.340 -0.128 17865
10863 1 17 . 1 1 50 50 THR C C 75 175.170 175.170 175.548 -0.378 17865
10864 1 17 . 1 1 50 50 THR CA C 75 60.589 60.589 60.859 -0.270 17865
10865 1 17 . 1 1 50 50 THR CB C 75 70.952 70.952 69.898 1.054 17865
10866 1 17 . 1 1 50 50 THR H H 75 7.717 7.717 7.982 -0.265 17865
10867 1 17 . 1 1 51 51 ALA N N 76 122.097 122.097 122.485 -0.388 17865
10868 1 17 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.040 -0.002 17865
10869 1 17 . 1 1 51 51 ALA C C 76 181.906 181.906 179.253 2.653 17865
10870 1 17 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.043 0.611 17865
10871 1 17 . 1 1 51 51 ALA CB C 76 17.993 17.993 17.979 0.014 17865
10872 1 17 . 1 1 51 51 ALA H H 76 8.734 8.734 8.469 0.265 17865
10873 1 17 . 1 1 52 52 CYS N N 77 115.347 115.347 116.956 -1.609 17865
10874 1 17 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.246 0.234 17865
10875 1 17 . 1 1 52 52 CYS C C 77 176.299 176.299 176.832 -0.533 17865
10876 1 17 . 1 1 52 52 CYS CA C 77 57.701 57.701 60.333 -2.632 17865
10877 1 17 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.770 9.861 17865
10878 1 17 . 1 1 52 52 CYS H H 77 9.073 9.073 8.092 0.981 17865
10879 1 17 . 1 1 53 53 ALA N N 78 128.517 128.517 122.641 5.876 17865
10880 1 17 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.909 -0.054 17865
10881 1 17 . 1 1 53 53 ALA C C 78 178.736 178.736 179.096 -0.360 17865
10882 1 17 . 1 1 53 53 ALA CA C 78 55.633 55.633 54.828 0.805 17865
10883 1 17 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.990 1.201 17865
10884 1 17 . 1 1 53 53 ALA H H 78 7.174 7.174 7.861 -0.687 17865
10885 1 17 . 1 1 54 54 LYS N N 79 118.706 118.706 118.157 0.549 17865
10886 1 17 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.109 -0.306 17865
10887 1 17 . 1 1 54 54 LYS C C 79 179.611 179.611 178.618 0.993 17865
10888 1 17 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.339 1.386 17865
10889 1 17 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.273 0.380 17865
10890 1 17 . 1 1 54 54 LYS H H 79 8.313 8.313 7.887 0.426 17865
10891 1 17 . 1 1 55 55 GLY N N 80 104.822 104.822 106.979 -2.157 17865
10892 1 17 . 1 1 55 55 GLY C C 80 176.504 176.504 175.895 0.609 17865
10893 1 17 . 1 1 55 55 GLY CA C 80 46.839 46.839 46.816 0.023 17865
10894 1 17 . 1 1 55 55 GLY H H 80 8.175 8.175 7.510 0.665 17865
10895 1 17 . 1 1 56 56 ILE N N 81 123.697 123.697 122.721 0.976 17865
10896 1 17 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.813 -0.018 17865
10897 1 17 . 1 1 56 56 ILE C C 81 177.334 177.334 177.572 -0.238 17865
10898 1 17 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.564 0.717 17865
10899 1 17 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.999 0.336 17865
10900 1 17 . 1 1 56 56 ILE H H 81 7.590 7.590 7.081 0.509 17865
10901 1 17 . 1 1 57 57 ARG N N 82 118.161 118.161 118.125 0.036 17865
10902 1 17 . 1 1 57 57 ARG HA H 82 3.935 3.935 3.929 0.006 17865
10903 1 17 . 1 1 57 57 ARG C C 82 178.662 178.662 178.439 0.223 17865
10904 1 17 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.398 0.304 17865
10905 1 17 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.526 0.374 17865
10906 1 17 . 1 1 57 57 ARG H H 82 7.569 7.569 7.599 -0.030 17865
10907 1 17 . 1 1 58 58 GLU N N 83 115.085 115.085 119.296 -4.211 17865
10908 1 17 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.274 -0.243 17865
10909 1 17 . 1 1 58 58 GLU C C 83 178.224 178.224 178.989 -0.765 17865
10910 1 17 . 1 1 58 58 GLU CA C 83 58.304 58.304 58.522 -0.218 17865
10911 1 17 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.283 0.748 17865
10912 1 17 . 1 1 58 58 GLU H H 83 7.786 7.786 7.687 0.099 17865
10913 1 17 . 1 1 59 59 LYS N N 84 119.183 119.183 121.390 -2.207 17865
10914 1 17 . 1 1 59 59 LYS HA H 84 3.830 3.830 3.874 -0.044 17865
10915 1 17 . 1 1 59 59 LYS C C 84 177.933 177.933 179.096 -1.163 17865
10916 1 17 . 1 1 59 59 LYS CA C 84 59.043 59.043 59.190 -0.147 17865
10917 1 17 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.481 1.169 17865
10918 1 17 . 1 1 59 59 LYS H H 84 7.968 7.968 8.207 -0.239 17865
10919 1 17 . 1 1 60 60 TYR N N 85 113.663 113.663 115.175 -1.512 17865
10920 1 17 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.594 0.109 17865
10921 1 17 . 1 1 60 60 TYR C C 85 174.729 174.729 174.752 -0.023 17865
10922 1 17 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.515 0.687 17865
10923 1 17 . 1 1 60 60 TYR CB C 85 37.902 37.902 36.916 0.986 17865
10924 1 17 . 1 1 60 60 TYR H H 85 7.562 7.562 7.534 0.028 17865
10925 1 17 . 1 1 61 61 LYS N N 86 121.862 121.862 123.725 -1.863 17865
10926 1 17 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.179 0.333 17865
10927 1 17 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.204 -0.262 17865
10928 1 17 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.864 -0.762 17865
10929 1 17 . 1 1 61 61 LYS H H 86 7.222 7.222 7.320 -0.098 17865
10930 1 17 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.559 -0.236 17865
10931 1 17 . 1 1 62 62 PRO C C 87 176.576 176.576 176.179 0.397 17865
10932 1 17 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.095 0.925 17865
10933 1 17 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.704 -0.464 17865
10934 1 17 . 1 1 63 63 ALA N N 88 125.029 125.029 123.517 1.512 17865
10935 1 17 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.345 -0.091 17865
10936 1 17 . 1 1 63 63 ALA C C 88 177.301 177.301 176.442 0.859 17865
10937 1 17 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.158 0.123 17865
10938 1 17 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.448 1.754 17865
10939 1 17 . 1 1 63 63 ALA H H 88 8.329 8.329 8.016 0.313 17865
10940 1 17 . 1 1 64 64 VAL N N 89 121.843 121.843 118.532 3.311 17865
10941 1 17 . 1 1 64 64 VAL HA H 89 3.944 3.944 5.075 -1.131 17865
10942 1 17 . 1 1 64 64 VAL C C 89 174.791 174.791 175.465 -0.674 17865
10943 1 17 . 1 1 64 64 VAL CA C 89 61.981 61.981 59.586 2.395 17865
10944 1 17 . 1 1 64 64 VAL CB C 89 33.485 33.485 35.306 -1.821 17865
10945 1 17 . 1 1 64 64 VAL H H 89 8.075 8.075 7.618 0.457 17865
10946 1 17 . 1 1 65 65 VAL N N 90 125.399 125.399 120.498 4.901 17865
10947 1 17 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.106 0.032 17865
10948 1 17 . 1 1 65 65 VAL C C 90 174.340 174.340 174.800 -0.460 17865
10949 1 17 . 1 1 65 65 VAL CA C 90 61.162 61.162 63.312 -2.150 17865
10950 1 17 . 1 1 65 65 VAL CB C 90 33.866 33.866 30.495 3.371 17865
10951 1 17 . 1 1 65 65 VAL H H 90 8.229 8.229 8.426 -0.197 17865
10952 1 17 . 1 1 66 66 TYR N N 91 124.848 124.848 126.205 -1.357 17865
10953 1 17 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.673 0.098 17865
10954 1 17 . 1 1 66 66 TYR C C 91 176.658 176.658 175.418 1.240 17865
10955 1 17 . 1 1 66 66 TYR CA C 91 58.084 58.084 57.199 0.885 17865
10956 1 17 . 1 1 66 66 TYR CB C 91 41.535 41.535 42.981 -1.446 17865
10957 1 17 . 1 1 66 66 TYR H H 91 9.145 9.145 7.871 1.274 17865
10958 1 17 . 1 1 67 67 GLY N N 92 106.185 106.185 107.858 -1.673 17865
10959 1 17 . 1 1 67 67 GLY C C 92 175.681 175.681 174.956 0.725 17865
10960 1 17 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.977 -0.002 17865
10961 1 17 . 1 1 67 67 GLY H H 92 8.730 8.730 9.061 -0.331 17865
10962 1 17 . 1 1 68 68 TYR N N 93 121.815 121.815 122.019 -0.204 17865
10963 1 17 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.333 -0.358 17865
10964 1 17 . 1 1 68 68 TYR C C 93 176.035 176.035 175.353 0.682 17865
10965 1 17 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.349 1.697 17865
10966 1 17 . 1 1 68 68 TYR CB C 93 38.425 38.425 37.739 0.686 17865
10967 1 17 . 1 1 68 68 TYR H H 93 8.711 8.711 8.748 -0.037 17865
10968 1 17 . 1 1 69 69 ASP N N 94 115.507 115.507 117.264 -1.757 17865
10969 1 17 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.507 -0.219 17865
10970 1 17 . 1 1 69 69 ASP C C 94 177.063 177.063 177.422 -0.359 17865
10971 1 17 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.285 -0.274 17865
10972 1 17 . 1 1 69 69 ASP CB C 94 40.167 40.167 39.494 0.673 17865
10973 1 17 . 1 1 69 69 ASP H H 94 8.010 8.010 7.554 0.456 17865
10974 1 17 . 1 1 70 70 GLY N N 95 107.196 107.196 108.159 -0.963 17865
10975 1 17 . 1 1 70 70 GLY C C 95 173.936 173.936 174.381 -0.445 17865
10976 1 17 . 1 1 70 70 GLY CA C 95 45.392 45.392 44.929 0.463 17865
10977 1 17 . 1 1 70 70 GLY H H 95 7.986 7.986 8.241 -0.255 17865
10978 1 17 . 1 1 71 71 LYS N N 96 121.258 121.258 122.131 -0.873 17865
10979 1 17 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.476 0.308 17865
10980 1 17 . 1 1 71 71 LYS CA C 96 54.114 54.114 54.321 -0.207 17865
10981 1 17 . 1 1 71 71 LYS CB C 96 31.762 31.762 32.552 -0.790 17865
10982 1 17 . 1 1 71 71 LYS H H 96 7.877 7.877 7.474 0.403 17865
10983 1 17 . 1 1 72 72 PRO C C 97 177.170 177.170 174.958 2.212 17865
10984 1 17 . 1 1 72 72 PRO CA C 97 63.137 63.137 62.023 1.114 17865
10985 1 17 . 1 1 72 72 PRO CB C 97 32.240 32.240 29.771 2.469 17865
10986 1 17 . 1 1 73 73 LEU N N 98 123.503 123.503 118.363 5.140 17865
10987 1 17 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.516 -0.156 17865
10988 1 17 . 1 1 73 73 LEU C C 98 176.354 176.354 176.120 0.234 17865
10989 1 17 . 1 1 73 73 LEU CA C 98 53.927 53.927 52.921 1.006 17865
10990 1 17 . 1 1 73 73 LEU CB C 98 42.272 42.272 43.695 -1.423 17865
10991 1 17 . 1 1 73 73 LEU H H 98 8.850 8.850 7.416 1.434 17865
10992 1 17 . 1 1 74 74 ASP N N 99 122.212 122.212 120.774 1.438 17865
10993 1 17 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.658 -0.061 17865
10994 1 17 . 1 1 74 74 ASP C C 99 175.819 175.819 176.185 -0.366 17865
10995 1 17 . 1 1 74 74 ASP CA C 99 53.856 53.856 53.023 0.833 17865
10996 1 17 . 1 1 74 74 ASP CB C 99 40.989 40.989 42.642 -1.653 17865
10997 1 17 . 1 1 74 74 ASP H H 99 8.517 8.517 8.277 0.240 17865
10998 1 17 . 1 1 75 75 LEU N N 100 125.874 125.874 115.432 10.442 17865
10999 1 17 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.016 0.350 17865
11000 1 17 . 1 1 75 75 LEU C C 100 178.426 178.426 177.987 0.439 17865
11001 1 17 . 1 1 75 75 LEU CA C 100 53.631 53.631 54.958 -1.327 17865
11002 1 17 . 1 1 75 75 LEU CB C 100 40.676 40.676 40.136 0.539 17865
11003 1 17 . 1 1 75 75 LEU H H 100 8.281 8.281 8.722 -0.441 17865
11004 1 17 . 1 1 76 76 GLY N N 101 110.604 110.604 108.028 2.576 17865
11005 1 17 . 1 1 76 76 GLY C C 101 176.936 176.936 175.211 1.725 17865
11006 1 17 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.163 0.664 17865
11007 1 17 . 1 1 76 76 GLY H H 101 8.914 8.914 8.692 0.222 17865
11008 1 17 . 1 1 77 77 PHE N N 102 117.639 117.639 117.477 0.162 17865
11009 1 17 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.848 -0.467 17865
11010 1 17 . 1 1 77 77 PHE C C 102 177.878 177.878 174.878 3.000 17865
11011 1 17 . 1 1 77 77 PHE CA C 102 59.139 59.139 57.725 1.414 17865
11012 1 17 . 1 1 77 77 PHE CB C 102 36.935 36.935 39.375 -2.440 17865
11013 1 17 . 1 1 77 77 PHE H H 102 7.992 7.992 8.196 -0.204 17865
11014 1 17 . 1 1 78 78 CYS N N 103 121.136 121.136 118.534 2.602 17865
11015 1 17 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.866 -0.481 17865
11016 1 17 . 1 1 78 78 CYS C C 103 172.780 172.780 176.770 -3.990 17865
11017 1 17 . 1 1 78 78 CYS CA C 103 53.696 53.696 58.969 -5.273 17865
11018 1 17 . 1 1 78 78 CYS CB C 103 34.237 34.237 28.933 5.304 17865
11019 1 17 . 1 1 78 78 CYS H H 103 7.362 7.362 7.901 -0.539 17865
11020 1 17 . 1 1 79 79 THR N N 104 114.773 114.773 118.865 -4.092 17865
11021 1 17 . 1 1 79 79 THR HA H 104 3.984 3.984 4.065 -0.081 17865
11022 1 17 . 1 1 79 79 THR C C 104 176.624 176.624 175.606 1.018 17865
11023 1 17 . 1 1 79 79 THR CA C 104 65.180 65.180 65.629 -0.449 17865
11024 1 17 . 1 1 79 79 THR CB C 104 69.062 69.062 68.586 0.476 17865
11025 1 17 . 1 1 79 79 THR H H 104 7.864 7.864 8.466 -0.602 17865
11026 1 17 . 1 1 80 80 LEU N N 105 119.785 119.785 115.164 4.621 17865
11027 1 17 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.657 -0.326 17865
11028 1 17 . 1 1 80 80 LEU C C 105 177.208 177.208 176.040 1.168 17865
11029 1 17 . 1 1 80 80 LEU CA C 105 55.453 55.453 54.615 0.838 17865
11030 1 17 . 1 1 80 80 LEU CB C 105 41.293 41.293 41.080 0.213 17865
11031 1 17 . 1 1 80 80 LEU H H 105 7.238 7.238 7.760 -0.522 17865
11032 1 17 . 1 1 81 81 ALA N N 106 119.309 119.309 122.663 -3.354 17865
11033 1 17 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.719 -0.192 17865
11034 1 17 . 1 1 81 81 ALA C C 106 178.769 178.769 177.494 1.275 17865
11035 1 17 . 1 1 81 81 ALA CA C 106 52.049 52.049 51.446 0.603 17865
11036 1 17 . 1 1 81 81 ALA CB C 106 18.820 18.820 19.563 -0.743 17865
11037 1 17 . 1 1 81 81 ALA H H 106 7.432 7.432 7.888 -0.456 17865
11038 1 17 . 1 1 82 82 GLY N N 107 109.793 109.793 111.860 -2.067 17865
11039 1 17 . 1 1 82 82 GLY CA C 107 47.119 47.119 46.975 0.144 17865
11040 1 17 . 1 1 82 82 GLY H H 107 7.918 7.918 8.839 -0.921 17865
11041 1 17 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.847 0.419 17865
11042 1 17 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.245 0.018 17865
11043 1 17 . 1 1 83 83 ILE CB C 108 38.261 38.261 38.078 0.183 17865
11044 1 17 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.178 0.577 17865
11045 1 17 . 1 1 84 84 ARG C C 109 181.344 181.344 178.219 3.125 17865
11046 1 17 . 1 1 84 84 ARG CA C 109 55.939 55.939 58.182 -2.243 17865
11047 1 17 . 1 1 84 84 ARG CB C 109 30.283 30.283 29.733 0.550 17865
11048 1 17 . 1 1 85 85 GLU N N 110 122.944 122.944 121.192 1.752 17865
11049 1 17 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.122 -0.505 17865
11050 1 17 . 1 1 85 85 GLU C C 110 177.797 177.797 178.530 -0.733 17865
11051 1 17 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.585 1.143 17865
11052 1 17 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.506 -0.635 17865
11053 1 17 . 1 1 85 85 GLU H H 110 8.003 8.003 7.829 0.174 17865
11054 1 17 . 1 1 86 86 VAL N N 111 117.101 117.101 118.529 -1.428 17865
11055 1 17 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.648 -0.137 17865
11056 1 17 . 1 1 86 86 VAL C C 111 177.710 177.710 178.094 -0.384 17865
11057 1 17 . 1 1 86 86 VAL CA C 111 66.430 66.430 65.774 0.656 17865
11058 1 17 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.654 -0.441 17865
11059 1 17 . 1 1 86 86 VAL H H 111 8.106 8.106 7.437 0.669 17865
11060 1 17 . 1 1 87 87 ASP N N 112 122.242 122.242 119.160 3.082 17865
11061 1 17 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.480 -0.176 17865
11062 1 17 . 1 1 87 87 ASP C C 112 176.912 176.912 178.430 -1.518 17865
11063 1 17 . 1 1 87 87 ASP CA C 112 57.417 57.417 56.777 0.640 17865
11064 1 17 . 1 1 87 87 ASP CB C 112 40.476 40.476 40.826 -0.350 17865
11065 1 17 . 1 1 87 87 ASP H H 112 7.401 7.401 7.935 -0.534 17865
11066 1 17 . 1 1 88 88 CYS N N 113 120.819 120.819 117.328 3.491 17865
11067 1 17 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.163 -0.854 17865
11068 1 17 . 1 1 88 88 CYS C C 113 175.270 175.270 176.981 -1.711 17865
11069 1 17 . 1 1 88 88 CYS CA C 113 59.759 59.759 61.532 -1.773 17865
11070 1 17 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.500 7.335 17865
11071 1 17 . 1 1 88 88 CYS H H 113 7.785 7.785 8.573 -0.788 17865
11072 1 17 . 1 1 89 89 ARG N N 114 118.654 118.654 120.252 -1.598 17865
11073 1 17 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.086 -0.445 17865
11074 1 17 . 1 1 89 89 ARG C C 114 179.018 179.018 178.274 0.744 17865
11075 1 17 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.080 1.113 17865
11076 1 17 . 1 1 89 89 ARG CB C 114 29.713 29.713 29.567 0.146 17865
11077 1 17 . 1 1 89 89 ARG H H 114 8.142 8.142 7.746 0.396 17865
11078 1 17 . 1 1 90 90 LYS N N 115 120.964 120.964 119.453 1.511 17865
11079 1 17 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.149 -0.119 17865
11080 1 17 . 1 1 90 90 LYS C C 115 180.092 180.092 178.001 2.091 17865
11081 1 17 . 1 1 90 90 LYS CA C 115 59.568 59.568 58.851 0.717 17865
11082 1 17 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.403 -0.182 17865
11083 1 17 . 1 1 90 90 LYS H H 115 7.936 7.936 7.676 0.260 17865
11084 1 17 . 1 1 91 91 ASP N N 116 121.690 121.690 119.127 2.563 17865
11085 1 17 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.606 -0.093 17865
11086 1 17 . 1 1 91 91 ASP C C 116 179.419 179.419 178.255 1.164 17865
11087 1 17 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.978 0.259 17865
11088 1 17 . 1 1 91 91 ASP CB C 116 40.648 40.648 41.194 -0.546 17865
11089 1 17 . 1 1 91 91 ASP H H 116 8.558 8.558 8.109 0.449 17865
11090 1 17 . 1 1 92 92 ALA N N 117 122.784 122.784 122.534 0.250 17865
11091 1 17 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.083 -0.060 17865
11092 1 17 . 1 1 92 92 ALA C C 117 178.789 178.789 179.639 -0.850 17865
11093 1 17 . 1 1 92 92 ALA CA C 117 55.051 55.051 54.796 0.255 17865
11094 1 17 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.473 0.702 17865
11095 1 17 . 1 1 92 92 ALA H H 117 8.703 8.703 8.144 0.559 17865
11096 1 17 . 1 1 93 93 GLN N N 118 115.510 115.510 117.178 -1.668 17865
11097 1 17 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.055 -0.111 17865
11098 1 17 . 1 1 93 93 GLN C C 118 178.745 178.745 178.083 0.662 17865
11099 1 17 . 1 1 93 93 GLN CA C 118 58.482 58.482 58.035 0.447 17865
11100 1 17 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.053 0.344 17865
11101 1 17 . 1 1 93 93 GLN H H 118 7.664 7.664 8.449 -0.785 17865
11102 1 17 . 1 1 94 94 THR N N 119 110.110 110.110 113.626 -3.516 17865
11103 1 17 . 1 1 94 94 THR HA H 119 4.237 4.237 4.200 0.037 17865
11104 1 17 . 1 1 94 94 THR C C 119 175.861 175.861 176.101 -0.240 17865
11105 1 17 . 1 1 94 94 THR CA C 119 64.604 64.604 63.869 0.735 17865
11106 1 17 . 1 1 94 94 THR CB C 119 69.716 69.716 68.835 0.881 17865
11107 1 17 . 1 1 94 94 THR H H 119 7.726 7.726 7.713 0.013 17865
11108 1 17 . 1 1 95 95 CYS N N 120 118.523 118.523 122.547 -4.024 17865
11109 1 17 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.344 0.389 17865
11110 1 17 . 1 1 95 95 CYS C C 120 175.165 175.165 175.141 0.024 17865
11111 1 17 . 1 1 95 95 CYS CA C 120 52.973 52.973 59.487 -6.514 17865
11112 1 17 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.733 11.998 17865
11113 1 17 . 1 1 95 95 CYS H H 120 7.756 7.756 7.993 -0.237 17865
11114 1 17 . 1 1 96 96 ASP N N 121 119.081 119.081 122.493 -3.412 17865
11115 1 17 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.323 0.355 17865
11116 1 17 . 1 1 96 96 ASP CA C 121 56.224 56.224 57.292 -1.068 17865
11117 1 17 . 1 1 96 96 ASP CB C 121 42.731 42.731 40.799 1.932 17865
11118 1 17 . 1 1 96 96 ASP H H 121 7.354 7.354 8.537 -1.183 17865
11119 1 17 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.453 -0.878 17865
11120 1 17 . 1 1 97 97 LYS C C 122 175.510 175.510 178.486 -2.976 17865
11121 1 17 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.111 0.728 17865
11122 1 17 . 1 1 97 97 LYS CB C 122 30.750 30.750 33.233 -2.483 17865
11123 1 17 . 1 1 98 98 LYS N N 123 119.980 119.980 119.749 0.231 17865
11124 1 17 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.539 -0.245 17865
11125 1 17 . 1 1 98 98 LYS C C 123 176.968 176.968 177.909 -0.941 17865
11126 1 17 . 1 1 98 98 LYS CA C 123 55.904 55.904 57.514 -1.610 17865
11127 1 17 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.806 -0.574 17865
11128 1 17 . 1 1 98 98 LYS H H 123 7.799 7.799 8.174 -0.375 17865
11129 1 17 . 1 1 99 99 TYR N N 124 122.378 122.378 122.188 0.190 17865
11130 1 17 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.093 -0.198 17865
11131 1 17 . 1 1 99 99 TYR C C 124 177.126 177.126 177.428 -0.302 17865
11132 1 17 . 1 1 99 99 TYR CA C 124 60.211 60.211 61.351 -1.140 17865
11133 1 17 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.643 -0.372 17865
11134 1 17 . 1 1 99 99 TYR H H 124 8.536 8.536 8.268 0.268 17865
11135 1 17 . 1 1 100 100 GLU N N 125 118.610 118.610 116.836 1.774 17865
11136 1 17 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.144 0.124 17865
11137 1 17 . 1 1 100 100 GLU C C 125 177.387 177.387 178.638 -1.251 17865
11138 1 17 . 1 1 100 100 GLU CA C 125 55.759 55.759 57.652 -1.893 17865
11139 1 17 . 1 1 100 100 GLU CB C 125 27.321 27.321 29.242 -1.921 17865
11140 1 17 . 1 1 100 100 GLU H H 125 8.385 8.385 8.570 -0.185 17865
11141 1 17 . 1 1 101 101 SER N N 126 115.949 115.949 117.107 -1.158 17865
11142 1 17 . 1 1 101 101 SER HA H 126 3.959 3.959 4.212 -0.253 17865
11143 1 17 . 1 1 101 101 SER C C 126 176.047 176.047 175.927 0.120 17865
11144 1 17 . 1 1 101 101 SER CA C 126 62.439 62.439 61.664 0.775 17865
11145 1 17 . 1 1 101 101 SER CB C 126 63.299 63.299 63.176 0.123 17865
11146 1 17 . 1 1 101 101 SER H H 126 7.823 7.823 7.882 -0.059 17865
11147 1 17 . 1 1 102 102 ASP N N 127 120.920 120.920 122.341 -1.421 17865
11148 1 17 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.221 0.186 17865
11149 1 17 . 1 1 102 102 ASP C C 127 178.234 178.234 177.971 0.263 17865
11150 1 17 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.636 -0.225 17865
11151 1 17 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.776 -1.060 17865
11152 1 17 . 1 1 102 102 ASP H H 127 8.683 8.683 7.647 1.036 17865
11153 1 17 . 1 1 103 103 LYS N N 128 121.753 121.753 118.715 3.038 17865
11154 1 17 . 1 1 103 103 LYS HA H 128 4.004 4.004 3.951 0.053 17865
11155 1 17 . 1 1 103 103 LYS C C 128 179.395 179.395 178.831 0.564 17865
11156 1 17 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.851 0.620 17865
11157 1 17 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.767 0.634 17865
11158 1 17 . 1 1 103 103 LYS H H 128 7.771 7.771 7.640 0.131 17865
11159 1 17 . 1 1 104 104 CYS N N 129 120.109 120.109 120.500 -0.391 17865
11160 1 17 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.182 0.012 17865
11161 1 17 . 1 1 104 104 CYS C C 129 176.779 176.779 176.801 -0.022 17865
11162 1 17 . 1 1 104 104 CYS CA C 129 59.790 59.790 62.119 -2.329 17865
11163 1 17 . 1 1 104 104 CYS CB C 129 36.879 36.879 25.900 10.979 17865
11164 1 17 . 1 1 104 104 CYS H H 129 7.973 7.973 7.930 0.043 17865
11165 1 17 . 1 1 105 105 LEU N N 130 121.804 121.804 121.636 0.168 17865
11166 1 17 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.949 0.141 17865
11167 1 17 . 1 1 105 105 LEU C C 130 179.373 179.373 178.725 0.648 17865
11168 1 17 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.261 -0.893 17865
11169 1 17 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.197 0.902 17865
11170 1 17 . 1 1 105 105 LEU H H 130 8.666 8.666 8.554 0.112 17865
11171 1 17 . 1 1 106 106 ASN N N 131 118.535 118.535 116.759 1.776 17865
11172 1 17 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.360 -0.122 17865
11173 1 17 . 1 1 106 106 ASN C C 131 177.830 177.830 177.609 0.221 17865
11174 1 17 . 1 1 106 106 ASN CA C 131 56.256 56.256 56.288 -0.032 17865
11175 1 17 . 1 1 106 106 ASN CB C 131 37.817 37.817 37.813 0.004 17865
11176 1 17 . 1 1 106 106 ASN H H 131 8.438 8.438 8.119 0.319 17865
11177 1 17 . 1 1 107 107 ALA N N 132 121.485 121.485 122.790 -1.305 17865
11178 1 17 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.170 0.049 17865
11179 1 17 . 1 1 107 107 ALA C C 132 180.726 180.726 179.654 1.072 17865
11180 1 17 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.503 0.460 17865
11181 1 17 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.739 -0.918 17865
11182 1 17 . 1 1 107 107 ALA H H 132 7.541 7.541 7.300 0.241 17865
11183 1 17 . 1 1 108 108 ILE N N 133 120.979 120.979 118.896 2.083 17865
11184 1 17 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.490 0.441 17865
11185 1 17 . 1 1 108 108 ILE C C 133 178.114 178.114 177.665 0.449 17865
11186 1 17 . 1 1 108 108 ILE CA C 133 63.353 63.353 64.328 -0.975 17865
11187 1 17 . 1 1 108 108 ILE CB C 133 36.454 36.454 37.609 -1.155 17865
11188 1 17 . 1 1 108 108 ILE H H 133 7.551 7.551 8.396 -0.845 17865
11189 1 17 . 1 1 109 109 LYS N N 134 121.415 121.415 118.647 2.768 17865
11190 1 17 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.101 -0.513 17865
11191 1 17 . 1 1 109 109 LYS C C 134 179.561 179.561 178.643 0.918 17865
11192 1 17 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.327 0.782 17865
11193 1 17 . 1 1 109 109 LYS CB C 134 32.161 32.161 31.913 0.248 17865
11194 1 17 . 1 1 109 109 LYS H H 134 8.414 8.414 8.182 0.232 17865
11195 1 17 . 1 1 110 110 GLU N N 135 116.099 116.099 118.244 -2.145 17865
11196 1 17 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.194 -0.265 17865
11197 1 17 . 1 1 110 110 GLU C C 135 178.239 178.239 177.979 0.260 17865
11198 1 17 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.393 0.253 17865
11199 1 17 . 1 1 110 110 GLU CB C 135 29.638 29.638 28.388 1.250 17865
11200 1 17 . 1 1 110 110 GLU H H 135 7.473 7.473 8.207 -0.734 17865
11201 1 17 . 1 1 111 111 LYS N N 136 119.805 119.805 117.891 1.914 17865
11202 1 17 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.113 -0.207 17865
11203 1 17 . 1 1 111 111 LYS C C 136 177.600 177.600 176.795 0.805 17865
11204 1 17 . 1 1 111 111 LYS CA C 136 58.749 58.749 57.162 1.587 17865
11205 1 17 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.074 1.164 17865
11206 1 17 . 1 1 111 111 LYS H H 136 7.540 7.540 7.419 0.121 17865
11207 1 17 . 1 1 112 112 TYR N N 137 114.768 114.768 116.146 -1.378 17865
11208 1 17 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.592 -0.069 17865
11209 1 17 . 1 1 112 112 TYR C C 137 174.690 174.690 175.004 -0.314 17865
11210 1 17 . 1 1 112 112 TYR CA C 137 58.359 58.359 56.867 1.492 17865
11211 1 17 . 1 1 112 112 TYR CB C 137 38.328 38.328 38.338 -0.010 17865
11212 1 17 . 1 1 112 112 TYR H H 137 7.488 7.488 7.243 0.245 17865
11213 1 17 . 1 1 113 113 LYS N N 138 123.694 123.694 123.450 0.244 17865
11214 1 17 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.624 -0.123 17865
11215 1 17 . 1 1 113 113 LYS CA C 138 55.282 55.282 53.151 2.131 17865
11216 1 17 . 1 1 113 113 LYS CB C 138 32.124 32.124 34.119 -1.995 17865
11217 1 17 . 1 1 113 113 LYS H H 138 7.217 7.217 7.091 0.126 17865
11218 1 17 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.543 -0.091 17865
11219 1 17 . 1 1 114 114 PRO C C 139 176.974 176.974 176.702 0.272 17865
11220 1 17 . 1 1 114 114 PRO CA C 139 63.189 63.189 62.899 0.290 17865
11221 1 17 . 1 1 114 114 PRO CB C 139 32.251 32.251 31.352 0.899 17865
11222 1 17 . 1 1 115 115 VAL N N 140 121.098 121.098 120.040 1.058 17865
11223 1 17 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.305 -0.203 17865
11224 1 17 . 1 1 115 115 VAL C C 140 176.207 176.207 176.446 -0.239 17865
11225 1 17 . 1 1 115 115 VAL CA C 140 62.356 62.356 61.952 0.404 17865
11226 1 17 . 1 1 115 115 VAL CB C 140 33.256 33.256 32.105 1.151 17865
11227 1 17 . 1 1 115 115 VAL H H 140 8.272 8.272 7.933 0.339 17865
11228 1 17 . 1 1 116 116 VAL N N 141 124.167 124.167 121.020 3.147 17865
11229 1 17 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.138 -0.016 17865
11230 1 17 . 1 1 116 116 VAL C C 141 175.415 175.415 175.675 -0.260 17865
11231 1 17 . 1 1 116 116 VAL CA C 141 61.731 61.731 62.485 -0.754 17865
11232 1 17 . 1 1 116 116 VAL CB C 141 33.145 33.145 32.702 0.443 17865
11233 1 17 . 1 1 116 116 VAL H H 141 8.142 8.142 7.535 0.607 17865
11234 1 17 . 1 1 117 117 ASP N N 142 126.737 126.737 129.319 -2.582 17865
11235 1 17 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.841 -0.029 17865
11236 1 17 . 1 1 117 117 ASP CA C 142 52.217 52.217 52.123 0.093 17865
11237 1 17 . 1 1 117 117 ASP CB C 142 41.368 41.368 41.940 -0.571 17865
11238 1 17 . 1 1 117 117 ASP H H 142 8.419 8.419 8.394 0.025 17865
11239 1 17 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.321 0.090 17865
11240 1 17 . 1 1 118 118 PRO C C 143 176.662 176.662 175.914 0.748 17865
11241 1 17 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.189 0.058 17865
11242 1 17 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.398 -0.088 17865
11243 1 17 . 1 1 119 119 ASN N N 144 119.287 119.287 121.579 -2.292 17865
11244 1 17 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.569 0.378 17865
11245 1 17 . 1 1 119 119 ASN CA C 144 51.633 51.633 52.334 -0.701 17865
11246 1 17 . 1 1 119 119 ASN CB C 144 38.859 38.859 38.119 0.740 17865
11247 1 17 . 1 1 119 119 ASN H H 144 8.432 8.432 8.316 0.116 17865
11248 1 17 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.737 -0.057 17865
11249 1 17 . 1 1 120 120 PRO CA C 145 61.640 61.640 61.829 -0.189 17865
11250 1 17 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.311 -0.393 17865
11251 1 17 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.506 -0.129 17865
11252 1 17 . 1 1 121 121 PRO C C 146 175.876 175.876 175.592 0.284 17865
11253 1 17 . 1 1 121 121 PRO CA C 146 63.174 63.174 62.847 0.327 17865
11254 1 17 . 1 1 121 121 PRO CB C 146 31.939 31.939 32.399 -0.460 17865
11255 1 18 . 1 1 2 2 ASP N N 27 121.041 121.041 121.001 0.040 17865
11256 1 18 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.892 -0.254 17865
11257 1 18 . 1 1 2 2 ASP C C 27 175.878 175.878 175.350 0.528 17865
11258 1 18 . 1 1 2 2 ASP CA C 27 54.382 54.382 54.336 0.046 17865
11259 1 18 . 1 1 2 2 ASP CB C 27 41.729 41.729 42.027 -0.298 17865
11260 1 18 . 1 1 2 2 ASP H H 27 8.639 8.639 8.507 0.132 17865
11261 1 18 . 1 1 3 3 VAL N N 28 119.901 119.901 121.482 -1.581 17865
11262 1 18 . 1 1 3 3 VAL HA H 28 4.033 4.033 3.943 0.090 17865
11263 1 18 . 1 1 3 3 VAL C C 28 175.521 175.521 174.958 0.563 17865
11264 1 18 . 1 1 3 3 VAL CA C 28 62.216 62.216 62.871 -0.655 17865
11265 1 18 . 1 1 3 3 VAL CB C 28 33.003 33.003 31.958 1.045 17865
11266 1 18 . 1 1 3 3 VAL H H 28 8.113 8.113 8.099 0.014 17865
11267 1 18 . 1 1 4 4 PHE N N 29 123.707 123.707 123.399 0.308 17865
11268 1 18 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.917 -0.261 17865
11269 1 18 . 1 1 4 4 PHE C C 29 174.874 174.874 174.116 0.758 17865
11270 1 18 . 1 1 4 4 PHE CA C 29 57.159 57.159 56.070 1.089 17865
11271 1 18 . 1 1 4 4 PHE CB C 29 39.795 39.795 40.209 -0.414 17865
11272 1 18 . 1 1 4 4 PHE H H 29 8.255 8.255 7.910 0.345 17865
11273 1 18 . 1 1 5 5 ASP N N 30 124.203 124.203 120.662 3.541 17865
11274 1 18 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.571 0.267 17865
11275 1 18 . 1 1 5 5 ASP CA C 30 52.385 52.385 52.828 -0.443 17865
11276 1 18 . 1 1 5 5 ASP CB C 30 40.801 40.801 40.285 0.516 17865
11277 1 18 . 1 1 5 5 ASP H H 30 8.226 8.226 8.443 -0.217 17865
11278 1 18 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.294 0.243 17865
11279 1 18 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.213 -0.549 17865
11280 1 18 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.212 -0.386 17865
11281 1 18 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.421 0.005 17865
11282 1 18 . 1 1 7 7 PRO C C 32 177.226 177.226 177.427 -0.201 17865
11283 1 18 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.978 -0.809 17865
11284 1 18 . 1 1 7 7 PRO CB C 32 31.948 31.948 31.970 -0.022 17865
11285 1 18 . 1 1 8 8 THR N N 33 114.158 114.158 121.613 -7.455 17865
11286 1 18 . 1 1 8 8 THR HA H 33 4.195 4.195 4.385 -0.190 17865
11287 1 18 . 1 1 8 8 THR C C 33 174.468 174.468 173.621 0.847 17865
11288 1 18 . 1 1 8 8 THR CA C 33 62.110 62.110 62.282 -0.172 17865
11289 1 18 . 1 1 8 8 THR CB C 33 69.975 69.975 67.756 2.219 17865
11290 1 18 . 1 1 8 8 THR H H 33 8.096 8.096 8.575 -0.479 17865
11291 1 18 . 1 1 9 9 GLN N N 34 122.411 122.411 123.949 -1.538 17865
11292 1 18 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.299 -0.036 17865
11293 1 18 . 1 1 9 9 GLN C C 34 175.445 175.445 173.879 1.566 17865
11294 1 18 . 1 1 9 9 GLN CA C 34 55.763 55.763 54.250 1.513 17865
11295 1 18 . 1 1 9 9 GLN CB C 34 29.691 29.691 29.478 0.213 17865
11296 1 18 . 1 1 9 9 GLN H H 34 8.278 8.278 7.562 0.716 17865
11297 1 18 . 1 1 10 10 TYR N N 35 121.048 121.048 118.754 2.294 17865
11298 1 18 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.409 0.111 17865
11299 1 18 . 1 1 10 10 TYR C C 35 176.314 176.314 174.036 2.278 17865
11300 1 18 . 1 1 10 10 TYR CA C 35 57.972 57.972 56.029 1.943 17865
11301 1 18 . 1 1 10 10 TYR CB C 35 38.936 38.936 39.447 -0.511 17865
11302 1 18 . 1 1 10 10 TYR H H 35 8.227 8.227 7.099 1.128 17865
11303 1 18 . 1 1 11 11 GLY N N 36 109.711 109.711 108.591 1.120 17865
11304 1 18 . 1 1 11 11 GLY C C 36 174.128 174.128 172.552 1.576 17865
11305 1 18 . 1 1 11 11 GLY CA C 36 45.212 45.212 45.334 -0.122 17865
11306 1 18 . 1 1 11 11 GLY H H 36 8.247 8.247 8.339 -0.092 17865
11307 1 18 . 1 1 12 12 TYR N N 37 120.302 120.302 114.888 5.414 17865
11308 1 18 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.765 -0.283 17865
11309 1 18 . 1 1 12 12 TYR C C 37 175.864 175.864 173.347 2.517 17865
11310 1 18 . 1 1 12 12 TYR CA C 37 58.541 58.541 57.854 0.687 17865
11311 1 18 . 1 1 12 12 TYR CB C 37 38.715 38.715 38.697 0.018 17865
11312 1 18 . 1 1 12 12 TYR H H 37 8.101 8.101 7.931 0.170 17865
11313 1 18 . 1 1 13 13 ASP N N 38 121.883 121.883 120.074 1.809 17865
11314 1 18 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.584 -0.098 17865
11315 1 18 . 1 1 13 13 ASP C C 38 176.538 176.538 175.814 0.724 17865
11316 1 18 . 1 1 13 13 ASP CA C 38 54.223 54.223 52.241 1.982 17865
11317 1 18 . 1 1 13 13 ASP CB C 38 40.988 40.988 42.156 -1.168 17865
11318 1 18 . 1 1 13 13 ASP H H 38 8.266 8.266 7.164 1.102 17865
11319 1 18 . 1 1 14 14 GLY N N 39 107.705 107.705 106.138 1.567 17865
11320 1 18 . 1 1 14 14 GLY C C 39 173.822 173.822 173.778 0.044 17865
11321 1 18 . 1 1 14 14 GLY CA C 39 45.404 45.404 45.304 0.100 17865
11322 1 18 . 1 1 14 14 GLY H H 39 7.647 7.647 8.055 -0.408 17865
11323 1 18 . 1 1 15 15 LYS N N 40 121.621 121.621 118.860 2.761 17865
11324 1 18 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.645 -0.070 17865
11325 1 18 . 1 1 15 15 LYS CA C 40 54.100 54.100 52.571 1.529 17865
11326 1 18 . 1 1 15 15 LYS CB C 40 32.510 32.510 34.398 -1.888 17865
11327 1 18 . 1 1 15 15 LYS H H 40 7.908 7.908 7.182 0.726 17865
11328 1 18 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.832 -0.480 17865
11329 1 18 . 1 1 16 16 PRO C C 41 176.806 176.806 177.520 -0.714 17865
11330 1 18 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.482 0.276 17865
11331 1 18 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.514 -0.200 17865
11332 1 18 . 1 1 17 17 LEU N N 42 123.488 123.488 117.305 6.183 17865
11333 1 18 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.569 -0.520 17865
11334 1 18 . 1 1 17 17 LEU C C 42 174.973 174.973 176.756 -1.783 17865
11335 1 18 . 1 1 17 17 LEU CA C 42 55.436 55.436 55.688 -0.252 17865
11336 1 18 . 1 1 17 17 LEU CB C 42 42.093 42.093 41.257 0.836 17865
11337 1 18 . 1 1 17 17 LEU H H 42 8.499 8.499 8.377 0.122 17865
11338 1 18 . 1 1 18 18 ASP N N 43 123.354 123.354 124.598 -1.244 17865
11339 1 18 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.843 -0.345 17865
11340 1 18 . 1 1 18 18 ASP C C 43 175.947 175.947 176.946 -0.999 17865
11341 1 18 . 1 1 18 18 ASP CA C 43 52.858 52.858 53.464 -0.606 17865
11342 1 18 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.901 -2.680 17865
11343 1 18 . 1 1 18 18 ASP H H 43 7.789 7.789 8.137 -0.348 17865
11344 1 18 . 1 1 19 19 ALA N N 44 120.147 120.147 122.489 -2.342 17865
11345 1 18 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.204 -0.218 17865
11346 1 18 . 1 1 19 19 ALA C C 44 179.476 179.476 178.992 0.484 17865
11347 1 18 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.470 0.693 17865
11348 1 18 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.801 -0.414 17865
11349 1 18 . 1 1 19 19 ALA H H 44 8.561 8.561 8.654 -0.093 17865
11350 1 18 . 1 1 20 20 SER N N 45 115.037 115.037 116.154 -1.117 17865
11351 1 18 . 1 1 20 20 SER HA H 45 4.151 4.151 4.157 -0.006 17865
11352 1 18 . 1 1 20 20 SER C C 45 177.191 177.191 176.863 0.328 17865
11353 1 18 . 1 1 20 20 SER CA C 45 61.629 61.629 60.999 0.630 17865
11354 1 18 . 1 1 20 20 SER CB C 45 62.804 62.804 63.052 -0.248 17865
11355 1 18 . 1 1 20 20 SER H H 45 8.466 8.466 8.115 0.351 17865
11356 1 18 . 1 1 21 21 PHE N N 46 125.030 125.030 122.763 2.267 17865
11357 1 18 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.422 -0.191 17865
11358 1 18 . 1 1 21 21 PHE C C 46 176.850 176.850 176.242 0.608 17865
11359 1 18 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.596 0.209 17865
11360 1 18 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.531 0.350 17865
11361 1 18 . 1 1 21 21 PHE H H 46 8.034 8.034 7.774 0.260 17865
11362 1 18 . 1 1 22 22 CYS N N 47 113.943 113.943 116.978 -3.035 17865
11363 1 18 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.348 -0.097 17865
11364 1 18 . 1 1 22 22 CYS C C 47 176.449 176.449 176.183 0.266 17865
11365 1 18 . 1 1 22 22 CYS CA C 47 53.600 53.600 58.546 -4.946 17865
11366 1 18 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.699 10.692 17865
11367 1 18 . 1 1 22 22 CYS H H 47 7.691 7.691 7.924 -0.233 17865
11368 1 18 . 1 1 23 23 ARG N N 48 119.958 119.958 121.123 -1.165 17865
11369 1 18 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.098 -0.018 17865
11370 1 18 . 1 1 23 23 ARG C C 48 177.904 177.904 176.999 0.905 17865
11371 1 18 . 1 1 23 23 ARG CA C 48 58.907 58.907 58.440 0.468 17865
11372 1 18 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.888 0.283 17865
11373 1 18 . 1 1 23 23 ARG H H 48 7.628 7.628 7.411 0.217 17865
11374 1 18 . 1 1 24 24 THR N N 49 106.445 106.445 111.237 -4.792 17865
11375 1 18 . 1 1 24 24 THR HA H 49 4.385 4.385 4.472 -0.087 17865
11376 1 18 . 1 1 24 24 THR C C 49 174.758 174.758 174.394 0.364 17865
11377 1 18 . 1 1 24 24 THR CA C 49 61.573 61.573 61.283 0.290 17865
11378 1 18 . 1 1 24 24 THR CB C 49 68.794 68.794 69.419 -0.626 17865
11379 1 18 . 1 1 24 24 THR H H 49 7.307 7.307 7.313 -0.006 17865
11380 1 18 . 1 1 25 25 ALA N N 50 122.242 122.242 122.848 -0.606 17865
11381 1 18 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.343 0.061 17865
11382 1 18 . 1 1 25 25 ALA C C 50 178.554 178.554 177.964 0.590 17865
11383 1 18 . 1 1 25 25 ALA CA C 50 52.381 52.381 53.292 -0.911 17865
11384 1 18 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.910 -1.515 17865
11385 1 18 . 1 1 25 25 ALA H H 50 7.401 7.401 7.777 -0.376 17865
11386 1 18 . 1 1 26 26 GLY N N 51 110.604 110.604 106.929 3.675 17865
11387 1 18 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.492 0.530 17865
11388 1 18 . 1 1 26 26 GLY H H 51 8.285 8.285 8.031 0.254 17865
11389 1 18 . 1 1 27 27 SER HA H 52 4.382 4.382 4.185 0.197 17865
11390 1 18 . 1 1 27 27 SER C C 52 175.774 175.774 175.903 -0.129 17865
11391 1 18 . 1 1 27 27 SER CA C 52 60.803 60.803 61.487 -0.684 17865
11392 1 18 . 1 1 27 27 SER CB C 52 62.827 62.827 63.078 -0.251 17865
11393 1 18 . 1 1 28 28 ARG N N 53 119.682 119.682 120.487 -0.805 17865
11394 1 18 . 1 1 28 28 ARG HA H 53 4.880 4.880 5.123 -0.243 17865
11395 1 18 . 1 1 28 28 ARG C C 53 175.796 175.796 176.655 -0.859 17865
11396 1 18 . 1 1 28 28 ARG CA C 53 55.738 55.738 55.053 0.685 17865
11397 1 18 . 1 1 28 28 ARG CB C 53 30.237 30.237 30.648 -0.411 17865
11398 1 18 . 1 1 28 28 ARG H H 53 7.894 7.894 7.760 0.134 17865
11399 1 18 . 1 1 29 29 GLU N N 54 122.318 122.318 121.364 0.954 17865
11400 1 18 . 1 1 29 29 GLU HA H 54 3.595 3.595 4.053 -0.458 17865
11401 1 18 . 1 1 29 29 GLU C C 54 177.523 177.523 177.490 0.033 17865
11402 1 18 . 1 1 29 29 GLU CA C 54 61.223 61.223 60.134 1.089 17865
11403 1 18 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.662 -0.725 17865
11404 1 18 . 1 1 29 29 GLU H H 54 7.730 7.730 7.713 0.017 17865
11405 1 18 . 1 1 30 30 LYS N N 55 118.377 118.377 117.701 0.676 17865
11406 1 18 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.092 -0.264 17865
11407 1 18 . 1 1 30 30 LYS C C 55 179.205 179.205 178.913 0.292 17865
11408 1 18 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.255 1.172 17865
11409 1 18 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.115 -0.514 17865
11410 1 18 . 1 1 30 30 LYS H H 55 8.659 8.659 8.162 0.497 17865
11411 1 18 . 1 1 31 31 ASP N N 56 121.614 121.614 120.821 0.793 17865
11412 1 18 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.479 -0.168 17865
11413 1 18 . 1 1 31 31 ASP C C 56 177.393 177.393 177.876 -0.483 17865
11414 1 18 . 1 1 31 31 ASP CA C 56 57.316 57.316 58.187 -0.870 17865
11415 1 18 . 1 1 31 31 ASP CB C 56 40.423 40.423 40.789 -0.366 17865
11416 1 18 . 1 1 31 31 ASP H H 56 7.646 7.646 8.011 -0.365 17865
11417 1 18 . 1 1 32 32 CYS N N 57 120.345 120.345 119.586 0.759 17865
11418 1 18 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.228 0.373 17865
11419 1 18 . 1 1 32 32 CYS C C 57 175.772 175.772 176.154 -0.382 17865
11420 1 18 . 1 1 32 32 CYS CA C 57 60.197 60.197 61.293 -1.096 17865
11421 1 18 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.522 8.444 17865
11422 1 18 . 1 1 32 32 CYS H H 57 8.042 8.042 7.984 0.058 17865
11423 1 18 . 1 1 33 33 ARG N N 58 120.293 120.293 118.967 1.326 17865
11424 1 18 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.989 -0.313 17865
11425 1 18 . 1 1 33 33 ARG C C 58 179.633 179.633 178.582 1.051 17865
11426 1 18 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.262 1.124 17865
11427 1 18 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.420 0.421 17865
11428 1 18 . 1 1 33 33 ARG H H 58 8.531 8.531 7.918 0.613 17865
11429 1 18 . 1 1 34 34 LYS N N 59 121.166 121.166 119.720 1.446 17865
11430 1 18 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.158 -0.122 17865
11431 1 18 . 1 1 34 34 LYS C C 59 179.220 179.220 178.627 0.593 17865
11432 1 18 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.746 0.784 17865
11433 1 18 . 1 1 34 34 LYS CB C 59 32.110 32.110 31.948 0.162 17865
11434 1 18 . 1 1 34 34 LYS H H 59 7.633 7.633 7.453 0.180 17865
11435 1 18 . 1 1 35 35 ASP N N 60 122.166 122.166 120.059 2.107 17865
11436 1 18 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.467 -0.036 17865
11437 1 18 . 1 1 35 35 ASP C C 60 179.709 179.709 178.256 1.453 17865
11438 1 18 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.123 0.580 17865
11439 1 18 . 1 1 35 35 ASP CB C 60 40.672 40.672 41.172 -0.500 17865
11440 1 18 . 1 1 35 35 ASP H H 60 8.221 8.221 8.031 0.190 17865
11441 1 18 . 1 1 36 36 VAL N N 61 121.312 121.312 117.686 3.626 17865
11442 1 18 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.802 -0.401 17865
11443 1 18 . 1 1 36 36 VAL C C 61 178.339 178.339 178.011 0.328 17865
11444 1 18 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.051 2.082 17865
11445 1 18 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.857 -0.200 17865
11446 1 18 . 1 1 36 36 VAL H H 61 8.916 8.916 8.153 0.763 17865
11447 1 18 . 1 1 37 37 GLN N N 62 119.166 119.166 118.926 0.240 17865
11448 1 18 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.213 -0.271 17865
11449 1 18 . 1 1 37 37 GLN C C 62 177.293 177.293 177.284 0.009 17865
11450 1 18 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.219 1.061 17865
11451 1 18 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.288 0.083 17865
11452 1 18 . 1 1 37 37 GLN H H 62 7.697 7.697 7.708 -0.011 17865
11453 1 18 . 1 1 38 38 ALA N N 63 118.964 118.964 121.041 -2.077 17865
11454 1 18 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.212 0.030 17865
11455 1 18 . 1 1 38 38 ALA C C 63 177.221 177.221 176.635 0.586 17865
11456 1 18 . 1 1 38 38 ALA CA C 63 53.137 53.137 52.741 0.396 17865
11457 1 18 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.217 -0.320 17865
11458 1 18 . 1 1 38 38 ALA H H 63 7.508 7.508 7.964 -0.456 17865
11459 1 18 . 1 1 39 39 CYS N N 64 119.081 119.081 118.433 0.648 17865
11460 1 18 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.544 0.409 17865
11461 1 18 . 1 1 39 39 CYS C C 64 172.052 172.052 174.546 -2.494 17865
11462 1 18 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.425 -6.545 17865
11463 1 18 . 1 1 39 39 CYS CB C 64 34.328 34.328 26.492 7.836 17865
11464 1 18 . 1 1 39 39 CYS H H 64 7.354 7.354 7.471 -0.117 17865
11465 1 18 . 1 1 40 40 ASP N N 65 124.167 124.167 125.968 -1.801 17865
11466 1 18 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.541 -0.216 17865
11467 1 18 . 1 1 40 40 ASP C C 65 176.496 176.496 176.581 -0.085 17865
11468 1 18 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.471 0.253 17865
11469 1 18 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.500 -0.187 17865
11470 1 18 . 1 1 40 40 ASP H H 65 8.142 8.142 8.709 -0.567 17865
11471 1 18 . 1 1 41 41 LYS N N 66 118.844 118.844 120.324 -1.480 17865
11472 1 18 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.427 0.097 17865
11473 1 18 . 1 1 41 41 LYS C C 66 175.586 175.586 176.306 -0.720 17865
11474 1 18 . 1 1 41 41 LYS CA C 66 55.275 55.275 55.978 -0.703 17865
11475 1 18 . 1 1 41 41 LYS CB C 66 32.598 32.598 31.399 1.199 17865
11476 1 18 . 1 1 41 41 LYS H H 66 7.858 7.858 8.336 -0.478 17865
11477 1 18 . 1 1 42 42 LYS N N 67 126.081 126.081 120.760 5.321 17865
11478 1 18 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.245 -0.330 17865
11479 1 18 . 1 1 42 42 LYS C C 67 174.665 174.665 175.796 -1.131 17865
11480 1 18 . 1 1 42 42 LYS CA C 67 57.827 57.827 57.212 0.615 17865
11481 1 18 . 1 1 42 42 LYS CB C 67 34.059 34.059 33.395 0.664 17865
11482 1 18 . 1 1 42 42 LYS H H 67 8.790 8.790 8.143 0.647 17865
11483 1 18 . 1 1 43 43 TYR N N 68 114.138 114.138 116.700 -2.562 17865
11484 1 18 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.988 0.271 17865
11485 1 18 . 1 1 43 43 TYR C C 68 175.767 175.767 175.600 0.167 17865
11486 1 18 . 1 1 43 43 TYR CA C 68 55.880 55.880 57.267 -1.387 17865
11487 1 18 . 1 1 43 43 TYR CB C 68 42.363 42.363 41.632 0.731 17865
11488 1 18 . 1 1 43 43 TYR H H 68 7.294 7.294 7.483 -0.189 17865
11489 1 18 . 1 1 44 44 ASP N N 69 121.807 121.807 121.999 -0.192 17865
11490 1 18 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.651 -0.011 17865
11491 1 18 . 1 1 44 44 ASP C C 69 177.812 177.812 177.503 0.309 17865
11492 1 18 . 1 1 44 44 ASP CA C 69 52.110 52.110 54.303 -2.193 17865
11493 1 18 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.578 -2.138 17865
11494 1 18 . 1 1 44 44 ASP H H 69 8.995 8.995 9.002 -0.007 17865
11495 1 18 . 1 1 45 45 ASP N N 70 116.686 116.686 122.241 -5.555 17865
11496 1 18 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.414 0.010 17865
11497 1 18 . 1 1 45 45 ASP C C 70 177.054 177.054 177.168 -0.114 17865
11498 1 18 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.337 0.044 17865
11499 1 18 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.986 -0.738 17865
11500 1 18 . 1 1 45 45 ASP H H 70 8.369 8.369 8.761 -0.392 17865
11501 1 18 . 1 1 46 46 GLN N N 71 117.949 117.949 117.075 0.874 17865
11502 1 18 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.458 -0.002 17865
11503 1 18 . 1 1 46 46 GLN C C 71 176.273 176.273 176.383 -0.110 17865
11504 1 18 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.071 0.296 17865
11505 1 18 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.078 0.252 17865
11506 1 18 . 1 1 46 46 GLN H H 71 8.274 8.274 8.499 -0.225 17865
11507 1 18 . 1 1 47 47 GLY N N 72 108.369 108.369 107.455 0.914 17865
11508 1 18 . 1 1 47 47 GLY C C 72 174.145 174.145 173.898 0.247 17865
11509 1 18 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.193 0.630 17865
11510 1 18 . 1 1 47 47 GLY H H 72 8.174 8.174 8.164 0.010 17865
11511 1 18 . 1 1 48 48 ARG N N 73 121.554 121.554 119.249 2.305 17865
11512 1 18 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.626 -0.141 17865
11513 1 18 . 1 1 48 48 ARG C C 73 176.855 176.855 175.673 1.182 17865
11514 1 18 . 1 1 48 48 ARG CA C 73 55.289 55.289 53.979 1.310 17865
11515 1 18 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.377 -0.819 17865
11516 1 18 . 1 1 48 48 ARG H H 73 8.462 8.462 7.876 0.586 17865
11517 1 18 . 1 1 49 49 GLU N N 74 122.784 122.784 120.522 2.262 17865
11518 1 18 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.519 -0.036 17865
11519 1 18 . 1 1 49 49 GLU C C 74 178.098 178.098 176.501 1.597 17865
11520 1 18 . 1 1 49 49 GLU CA C 74 57.184 57.184 56.566 0.618 17865
11521 1 18 . 1 1 49 49 GLU CB C 74 30.777 30.777 30.625 0.152 17865
11522 1 18 . 1 1 49 49 GLU H H 74 8.703 8.703 8.728 -0.025 17865
11523 1 18 . 1 1 50 50 THR N N 75 114.563 114.563 116.068 -1.505 17865
11524 1 18 . 1 1 50 50 THR HA H 75 4.212 4.212 4.401 -0.189 17865
11525 1 18 . 1 1 50 50 THR C C 75 175.170 175.170 175.809 -0.639 17865
11526 1 18 . 1 1 50 50 THR CA C 75 60.589 60.589 60.377 0.212 17865
11527 1 18 . 1 1 50 50 THR CB C 75 70.952 70.952 69.822 1.131 17865
11528 1 18 . 1 1 50 50 THR H H 75 7.717 7.717 7.918 -0.201 17865
11529 1 18 . 1 1 51 51 ALA N N 76 122.097 122.097 121.686 0.411 17865
11530 1 18 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.055 -0.017 17865
11531 1 18 . 1 1 51 51 ALA C C 76 181.906 181.906 179.042 2.864 17865
11532 1 18 . 1 1 51 51 ALA CA C 76 55.654 55.654 54.874 0.780 17865
11533 1 18 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.092 -0.099 17865
11534 1 18 . 1 1 51 51 ALA H H 76 8.734 8.734 8.491 0.243 17865
11535 1 18 . 1 1 52 52 CYS N N 77 115.347 115.347 116.650 -1.303 17865
11536 1 18 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.231 0.249 17865
11537 1 18 . 1 1 52 52 CYS C C 77 176.299 176.299 176.659 -0.360 17865
11538 1 18 . 1 1 52 52 CYS CA C 77 57.701 57.701 60.409 -2.708 17865
11539 1 18 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.723 9.908 17865
11540 1 18 . 1 1 52 52 CYS H H 77 9.073 9.073 7.931 1.142 17865
11541 1 18 . 1 1 53 53 ALA N N 78 128.517 128.517 122.790 5.727 17865
11542 1 18 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.809 0.046 17865
11543 1 18 . 1 1 53 53 ALA C C 78 178.736 178.736 179.155 -0.419 17865
11544 1 18 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.195 0.438 17865
11545 1 18 . 1 1 53 53 ALA CB C 78 19.191 19.191 18.182 1.009 17865
11546 1 18 . 1 1 53 53 ALA H H 78 7.174 7.174 8.055 -0.881 17865
11547 1 18 . 1 1 54 54 LYS N N 79 118.706 118.706 116.736 1.970 17865
11548 1 18 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.165 -0.362 17865
11549 1 18 . 1 1 54 54 LYS C C 79 179.611 179.611 178.451 1.160 17865
11550 1 18 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.434 1.291 17865
11551 1 18 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.100 0.553 17865
11552 1 18 . 1 1 54 54 LYS H H 79 8.313 8.313 7.854 0.459 17865
11553 1 18 . 1 1 55 55 GLY N N 80 104.822 104.822 108.376 -3.554 17865
11554 1 18 . 1 1 55 55 GLY C C 80 176.504 176.504 176.608 -0.104 17865
11555 1 18 . 1 1 55 55 GLY CA C 80 46.839 46.839 46.571 0.268 17865
11556 1 18 . 1 1 55 55 GLY H H 80 8.175 8.175 7.488 0.687 17865
11557 1 18 . 1 1 56 56 ILE N N 81 123.697 123.697 123.825 -0.128 17865
11558 1 18 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.995 -0.200 17865
11559 1 18 . 1 1 56 56 ILE C C 81 177.334 177.334 177.609 -0.275 17865
11560 1 18 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.333 0.948 17865
11561 1 18 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.837 0.498 17865
11562 1 18 . 1 1 56 56 ILE H H 81 7.590 7.590 7.628 -0.038 17865
11563 1 18 . 1 1 57 57 ARG N N 82 118.161 118.161 118.959 -0.798 17865
11564 1 18 . 1 1 57 57 ARG HA H 82 3.935 3.935 3.932 0.003 17865
11565 1 18 . 1 1 57 57 ARG C C 82 178.662 178.662 178.352 0.310 17865
11566 1 18 . 1 1 57 57 ARG CA C 82 59.702 59.702 58.686 1.016 17865
11567 1 18 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.375 0.523 17865
11568 1 18 . 1 1 57 57 ARG H H 82 7.569 7.569 7.672 -0.103 17865
11569 1 18 . 1 1 58 58 GLU N N 83 115.085 115.085 117.247 -2.162 17865
11570 1 18 . 1 1 58 58 GLU HA H 83 4.031 4.031 3.890 0.141 17865
11571 1 18 . 1 1 58 58 GLU C C 83 178.224 178.224 178.969 -0.745 17865
11572 1 18 . 1 1 58 58 GLU CA C 83 58.304 58.304 58.519 -0.215 17865
11573 1 18 . 1 1 58 58 GLU CB C 83 30.031 30.031 28.906 1.125 17865
11574 1 18 . 1 1 58 58 GLU H H 83 7.786 7.786 8.089 -0.303 17865
11575 1 18 . 1 1 59 59 LYS N N 84 119.183 119.183 120.366 -1.183 17865
11576 1 18 . 1 1 59 59 LYS HA H 84 3.830 3.830 3.777 0.053 17865
11577 1 18 . 1 1 59 59 LYS C C 84 177.933 177.933 177.669 0.264 17865
11578 1 18 . 1 1 59 59 LYS CA C 84 59.043 59.043 58.854 0.189 17865
11579 1 18 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.383 1.268 17865
11580 1 18 . 1 1 59 59 LYS H H 84 7.968 7.968 7.603 0.365 17865
11581 1 18 . 1 1 60 60 TYR N N 85 113.663 113.663 114.319 -0.656 17865
11582 1 18 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.711 -0.008 17865
11583 1 18 . 1 1 60 60 TYR C C 85 174.729 174.729 174.754 -0.025 17865
11584 1 18 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.132 1.070 17865
11585 1 18 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.378 0.524 17865
11586 1 18 . 1 1 60 60 TYR H H 85 7.562 7.562 7.444 0.118 17865
11587 1 18 . 1 1 61 61 LYS N N 86 121.862 121.862 121.695 0.167 17865
11588 1 18 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.501 0.011 17865
11589 1 18 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.576 -0.634 17865
11590 1 18 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.111 -0.009 17865
11591 1 18 . 1 1 61 61 LYS H H 86 7.222 7.222 7.223 -0.001 17865
11592 1 18 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.546 -0.223 17865
11593 1 18 . 1 1 62 62 PRO C C 87 176.576 176.576 176.779 -0.203 17865
11594 1 18 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.706 0.314 17865
11595 1 18 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.642 -0.402 17865
11596 1 18 . 1 1 63 63 ALA N N 88 125.029 125.029 125.115 -0.086 17865
11597 1 18 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.271 -0.017 17865
11598 1 18 . 1 1 63 63 ALA C C 88 177.301 177.301 176.294 1.007 17865
11599 1 18 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.648 -0.367 17865
11600 1 18 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.979 1.223 17865
11601 1 18 . 1 1 63 63 ALA H H 88 8.329 8.329 8.331 -0.002 17865
11602 1 18 . 1 1 64 64 VAL N N 89 121.843 121.843 123.778 -1.935 17865
11603 1 18 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.287 -0.343 17865
11604 1 18 . 1 1 64 64 VAL C C 89 174.791 174.791 174.914 -0.123 17865
11605 1 18 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.874 1.107 17865
11606 1 18 . 1 1 64 64 VAL CB C 89 33.485 33.485 35.984 -2.499 17865
11607 1 18 . 1 1 64 64 VAL H H 89 8.075 8.075 7.972 0.103 17865
11608 1 18 . 1 1 65 65 VAL N N 90 125.399 125.399 119.925 5.474 17865
11609 1 18 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.302 -0.164 17865
11610 1 18 . 1 1 65 65 VAL C C 90 174.340 174.340 174.562 -0.222 17865
11611 1 18 . 1 1 65 65 VAL CA C 90 61.162 61.162 61.633 -0.471 17865
11612 1 18 . 1 1 65 65 VAL CB C 90 33.866 33.866 31.029 2.837 17865
11613 1 18 . 1 1 65 65 VAL H H 90 8.229 8.229 8.225 0.004 17865
11614 1 18 . 1 1 66 66 TYR N N 91 124.848 124.848 127.407 -2.559 17865
11615 1 18 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.666 0.105 17865
11616 1 18 . 1 1 66 66 TYR C C 91 176.658 176.658 176.618 0.040 17865
11617 1 18 . 1 1 66 66 TYR CA C 91 58.084 58.084 58.333 -0.249 17865
11618 1 18 . 1 1 66 66 TYR CB C 91 41.535 41.535 39.596 1.939 17865
11619 1 18 . 1 1 66 66 TYR H H 91 9.145 9.145 8.352 0.793 17865
11620 1 18 . 1 1 67 67 GLY N N 92 106.185 106.185 109.842 -3.657 17865
11621 1 18 . 1 1 67 67 GLY C C 92 175.681 175.681 174.875 0.806 17865
11622 1 18 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.855 0.120 17865
11623 1 18 . 1 1 67 67 GLY H H 92 8.730 8.730 8.762 -0.032 17865
11624 1 18 . 1 1 68 68 TYR N N 93 121.815 121.815 117.962 3.853 17865
11625 1 18 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.467 -0.492 17865
11626 1 18 . 1 1 68 68 TYR C C 93 176.035 176.035 176.215 -0.180 17865
11627 1 18 . 1 1 68 68 TYR CA C 93 61.046 61.046 60.276 0.770 17865
11628 1 18 . 1 1 68 68 TYR CB C 93 38.425 38.425 37.706 0.719 17865
11629 1 18 . 1 1 68 68 TYR H H 93 8.711 8.711 8.998 -0.287 17865
11630 1 18 . 1 1 69 69 ASP N N 94 115.507 115.507 120.106 -4.599 17865
11631 1 18 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.442 -0.154 17865
11632 1 18 . 1 1 69 69 ASP C C 94 177.063 177.063 177.349 -0.286 17865
11633 1 18 . 1 1 69 69 ASP CA C 94 53.011 53.011 54.224 -1.213 17865
11634 1 18 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.097 0.070 17865
11635 1 18 . 1 1 69 69 ASP H H 94 8.010 8.010 7.630 0.380 17865
11636 1 18 . 1 1 70 70 GLY N N 95 107.196 107.196 106.147 1.049 17865
11637 1 18 . 1 1 70 70 GLY C C 95 173.936 173.936 173.898 0.038 17865
11638 1 18 . 1 1 70 70 GLY CA C 95 45.392 45.392 45.311 0.081 17865
11639 1 18 . 1 1 70 70 GLY H H 95 7.986 7.986 7.905 0.081 17865
11640 1 18 . 1 1 71 71 LYS N N 96 121.258 121.258 120.849 0.409 17865
11641 1 18 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.861 -0.077 17865
11642 1 18 . 1 1 71 71 LYS CA C 96 54.114 54.114 52.334 1.780 17865
11643 1 18 . 1 1 71 71 LYS CB C 96 31.762 31.762 34.302 -2.540 17865
11644 1 18 . 1 1 71 71 LYS H H 96 7.877 7.877 7.645 0.232 17865
11645 1 18 . 1 1 72 72 PRO C C 97 177.170 177.170 175.783 1.387 17865
11646 1 18 . 1 1 72 72 PRO CA C 97 63.137 63.137 62.888 0.249 17865
11647 1 18 . 1 1 72 72 PRO CB C 97 32.240 32.240 30.162 2.078 17865
11648 1 18 . 1 1 73 73 LEU N N 98 123.503 123.503 122.859 0.644 17865
11649 1 18 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.825 -0.465 17865
11650 1 18 . 1 1 73 73 LEU C C 98 176.354 176.354 175.399 0.955 17865
11651 1 18 . 1 1 73 73 LEU CA C 98 53.927 53.927 52.561 1.366 17865
11652 1 18 . 1 1 73 73 LEU CB C 98 42.272 42.272 46.191 -3.919 17865
11653 1 18 . 1 1 73 73 LEU H H 98 8.850 8.850 7.645 1.205 17865
11654 1 18 . 1 1 74 74 ASP N N 99 122.212 122.212 121.972 0.240 17865
11655 1 18 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.587 0.010 17865
11656 1 18 . 1 1 74 74 ASP C C 99 175.819 175.819 177.134 -1.315 17865
11657 1 18 . 1 1 74 74 ASP CA C 99 53.856 53.856 54.108 -0.252 17865
11658 1 18 . 1 1 74 74 ASP CB C 99 40.989 40.989 41.172 -0.183 17865
11659 1 18 . 1 1 74 74 ASP H H 99 8.517 8.517 8.530 -0.013 17865
11660 1 18 . 1 1 75 75 LEU N N 100 125.874 125.874 114.711 11.163 17865
11661 1 18 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.085 0.281 17865
11662 1 18 . 1 1 75 75 LEU C C 100 178.426 178.426 177.245 1.181 17865
11663 1 18 . 1 1 75 75 LEU CA C 100 53.631 53.631 56.644 -3.013 17865
11664 1 18 . 1 1 75 75 LEU CB C 100 40.676 40.676 40.147 0.529 17865
11665 1 18 . 1 1 75 75 LEU H H 100 8.281 8.281 8.444 -0.163 17865
11666 1 18 . 1 1 76 76 GLY N N 101 110.604 110.604 108.437 2.167 17865
11667 1 18 . 1 1 76 76 GLY C C 101 176.936 176.936 175.406 1.530 17865
11668 1 18 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.034 0.793 17865
11669 1 18 . 1 1 76 76 GLY H H 101 8.914 8.914 7.865 1.049 17865
11670 1 18 . 1 1 77 77 PHE N N 102 117.639 117.639 119.828 -2.189 17865
11671 1 18 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.730 -0.349 17865
11672 1 18 . 1 1 77 77 PHE C C 102 177.878 177.878 175.809 2.069 17865
11673 1 18 . 1 1 77 77 PHE CA C 102 59.139 59.139 59.091 0.048 17865
11674 1 18 . 1 1 77 77 PHE CB C 102 36.935 36.935 39.720 -2.785 17865
11675 1 18 . 1 1 77 77 PHE H H 102 7.992 7.992 8.246 -0.254 17865
11676 1 18 . 1 1 78 78 CYS N N 103 121.136 121.136 117.131 4.005 17865
11677 1 18 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.626 -0.241 17865
11678 1 18 . 1 1 78 78 CYS C C 103 172.780 172.780 175.733 -2.953 17865
11679 1 18 . 1 1 78 78 CYS CA C 103 53.696 53.696 57.887 -4.191 17865
11680 1 18 . 1 1 78 78 CYS CB C 103 34.237 34.237 27.142 7.095 17865
11681 1 18 . 1 1 78 78 CYS H H 103 7.362 7.362 7.907 -0.545 17865
11682 1 18 . 1 1 79 79 THR N N 104 114.773 114.773 117.718 -2.945 17865
11683 1 18 . 1 1 79 79 THR HA H 104 3.984 3.984 4.141 -0.157 17865
11684 1 18 . 1 1 79 79 THR C C 104 176.624 176.624 175.431 1.193 17865
11685 1 18 . 1 1 79 79 THR CA C 104 65.180 65.180 64.919 0.261 17865
11686 1 18 . 1 1 79 79 THR CB C 104 69.062 69.062 68.422 0.640 17865
11687 1 18 . 1 1 79 79 THR H H 104 7.864 7.864 7.966 -0.102 17865
11688 1 18 . 1 1 80 80 LEU N N 105 119.785 119.785 115.926 3.859 17865
11689 1 18 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.424 -0.093 17865
11690 1 18 . 1 1 80 80 LEU C C 105 177.208 177.208 176.524 0.684 17865
11691 1 18 . 1 1 80 80 LEU CA C 105 55.453 55.453 54.680 0.773 17865
11692 1 18 . 1 1 80 80 LEU CB C 105 41.293 41.293 40.068 1.225 17865
11693 1 18 . 1 1 80 80 LEU H H 105 7.238 7.238 7.755 -0.517 17865
11694 1 18 . 1 1 81 81 ALA N N 106 119.309 119.309 123.407 -4.098 17865
11695 1 18 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.590 -0.063 17865
11696 1 18 . 1 1 81 81 ALA C C 106 178.769 178.769 176.857 1.912 17865
11697 1 18 . 1 1 81 81 ALA CA C 106 52.049 52.049 51.628 0.421 17865
11698 1 18 . 1 1 81 81 ALA CB C 106 18.820 18.820 20.816 -1.996 17865
11699 1 18 . 1 1 81 81 ALA H H 106 7.432 7.432 7.487 -0.055 17865
11700 1 18 . 1 1 82 82 GLY N N 107 109.793 109.793 106.978 2.815 17865
11701 1 18 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.156 1.963 17865
11702 1 18 . 1 1 82 82 GLY H H 107 7.918 7.918 8.131 -0.213 17865
11703 1 18 . 1 1 83 83 ILE HA H 108 4.266 4.266 4.026 0.240 17865
11704 1 18 . 1 1 83 83 ILE CA C 108 63.263 63.263 62.839 0.424 17865
11705 1 18 . 1 1 83 83 ILE CB C 108 38.261 38.261 38.294 -0.033 17865
11706 1 18 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.186 0.569 17865
11707 1 18 . 1 1 84 84 ARG C C 109 181.344 181.344 177.590 3.754 17865
11708 1 18 . 1 1 84 84 ARG CA C 109 55.939 55.939 57.946 -2.007 17865
11709 1 18 . 1 1 84 84 ARG CB C 109 30.283 30.283 29.227 1.056 17865
11710 1 18 . 1 1 85 85 GLU N N 110 122.944 122.944 120.752 2.192 17865
11711 1 18 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.149 -0.532 17865
11712 1 18 . 1 1 85 85 GLU C C 110 177.797 177.797 178.094 -0.297 17865
11713 1 18 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.376 1.352 17865
11714 1 18 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.483 -0.612 17865
11715 1 18 . 1 1 85 85 GLU H H 110 8.003 8.003 7.621 0.382 17865
11716 1 18 . 1 1 86 86 VAL N N 111 117.101 117.101 118.282 -1.181 17865
11717 1 18 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.716 -0.205 17865
11718 1 18 . 1 1 86 86 VAL C C 111 177.710 177.710 178.115 -0.405 17865
11719 1 18 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.540 -0.110 17865
11720 1 18 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.665 -0.452 17865
11721 1 18 . 1 1 86 86 VAL H H 111 8.106 8.106 7.494 0.612 17865
11722 1 18 . 1 1 87 87 ASP N N 112 122.242 122.242 118.513 3.729 17865
11723 1 18 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.419 -0.115 17865
11724 1 18 . 1 1 87 87 ASP C C 112 176.912 176.912 177.182 -0.270 17865
11725 1 18 . 1 1 87 87 ASP CA C 112 57.417 57.417 56.611 0.806 17865
11726 1 18 . 1 1 87 87 ASP CB C 112 40.476 40.476 41.001 -0.525 17865
11727 1 18 . 1 1 87 87 ASP H H 112 7.401 7.401 8.181 -0.780 17865
11728 1 18 . 1 1 88 88 CYS N N 113 120.819 120.819 118.054 2.765 17865
11729 1 18 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.363 -1.054 17865
11730 1 18 . 1 1 88 88 CYS C C 113 175.270 175.270 176.680 -1.410 17865
11731 1 18 . 1 1 88 88 CYS CA C 113 59.759 59.759 60.595 -0.836 17865
11732 1 18 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.667 7.168 17865
11733 1 18 . 1 1 88 88 CYS H H 113 7.785 7.785 7.579 0.206 17865
11734 1 18 . 1 1 89 89 ARG N N 114 118.654 118.654 120.279 -1.625 17865
11735 1 18 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.152 -0.511 17865
11736 1 18 . 1 1 89 89 ARG C C 114 179.018 179.018 177.919 1.099 17865
11737 1 18 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.364 0.830 17865
11738 1 18 . 1 1 89 89 ARG CB C 114 29.713 29.713 30.294 -0.581 17865
11739 1 18 . 1 1 89 89 ARG H H 114 8.142 8.142 7.796 0.346 17865
11740 1 18 . 1 1 90 90 LYS N N 115 120.964 120.964 117.787 3.177 17865
11741 1 18 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.082 -0.052 17865
11742 1 18 . 1 1 90 90 LYS C C 115 180.092 180.092 178.924 1.168 17865
11743 1 18 . 1 1 90 90 LYS CA C 115 59.568 59.568 59.254 0.314 17865
11744 1 18 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.298 -0.077 17865
11745 1 18 . 1 1 90 90 LYS H H 115 7.936 7.936 7.849 0.087 17865
11746 1 18 . 1 1 91 91 ASP N N 116 121.690 121.690 118.233 3.457 17865
11747 1 18 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.649 -0.136 17865
11748 1 18 . 1 1 91 91 ASP C C 116 179.419 179.419 178.247 1.172 17865
11749 1 18 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.854 0.383 17865
11750 1 18 . 1 1 91 91 ASP CB C 116 40.648 40.648 40.940 -0.292 17865
11751 1 18 . 1 1 91 91 ASP H H 116 8.558 8.558 7.825 0.733 17865
11752 1 18 . 1 1 92 92 ALA N N 117 122.784 122.784 123.079 -0.295 17865
11753 1 18 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.083 -0.060 17865
11754 1 18 . 1 1 92 92 ALA C C 117 178.789 178.789 179.533 -0.744 17865
11755 1 18 . 1 1 92 92 ALA CA C 117 55.051 55.051 54.930 0.121 17865
11756 1 18 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.507 0.668 17865
11757 1 18 . 1 1 92 92 ALA H H 117 8.703 8.703 7.703 1.000 17865
11758 1 18 . 1 1 93 93 GLN N N 118 115.510 115.510 115.732 -0.222 17865
11759 1 18 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.168 -0.224 17865
11760 1 18 . 1 1 93 93 GLN C C 118 178.745 178.745 177.612 1.133 17865
11761 1 18 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.913 0.569 17865
11762 1 18 . 1 1 93 93 GLN CB C 118 28.397 28.397 27.708 0.689 17865
11763 1 18 . 1 1 93 93 GLN H H 118 7.664 7.664 8.400 -0.736 17865
11764 1 18 . 1 1 94 94 THR N N 119 110.110 110.110 115.201 -5.091 17865
11765 1 18 . 1 1 94 94 THR HA H 119 4.237 4.237 4.428 -0.191 17865
11766 1 18 . 1 1 94 94 THR C C 119 175.861 175.861 174.817 1.044 17865
11767 1 18 . 1 1 94 94 THR CA C 119 64.604 64.604 64.436 0.168 17865
11768 1 18 . 1 1 94 94 THR CB C 119 69.716 69.716 69.513 0.203 17865
11769 1 18 . 1 1 94 94 THR H H 119 7.726 7.726 8.123 -0.397 17865
11770 1 18 . 1 1 95 95 CYS N N 120 118.523 118.523 120.852 -2.329 17865
11771 1 18 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.770 -0.037 17865
11772 1 18 . 1 1 95 95 CYS C C 120 175.165 175.165 174.989 0.176 17865
11773 1 18 . 1 1 95 95 CYS CA C 120 52.973 52.973 56.596 -3.623 17865
11774 1 18 . 1 1 95 95 CYS CB C 120 36.731 36.731 25.379 11.352 17865
11775 1 18 . 1 1 95 95 CYS H H 120 7.756 7.756 7.620 0.136 17865
11776 1 18 . 1 1 96 96 ASP N N 121 119.081 119.081 124.278 -5.197 17865
11777 1 18 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.407 0.271 17865
11778 1 18 . 1 1 96 96 ASP CA C 121 56.224 56.224 56.364 -0.140 17865
11779 1 18 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.134 1.597 17865
11780 1 18 . 1 1 96 96 ASP H H 121 7.354 7.354 8.176 -0.822 17865
11781 1 18 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.371 -0.796 17865
11782 1 18 . 1 1 97 97 LYS C C 122 175.510 175.510 176.707 -1.197 17865
11783 1 18 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.362 0.477 17865
11784 1 18 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.699 -3.949 17865
11785 1 18 . 1 1 98 98 LYS N N 123 119.980 119.980 118.208 1.772 17865
11786 1 18 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.381 -0.087 17865
11787 1 18 . 1 1 98 98 LYS C C 123 176.968 176.968 177.394 -0.426 17865
11788 1 18 . 1 1 98 98 LYS CA C 123 55.904 55.904 56.818 -0.914 17865
11789 1 18 . 1 1 98 98 LYS CB C 123 33.232 33.232 32.566 0.666 17865
11790 1 18 . 1 1 98 98 LYS H H 123 7.799 7.799 8.174 -0.375 17865
11791 1 18 . 1 1 99 99 TYR N N 124 122.378 122.378 123.985 -1.607 17865
11792 1 18 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.185 -0.290 17865
11793 1 18 . 1 1 99 99 TYR C C 124 177.126 177.126 177.702 -0.576 17865
11794 1 18 . 1 1 99 99 TYR CA C 124 60.211 60.211 61.782 -1.571 17865
11795 1 18 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.722 -0.452 17865
11796 1 18 . 1 1 99 99 TYR H H 124 8.536 8.536 8.459 0.077 17865
11797 1 18 . 1 1 100 100 GLU N N 125 118.610 118.610 118.168 0.442 17865
11798 1 18 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.184 0.084 17865
11799 1 18 . 1 1 100 100 GLU C C 125 177.387 177.387 178.448 -1.061 17865
11800 1 18 . 1 1 100 100 GLU CA C 125 55.759 55.759 58.011 -2.252 17865
11801 1 18 . 1 1 100 100 GLU CB C 125 27.321 27.321 28.409 -1.088 17865
11802 1 18 . 1 1 100 100 GLU H H 125 8.385 8.385 8.910 -0.525 17865
11803 1 18 . 1 1 101 101 SER N N 126 115.949 115.949 117.035 -1.086 17865
11804 1 18 . 1 1 101 101 SER HA H 126 3.959 3.959 4.364 -0.405 17865
11805 1 18 . 1 1 101 101 SER C C 126 176.047 176.047 176.430 -0.383 17865
11806 1 18 . 1 1 101 101 SER CA C 126 62.439 62.439 61.883 0.556 17865
11807 1 18 . 1 1 101 101 SER CB C 126 63.299 63.299 62.379 0.920 17865
11808 1 18 . 1 1 101 101 SER H H 126 7.823 7.823 8.208 -0.385 17865
11809 1 18 . 1 1 102 102 ASP N N 127 120.920 120.920 121.476 -0.556 17865
11810 1 18 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.327 0.080 17865
11811 1 18 . 1 1 102 102 ASP C C 127 178.234 178.234 178.132 0.102 17865
11812 1 18 . 1 1 102 102 ASP CA C 127 57.411 57.411 58.219 -0.808 17865
11813 1 18 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.433 -0.717 17865
11814 1 18 . 1 1 102 102 ASP H H 127 8.683 8.683 7.706 0.977 17865
11815 1 18 . 1 1 103 103 LYS N N 128 121.753 121.753 118.687 3.066 17865
11816 1 18 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.185 -0.181 17865
11817 1 18 . 1 1 103 103 LYS C C 128 179.395 179.395 178.768 0.627 17865
11818 1 18 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.218 1.253 17865
11819 1 18 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.741 0.660 17865
11820 1 18 . 1 1 103 103 LYS H H 128 7.771 7.771 8.025 -0.254 17865
11821 1 18 . 1 1 104 104 CYS N N 129 120.109 120.109 120.907 -0.798 17865
11822 1 18 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.262 -0.068 17865
11823 1 18 . 1 1 104 104 CYS C C 129 176.779 176.779 176.731 0.048 17865
11824 1 18 . 1 1 104 104 CYS CA C 129 59.790 59.790 61.621 -1.831 17865
11825 1 18 . 1 1 104 104 CYS CB C 129 36.879 36.879 26.245 10.634 17865
11826 1 18 . 1 1 104 104 CYS H H 129 7.973 7.973 8.043 -0.070 17865
11827 1 18 . 1 1 105 105 LEU N N 130 121.804 121.804 122.521 -0.717 17865
11828 1 18 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.938 0.152 17865
11829 1 18 . 1 1 105 105 LEU C C 130 179.373 179.373 178.450 0.923 17865
11830 1 18 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.464 -1.096 17865
11831 1 18 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.525 0.573 17865
11832 1 18 . 1 1 105 105 LEU H H 130 8.666 8.666 8.626 0.040 17865
11833 1 18 . 1 1 106 106 ASN N N 131 118.535 118.535 116.472 2.063 17865
11834 1 18 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.540 -0.302 17865
11835 1 18 . 1 1 106 106 ASN C C 131 177.830 177.830 177.267 0.563 17865
11836 1 18 . 1 1 106 106 ASN CA C 131 56.256 56.256 55.702 0.555 17865
11837 1 18 . 1 1 106 106 ASN CB C 131 37.817 37.817 37.899 -0.082 17865
11838 1 18 . 1 1 106 106 ASN H H 131 8.438 8.438 7.939 0.499 17865
11839 1 18 . 1 1 107 107 ALA N N 132 121.485 121.485 122.422 -0.937 17865
11840 1 18 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.230 -0.011 17865
11841 1 18 . 1 1 107 107 ALA C C 132 180.726 180.726 179.395 1.331 17865
11842 1 18 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.451 0.512 17865
11843 1 18 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.643 -0.822 17865
11844 1 18 . 1 1 107 107 ALA H H 132 7.541 7.541 7.270 0.271 17865
11845 1 18 . 1 1 108 108 ILE N N 133 120.979 120.979 118.078 2.901 17865
11846 1 18 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.914 0.017 17865
11847 1 18 . 1 1 108 108 ILE C C 133 178.114 178.114 177.755 0.359 17865
11848 1 18 . 1 1 108 108 ILE CA C 133 63.353 63.353 62.797 0.556 17865
11849 1 18 . 1 1 108 108 ILE CB C 133 36.454 36.454 37.354 -0.900 17865
11850 1 18 . 1 1 108 108 ILE H H 133 7.551 7.551 8.158 -0.607 17865
11851 1 18 . 1 1 109 109 LYS N N 134 121.415 121.415 119.772 1.643 17865
11852 1 18 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.143 -0.555 17865
11853 1 18 . 1 1 109 109 LYS C C 134 179.561 179.561 178.313 1.248 17865
11854 1 18 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.789 0.319 17865
11855 1 18 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.121 0.040 17865
11856 1 18 . 1 1 109 109 LYS H H 134 8.414 8.414 7.506 0.908 17865
11857 1 18 . 1 1 110 110 GLU N N 135 116.099 116.099 118.909 -2.810 17865
11858 1 18 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.102 -0.173 17865
11859 1 18 . 1 1 110 110 GLU C C 135 178.239 178.239 179.166 -0.927 17865
11860 1 18 . 1 1 110 110 GLU CA C 135 58.646 58.646 59.083 -0.437 17865
11861 1 18 . 1 1 110 110 GLU CB C 135 29.638 29.638 29.464 0.174 17865
11862 1 18 . 1 1 110 110 GLU H H 135 7.473 7.473 7.712 -0.239 17865
11863 1 18 . 1 1 111 111 LYS N N 136 119.805 119.805 119.083 0.722 17865
11864 1 18 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.080 -0.174 17865
11865 1 18 . 1 1 111 111 LYS C C 136 177.600 177.600 177.929 -0.329 17865
11866 1 18 . 1 1 111 111 LYS CA C 136 58.749 58.749 58.264 0.485 17865
11867 1 18 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.426 0.812 17865
11868 1 18 . 1 1 111 111 LYS H H 136 7.540 7.540 7.451 0.089 17865
11869 1 18 . 1 1 112 112 TYR N N 137 114.768 114.768 118.296 -3.528 17865
11870 1 18 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.608 -0.085 17865
11871 1 18 . 1 1 112 112 TYR C C 137 174.690 174.690 175.094 -0.404 17865
11872 1 18 . 1 1 112 112 TYR CA C 137 58.359 58.359 57.425 0.934 17865
11873 1 18 . 1 1 112 112 TYR CB C 137 38.328 38.328 36.781 1.547 17865
11874 1 18 . 1 1 112 112 TYR H H 137 7.488 7.488 7.574 -0.086 17865
11875 1 18 . 1 1 113 113 LYS N N 138 123.694 123.694 122.940 0.754 17865
11876 1 18 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.440 0.061 17865
11877 1 18 . 1 1 113 113 LYS CA C 138 55.282 55.282 55.262 0.020 17865
11878 1 18 . 1 1 113 113 LYS CB C 138 32.124 32.124 33.200 -1.076 17865
11879 1 18 . 1 1 113 113 LYS H H 138 7.217 7.217 7.326 -0.109 17865
11880 1 18 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.502 -0.050 17865
11881 1 18 . 1 1 114 114 PRO C C 139 176.974 176.974 176.345 0.629 17865
11882 1 18 . 1 1 114 114 PRO CA C 139 63.189 63.189 63.391 -0.202 17865
11883 1 18 . 1 1 114 114 PRO CB C 139 32.251 32.251 30.089 2.162 17865
11884 1 18 . 1 1 115 115 VAL N N 140 121.098 121.098 115.772 5.326 17865
11885 1 18 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.104 -0.002 17865
11886 1 18 . 1 1 115 115 VAL C C 140 176.207 176.207 176.107 0.100 17865
11887 1 18 . 1 1 115 115 VAL CA C 140 62.356 62.356 62.408 -0.052 17865
11888 1 18 . 1 1 115 115 VAL CB C 140 33.256 33.256 32.132 1.124 17865
11889 1 18 . 1 1 115 115 VAL H H 140 8.272 8.272 8.045 0.227 17865
11890 1 18 . 1 1 116 116 VAL N N 141 124.167 124.167 120.945 3.222 17865
11891 1 18 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.030 0.092 17865
11892 1 18 . 1 1 116 116 VAL C C 141 175.415 175.415 176.501 -1.086 17865
11893 1 18 . 1 1 116 116 VAL CA C 141 61.731 61.731 62.757 -1.026 17865
11894 1 18 . 1 1 116 116 VAL CB C 141 33.145 33.145 32.389 0.756 17865
11895 1 18 . 1 1 116 116 VAL H H 141 8.142 8.142 7.560 0.582 17865
11896 1 18 . 1 1 117 117 ASP N N 142 126.737 126.737 124.514 2.223 17865
11897 1 18 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.581 0.231 17865
11898 1 18 . 1 1 117 117 ASP CA C 142 52.217 52.217 53.046 -0.829 17865
11899 1 18 . 1 1 117 117 ASP CB C 142 41.368 41.368 40.504 0.864 17865
11900 1 18 . 1 1 117 117 ASP H H 142 8.419 8.419 8.363 0.056 17865
11901 1 18 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.424 -0.013 17865
11902 1 18 . 1 1 118 118 PRO C C 143 176.662 176.662 176.338 0.324 17865
11903 1 18 . 1 1 118 118 PRO CA C 143 63.247 63.247 62.432 0.815 17865
11904 1 18 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.252 0.058 17865
11905 1 18 . 1 1 119 119 ASN N N 144 119.287 119.287 120.881 -1.594 17865
11906 1 18 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.726 0.221 17865
11907 1 18 . 1 1 119 119 ASN CA C 144 51.633 51.633 51.698 -0.065 17865
11908 1 18 . 1 1 119 119 ASN CB C 144 38.859 38.859 38.823 0.036 17865
11909 1 18 . 1 1 119 119 ASN H H 144 8.432 8.432 8.393 0.039 17865
11910 1 18 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.580 0.100 17865
11911 1 18 . 1 1 120 120 PRO CA C 145 61.640 61.640 61.821 -0.181 17865
11912 1 18 . 1 1 120 120 PRO CB C 145 30.918 30.918 30.899 0.019 17865
11913 1 18 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.196 0.181 17865
11914 1 18 . 1 1 121 121 PRO C C 146 175.876 175.876 175.870 0.006 17865
11915 1 18 . 1 1 121 121 PRO CA C 146 63.174 63.174 64.148 -0.974 17865
11916 1 18 . 1 1 121 121 PRO CB C 146 31.939 31.939 30.354 1.585 17865
11917 1 19 . 1 1 2 2 ASP N N 27 121.041 121.041 123.479 -2.438 17865
11918 1 19 . 1 1 2 2 ASP HA H 27 4.638 4.638 5.048 -0.410 17865
11919 1 19 . 1 1 2 2 ASP C C 27 175.878 175.878 175.237 0.641 17865
11920 1 19 . 1 1 2 2 ASP CA C 27 54.382 54.382 54.446 -0.063 17865
11921 1 19 . 1 1 2 2 ASP CB C 27 41.729 41.729 43.340 -1.611 17865
11922 1 19 . 1 1 2 2 ASP H H 27 8.639 8.639 8.633 0.006 17865
11923 1 19 . 1 1 3 3 VAL N N 28 119.901 119.901 122.243 -2.342 17865
11924 1 19 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.134 -0.101 17865
11925 1 19 . 1 1 3 3 VAL C C 28 175.521 175.521 174.828 0.693 17865
11926 1 19 . 1 1 3 3 VAL CA C 28 62.216 62.216 62.041 0.175 17865
11927 1 19 . 1 1 3 3 VAL CB C 28 33.003 33.003 32.693 0.310 17865
11928 1 19 . 1 1 3 3 VAL H H 28 8.113 8.113 8.346 -0.233 17865
11929 1 19 . 1 1 4 4 PHE N N 29 123.707 123.707 122.037 1.670 17865
11930 1 19 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.545 0.111 17865
11931 1 19 . 1 1 4 4 PHE C C 29 174.874 174.874 175.844 -0.970 17865
11932 1 19 . 1 1 4 4 PHE CA C 29 57.159 57.159 58.309 -1.150 17865
11933 1 19 . 1 1 4 4 PHE CB C 29 39.795 39.795 39.357 0.438 17865
11934 1 19 . 1 1 4 4 PHE H H 29 8.255 8.255 8.231 0.024 17865
11935 1 19 . 1 1 5 5 ASP N N 30 124.203 124.203 125.986 -1.783 17865
11936 1 19 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.912 -0.074 17865
11937 1 19 . 1 1 5 5 ASP CA C 30 52.385 52.385 51.530 0.855 17865
11938 1 19 . 1 1 5 5 ASP CB C 30 40.801 40.801 41.672 -0.871 17865
11939 1 19 . 1 1 5 5 ASP H H 30 8.226 8.226 8.505 -0.279 17865
11940 1 19 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.645 -0.108 17865
11941 1 19 . 1 1 6 6 PRO CA C 31 61.664 61.664 61.969 -0.305 17865
11942 1 19 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.562 -0.736 17865
11943 1 19 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.445 -0.019 17865
11944 1 19 . 1 1 7 7 PRO C C 32 177.226 177.226 176.590 0.636 17865
11945 1 19 . 1 1 7 7 PRO CA C 32 63.169 63.169 62.813 0.356 17865
11946 1 19 . 1 1 7 7 PRO CB C 32 31.948 31.948 32.093 -0.144 17865
11947 1 19 . 1 1 8 8 THR N N 33 114.158 114.158 119.511 -5.353 17865
11948 1 19 . 1 1 8 8 THR HA H 33 4.195 4.195 4.289 -0.094 17865
11949 1 19 . 1 1 8 8 THR C C 33 174.468 174.468 175.009 -0.541 17865
11950 1 19 . 1 1 8 8 THR CA C 33 62.110 62.110 62.248 -0.138 17865
11951 1 19 . 1 1 8 8 THR CB C 33 69.975 69.975 68.684 1.291 17865
11952 1 19 . 1 1 8 8 THR H H 33 8.096 8.096 8.512 -0.416 17865
11953 1 19 . 1 1 9 9 GLN N N 34 122.411 122.411 125.003 -2.592 17865
11954 1 19 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.167 0.096 17865
11955 1 19 . 1 1 9 9 GLN C C 34 175.445 175.445 175.469 -0.024 17865
11956 1 19 . 1 1 9 9 GLN CA C 34 55.763 55.763 56.223 -0.460 17865
11957 1 19 . 1 1 9 9 GLN CB C 34 29.691 29.691 28.904 0.787 17865
11958 1 19 . 1 1 9 9 GLN H H 34 8.278 8.278 8.567 -0.289 17865
11959 1 19 . 1 1 10 10 TYR N N 35 121.048 121.048 118.661 2.387 17865
11960 1 19 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.536 -0.016 17865
11961 1 19 . 1 1 10 10 TYR C C 35 176.314 176.314 176.847 -0.533 17865
11962 1 19 . 1 1 10 10 TYR CA C 35 57.972 57.972 58.725 -0.753 17865
11963 1 19 . 1 1 10 10 TYR CB C 35 38.936 38.936 39.584 -0.648 17865
11964 1 19 . 1 1 10 10 TYR H H 35 8.227 8.227 7.539 0.688 17865
11965 1 19 . 1 1 11 11 GLY N N 36 109.711 109.711 105.765 3.946 17865
11966 1 19 . 1 1 11 11 GLY C C 36 174.128 174.128 174.252 -0.124 17865
11967 1 19 . 1 1 11 11 GLY CA C 36 45.212 45.212 46.278 -1.066 17865
11968 1 19 . 1 1 11 11 GLY H H 36 8.247 8.247 8.297 -0.050 17865
11969 1 19 . 1 1 12 12 TYR N N 37 120.302 120.302 121.384 -1.082 17865
11970 1 19 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.844 -0.362 17865
11971 1 19 . 1 1 12 12 TYR C C 37 175.864 175.864 174.515 1.349 17865
11972 1 19 . 1 1 12 12 TYR CA C 37 58.541 58.541 55.158 3.383 17865
11973 1 19 . 1 1 12 12 TYR CB C 37 38.715 38.715 38.915 -0.200 17865
11974 1 19 . 1 1 12 12 TYR H H 37 8.101 8.101 7.829 0.272 17865
11975 1 19 . 1 1 13 13 ASP N N 38 121.883 121.883 121.215 0.668 17865
11976 1 19 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.376 0.110 17865
11977 1 19 . 1 1 13 13 ASP C C 38 176.538 176.538 175.964 0.574 17865
11978 1 19 . 1 1 13 13 ASP CA C 38 54.223 54.223 54.680 -0.457 17865
11979 1 19 . 1 1 13 13 ASP CB C 38 40.988 40.988 41.497 -0.509 17865
11980 1 19 . 1 1 13 13 ASP H H 38 8.266 8.266 8.070 0.196 17865
11981 1 19 . 1 1 14 14 GLY N N 39 107.705 107.705 110.542 -2.837 17865
11982 1 19 . 1 1 14 14 GLY C C 39 173.822 173.822 173.089 0.733 17865
11983 1 19 . 1 1 14 14 GLY CA C 39 45.404 45.404 44.641 0.763 17865
11984 1 19 . 1 1 14 14 GLY H H 39 7.647 7.647 7.905 -0.258 17865
11985 1 19 . 1 1 15 15 LYS N N 40 121.621 121.621 121.957 -0.336 17865
11986 1 19 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.919 -0.344 17865
11987 1 19 . 1 1 15 15 LYS CA C 40 54.100 54.100 53.011 1.089 17865
11988 1 19 . 1 1 15 15 LYS CB C 40 32.510 32.510 33.968 -1.458 17865
11989 1 19 . 1 1 15 15 LYS H H 40 7.908 7.908 7.140 0.768 17865
11990 1 19 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.500 -0.148 17865
11991 1 19 . 1 1 16 16 PRO C C 41 176.806 176.806 176.618 0.188 17865
11992 1 19 . 1 1 16 16 PRO CA C 41 62.758 62.758 64.598 -1.840 17865
11993 1 19 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.572 -0.258 17865
11994 1 19 . 1 1 17 17 LEU N N 42 123.488 123.488 117.785 5.703 17865
11995 1 19 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.529 -0.480 17865
11996 1 19 . 1 1 17 17 LEU C C 42 174.973 174.973 174.771 0.202 17865
11997 1 19 . 1 1 17 17 LEU CA C 42 55.436 55.436 54.124 1.312 17865
11998 1 19 . 1 1 17 17 LEU CB C 42 42.093 42.093 44.407 -2.313 17865
11999 1 19 . 1 1 17 17 LEU H H 42 8.499 8.499 7.636 0.863 17865
12000 1 19 . 1 1 18 18 ASP N N 43 123.354 123.354 123.346 0.008 17865
12001 1 19 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.919 -0.421 17865
12002 1 19 . 1 1 18 18 ASP C C 43 175.947 175.947 176.190 -0.243 17865
12003 1 19 . 1 1 18 18 ASP CA C 43 52.858 52.858 53.228 -0.370 17865
12004 1 19 . 1 1 18 18 ASP CB C 43 42.221 42.221 43.803 -1.582 17865
12005 1 19 . 1 1 18 18 ASP H H 43 7.789 7.789 8.293 -0.504 17865
12006 1 19 . 1 1 19 19 ALA N N 44 120.147 120.147 126.518 -6.371 17865
12007 1 19 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.207 -0.221 17865
12008 1 19 . 1 1 19 19 ALA C C 44 179.476 179.476 178.876 0.600 17865
12009 1 19 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.082 1.081 17865
12010 1 19 . 1 1 19 19 ALA CB C 44 18.387 18.387 19.101 -0.714 17865
12011 1 19 . 1 1 19 19 ALA H H 44 8.561 8.561 8.741 -0.180 17865
12012 1 19 . 1 1 20 20 SER N N 45 115.037 115.037 115.459 -0.422 17865
12013 1 19 . 1 1 20 20 SER HA H 45 4.151 4.151 4.171 -0.020 17865
12014 1 19 . 1 1 20 20 SER C C 45 177.191 177.191 176.264 0.927 17865
12015 1 19 . 1 1 20 20 SER CA C 45 61.629 61.629 62.072 -0.443 17865
12016 1 19 . 1 1 20 20 SER CB C 45 62.804 62.804 63.127 -0.323 17865
12017 1 19 . 1 1 20 20 SER H H 45 8.466 8.466 9.124 -0.658 17865
12018 1 19 . 1 1 21 21 PHE N N 46 125.030 125.030 122.558 2.472 17865
12019 1 19 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.329 -0.098 17865
12020 1 19 . 1 1 21 21 PHE C C 46 176.850 176.850 176.453 0.397 17865
12021 1 19 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.861 -0.055 17865
12022 1 19 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.281 0.600 17865
12023 1 19 . 1 1 21 21 PHE H H 46 8.034 8.034 7.678 0.356 17865
12024 1 19 . 1 1 22 22 CYS N N 47 113.943 113.943 117.598 -3.655 17865
12025 1 19 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.101 0.150 17865
12026 1 19 . 1 1 22 22 CYS C C 47 176.449 176.449 176.556 -0.107 17865
12027 1 19 . 1 1 22 22 CYS CA C 47 53.600 53.600 61.673 -8.073 17865
12028 1 19 . 1 1 22 22 CYS CB C 47 36.391 36.391 26.048 10.343 17865
12029 1 19 . 1 1 22 22 CYS H H 47 7.691 7.691 7.755 -0.064 17865
12030 1 19 . 1 1 23 23 ARG N N 48 119.958 119.958 118.819 1.139 17865
12031 1 19 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.183 -0.103 17865
12032 1 19 . 1 1 23 23 ARG C C 48 177.904 177.904 177.112 0.792 17865
12033 1 19 . 1 1 23 23 ARG CA C 48 58.907 58.907 58.103 0.804 17865
12034 1 19 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.154 1.018 17865
12035 1 19 . 1 1 23 23 ARG H H 48 7.628 7.628 7.990 -0.362 17865
12036 1 19 . 1 1 24 24 THR N N 49 106.445 106.445 114.430 -7.985 17865
12037 1 19 . 1 1 24 24 THR HA H 49 4.385 4.385 4.211 0.174 17865
12038 1 19 . 1 1 24 24 THR C C 49 174.758 174.758 174.436 0.322 17865
12039 1 19 . 1 1 24 24 THR CA C 49 61.573 61.573 64.252 -2.679 17865
12040 1 19 . 1 1 24 24 THR CB C 49 68.794 68.794 68.430 0.364 17865
12041 1 19 . 1 1 24 24 THR H H 49 7.307 7.307 7.162 0.145 17865
12042 1 19 . 1 1 25 25 ALA N N 50 122.242 122.242 121.027 1.215 17865
12043 1 19 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.013 0.391 17865
12044 1 19 . 1 1 25 25 ALA C C 50 178.554 178.554 177.080 1.474 17865
12045 1 19 . 1 1 25 25 ALA CA C 50 52.381 52.381 53.473 -1.092 17865
12046 1 19 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.354 -0.959 17865
12047 1 19 . 1 1 25 25 ALA H H 50 7.401 7.401 7.254 0.147 17865
12048 1 19 . 1 1 26 26 GLY N N 51 110.604 110.604 104.393 6.211 17865
12049 1 19 . 1 1 26 26 GLY CA C 51 47.022 47.022 45.333 1.689 17865
12050 1 19 . 1 1 26 26 GLY H H 51 8.285 8.285 7.876 0.409 17865
12051 1 19 . 1 1 27 27 SER HA H 52 4.382 4.382 4.163 0.219 17865
12052 1 19 . 1 1 27 27 SER C C 52 175.774 175.774 176.335 -0.561 17865
12053 1 19 . 1 1 27 27 SER CA C 52 60.803 60.803 60.377 0.426 17865
12054 1 19 . 1 1 27 27 SER CB C 52 62.827 62.827 62.811 0.016 17865
12055 1 19 . 1 1 28 28 ARG N N 53 119.682 119.682 120.544 -0.862 17865
12056 1 19 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.631 0.249 17865
12057 1 19 . 1 1 28 28 ARG C C 53 175.796 175.796 177.604 -1.808 17865
12058 1 19 . 1 1 28 28 ARG CA C 53 55.738 55.738 56.344 -0.607 17865
12059 1 19 . 1 1 28 28 ARG CB C 53 30.237 30.237 28.707 1.530 17865
12060 1 19 . 1 1 28 28 ARG H H 53 7.894 7.894 8.106 -0.212 17865
12061 1 19 . 1 1 29 29 GLU N N 54 122.318 122.318 121.511 0.807 17865
12062 1 19 . 1 1 29 29 GLU HA H 54 3.595 3.595 4.079 -0.484 17865
12063 1 19 . 1 1 29 29 GLU C C 54 177.523 177.523 178.035 -0.512 17865
12064 1 19 . 1 1 29 29 GLU CA C 54 61.223 61.223 60.172 1.051 17865
12065 1 19 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.347 -0.410 17865
12066 1 19 . 1 1 29 29 GLU H H 54 7.730 7.730 8.056 -0.326 17865
12067 1 19 . 1 1 30 30 LYS N N 55 118.377 118.377 117.379 0.998 17865
12068 1 19 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.146 -0.318 17865
12069 1 19 . 1 1 30 30 LYS C C 55 179.205 179.205 178.895 0.310 17865
12070 1 19 . 1 1 30 30 LYS CA C 55 60.427 60.427 58.904 1.523 17865
12071 1 19 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.429 -0.828 17865
12072 1 19 . 1 1 30 30 LYS H H 55 8.659 8.659 7.539 1.120 17865
12073 1 19 . 1 1 31 31 ASP N N 56 121.614 121.614 120.084 1.530 17865
12074 1 19 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.671 -0.360 17865
12075 1 19 . 1 1 31 31 ASP C C 56 177.393 177.393 177.810 -0.417 17865
12076 1 19 . 1 1 31 31 ASP CA C 56 57.316 57.316 56.786 0.530 17865
12077 1 19 . 1 1 31 31 ASP CB C 56 40.423 40.423 41.045 -0.622 17865
12078 1 19 . 1 1 31 31 ASP H H 56 7.646 7.646 7.851 -0.205 17865
12079 1 19 . 1 1 32 32 CYS N N 57 120.345 120.345 121.009 -0.664 17865
12080 1 19 . 1 1 32 32 CYS HA H 57 3.601 3.601 4.296 -0.695 17865
12081 1 19 . 1 1 32 32 CYS C C 57 175.772 175.772 177.007 -1.235 17865
12082 1 19 . 1 1 32 32 CYS CA C 57 60.197 60.197 61.278 -1.081 17865
12083 1 19 . 1 1 32 32 CYS CB C 57 33.966 33.966 26.609 7.357 17865
12084 1 19 . 1 1 32 32 CYS H H 57 8.042 8.042 8.772 -0.730 17865
12085 1 19 . 1 1 33 33 ARG N N 58 120.293 120.293 119.249 1.044 17865
12086 1 19 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.987 -0.311 17865
12087 1 19 . 1 1 33 33 ARG C C 58 179.633 179.633 177.808 1.825 17865
12088 1 19 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.077 1.309 17865
12089 1 19 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.411 0.430 17865
12090 1 19 . 1 1 33 33 ARG H H 58 8.531 8.531 8.031 0.500 17865
12091 1 19 . 1 1 34 34 LYS N N 59 121.166 121.166 119.444 1.722 17865
12092 1 19 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.231 -0.195 17865
12093 1 19 . 1 1 34 34 LYS C C 59 179.220 179.220 178.298 0.922 17865
12094 1 19 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.163 1.367 17865
12095 1 19 . 1 1 34 34 LYS CB C 59 32.110 32.110 32.719 -0.609 17865
12096 1 19 . 1 1 34 34 LYS H H 59 7.633 7.633 7.400 0.233 17865
12097 1 19 . 1 1 35 35 ASP N N 60 122.166 122.166 119.584 2.582 17865
12098 1 19 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.519 -0.088 17865
12099 1 19 . 1 1 35 35 ASP C C 60 179.709 179.709 178.786 0.923 17865
12100 1 19 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.642 0.061 17865
12101 1 19 . 1 1 35 35 ASP CB C 60 40.672 40.672 41.124 -0.452 17865
12102 1 19 . 1 1 35 35 ASP H H 60 8.221 8.221 8.403 -0.182 17865
12103 1 19 . 1 1 36 36 VAL N N 61 121.312 121.312 119.359 1.953 17865
12104 1 19 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.610 -0.208 17865
12105 1 19 . 1 1 36 36 VAL C C 61 178.339 178.339 178.019 0.320 17865
12106 1 19 . 1 1 36 36 VAL CA C 61 67.133 67.133 66.674 0.459 17865
12107 1 19 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.603 0.054 17865
12108 1 19 . 1 1 36 36 VAL H H 61 8.916 8.916 8.319 0.597 17865
12109 1 19 . 1 1 37 37 GLN N N 62 119.166 119.166 118.463 0.703 17865
12110 1 19 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.114 -0.172 17865
12111 1 19 . 1 1 37 37 GLN C C 62 177.293 177.293 177.893 -0.600 17865
12112 1 19 . 1 1 37 37 GLN CA C 62 58.280 58.280 58.428 -0.148 17865
12113 1 19 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.797 -0.426 17865
12114 1 19 . 1 1 37 37 GLN H H 62 7.697 7.697 7.746 -0.049 17865
12115 1 19 . 1 1 38 38 ALA N N 63 118.964 118.964 122.269 -3.305 17865
12116 1 19 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.269 -0.027 17865
12117 1 19 . 1 1 38 38 ALA C C 63 177.221 177.221 177.860 -0.639 17865
12118 1 19 . 1 1 38 38 ALA CA C 63 53.137 53.137 53.242 -0.105 17865
12119 1 19 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.236 -0.339 17865
12120 1 19 . 1 1 38 38 ALA H H 63 7.508 7.508 7.491 0.017 17865
12121 1 19 . 1 1 39 39 CYS N N 64 119.081 119.081 119.270 -0.189 17865
12122 1 19 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.241 0.712 17865
12123 1 19 . 1 1 39 39 CYS C C 64 172.052 172.052 174.796 -2.744 17865
12124 1 19 . 1 1 39 39 CYS CA C 64 51.880 51.880 60.287 -8.407 17865
12125 1 19 . 1 1 39 39 CYS CB C 64 34.328 34.328 25.659 8.669 17865
12126 1 19 . 1 1 39 39 CYS H H 64 7.354 7.354 8.151 -0.797 17865
12127 1 19 . 1 1 40 40 ASP N N 65 124.167 124.167 127.126 -2.959 17865
12128 1 19 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.405 -0.080 17865
12129 1 19 . 1 1 40 40 ASP C C 65 176.496 176.496 176.323 0.173 17865
12130 1 19 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.451 0.273 17865
12131 1 19 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.316 -0.004 17865
12132 1 19 . 1 1 40 40 ASP H H 65 8.142 8.142 8.606 -0.464 17865
12133 1 19 . 1 1 41 41 LYS N N 66 118.844 118.844 119.927 -1.083 17865
12134 1 19 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.489 0.035 17865
12135 1 19 . 1 1 41 41 LYS C C 66 175.586 175.586 176.620 -1.034 17865
12136 1 19 . 1 1 41 41 LYS CA C 66 55.275 55.275 55.436 -0.161 17865
12137 1 19 . 1 1 41 41 LYS CB C 66 32.598 32.598 31.379 1.219 17865
12138 1 19 . 1 1 41 41 LYS H H 66 7.858 7.858 8.443 -0.585 17865
12139 1 19 . 1 1 42 42 LYS N N 67 126.081 126.081 121.460 4.621 17865
12140 1 19 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.272 -0.357 17865
12141 1 19 . 1 1 42 42 LYS C C 67 174.665 174.665 174.958 -0.293 17865
12142 1 19 . 1 1 42 42 LYS CA C 67 57.827 57.827 56.447 1.380 17865
12143 1 19 . 1 1 42 42 LYS CB C 67 34.059 34.059 33.270 0.789 17865
12144 1 19 . 1 1 42 42 LYS H H 67 8.790 8.790 8.384 0.406 17865
12145 1 19 . 1 1 43 43 TYR N N 68 114.138 114.138 117.958 -3.820 17865
12146 1 19 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.858 0.401 17865
12147 1 19 . 1 1 43 43 TYR C C 68 175.767 175.767 174.221 1.546 17865
12148 1 19 . 1 1 43 43 TYR CA C 68 55.880 55.880 57.046 -1.166 17865
12149 1 19 . 1 1 43 43 TYR CB C 68 42.363 42.363 42.115 0.248 17865
12150 1 19 . 1 1 43 43 TYR H H 68 7.294 7.294 7.386 -0.092 17865
12151 1 19 . 1 1 44 44 ASP N N 69 121.807 121.807 121.742 0.065 17865
12152 1 19 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.684 -0.044 17865
12153 1 19 . 1 1 44 44 ASP C C 69 177.812 177.812 177.551 0.261 17865
12154 1 19 . 1 1 44 44 ASP CA C 69 52.110 52.110 53.725 -1.615 17865
12155 1 19 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.369 -1.929 17865
12156 1 19 . 1 1 44 44 ASP H H 69 8.995 8.995 8.984 0.011 17865
12157 1 19 . 1 1 45 45 ASP N N 70 116.686 116.686 125.011 -8.325 17865
12158 1 19 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.457 -0.033 17865
12159 1 19 . 1 1 45 45 ASP C C 70 177.054 177.054 176.735 0.319 17865
12160 1 19 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.475 -0.094 17865
12161 1 19 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.645 -0.397 17865
12162 1 19 . 1 1 45 45 ASP H H 70 8.369 8.369 8.830 -0.461 17865
12163 1 19 . 1 1 46 46 GLN N N 71 117.949 117.949 117.263 0.686 17865
12164 1 19 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.454 0.002 17865
12165 1 19 . 1 1 46 46 GLN C C 71 176.273 176.273 176.635 -0.362 17865
12166 1 19 . 1 1 46 46 GLN CA C 71 55.367 55.367 54.651 0.716 17865
12167 1 19 . 1 1 46 46 GLN CB C 71 29.330 29.330 28.689 0.641 17865
12168 1 19 . 1 1 46 46 GLN H H 71 8.274 8.274 7.974 0.300 17865
12169 1 19 . 1 1 47 47 GLY N N 72 108.369 108.369 106.476 1.893 17865
12170 1 19 . 1 1 47 47 GLY C C 72 174.145 174.145 174.274 -0.129 17865
12171 1 19 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.264 0.559 17865
12172 1 19 . 1 1 47 47 GLY H H 72 8.174 8.174 8.126 0.048 17865
12173 1 19 . 1 1 48 48 ARG N N 73 121.554 121.554 119.623 1.931 17865
12174 1 19 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.522 -0.037 17865
12175 1 19 . 1 1 48 48 ARG C C 73 176.855 176.855 175.586 1.269 17865
12176 1 19 . 1 1 48 48 ARG CA C 73 55.289 55.289 53.945 1.344 17865
12177 1 19 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.475 -0.917 17865
12178 1 19 . 1 1 48 48 ARG H H 73 8.462 8.462 8.203 0.259 17865
12179 1 19 . 1 1 49 49 GLU N N 74 122.784 122.784 119.599 3.185 17865
12180 1 19 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.579 -0.096 17865
12181 1 19 . 1 1 49 49 GLU C C 74 178.098 178.098 176.278 1.820 17865
12182 1 19 . 1 1 49 49 GLU CA C 74 57.184 57.184 55.475 1.709 17865
12183 1 19 . 1 1 49 49 GLU CB C 74 30.777 30.777 30.430 0.347 17865
12184 1 19 . 1 1 49 49 GLU H H 74 8.703 8.703 8.543 0.160 17865
12185 1 19 . 1 1 50 50 THR N N 75 114.563 114.563 113.464 1.099 17865
12186 1 19 . 1 1 50 50 THR HA H 75 4.212 4.212 4.342 -0.130 17865
12187 1 19 . 1 1 50 50 THR C C 75 175.170 175.170 175.650 -0.480 17865
12188 1 19 . 1 1 50 50 THR CA C 75 60.589 60.589 60.587 0.002 17865
12189 1 19 . 1 1 50 50 THR CB C 75 70.952 70.952 70.146 0.806 17865
12190 1 19 . 1 1 50 50 THR H H 75 7.717 7.717 8.135 -0.418 17865
12191 1 19 . 1 1 51 51 ALA N N 76 122.097 122.097 122.444 -0.347 17865
12192 1 19 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.025 0.013 17865
12193 1 19 . 1 1 51 51 ALA C C 76 181.906 181.906 179.346 2.560 17865
12194 1 19 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.039 0.615 17865
12195 1 19 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.048 -0.055 17865
12196 1 19 . 1 1 51 51 ALA H H 76 8.734 8.734 8.579 0.155 17865
12197 1 19 . 1 1 52 52 CYS N N 77 115.347 115.347 116.648 -1.301 17865
12198 1 19 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.187 0.293 17865
12199 1 19 . 1 1 52 52 CYS C C 77 176.299 176.299 176.648 -0.349 17865
12200 1 19 . 1 1 52 52 CYS CA C 77 57.701 57.701 60.685 -2.984 17865
12201 1 19 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.499 10.132 17865
12202 1 19 . 1 1 52 52 CYS H H 77 9.073 9.073 8.246 0.827 17865
12203 1 19 . 1 1 53 53 ALA N N 78 128.517 128.517 122.967 5.550 17865
12204 1 19 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.781 0.074 17865
12205 1 19 . 1 1 53 53 ALA C C 78 178.736 178.736 178.962 -0.226 17865
12206 1 19 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.172 0.461 17865
12207 1 19 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.877 1.314 17865
12208 1 19 . 1 1 53 53 ALA H H 78 7.174 7.174 7.816 -0.642 17865
12209 1 19 . 1 1 54 54 LYS N N 79 118.706 118.706 120.091 -1.385 17865
12210 1 19 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.112 -0.309 17865
12211 1 19 . 1 1 54 54 LYS C C 79 179.611 179.611 179.180 0.431 17865
12212 1 19 . 1 1 54 54 LYS CA C 79 59.725 59.725 59.042 0.683 17865
12213 1 19 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.202 0.451 17865
12214 1 19 . 1 1 54 54 LYS H H 79 8.313 8.313 7.963 0.350 17865
12215 1 19 . 1 1 55 55 GLY N N 80 104.822 104.822 107.469 -2.647 17865
12216 1 19 . 1 1 55 55 GLY C C 80 176.504 176.504 176.128 0.376 17865
12217 1 19 . 1 1 55 55 GLY CA C 80 46.839 46.839 46.978 -0.139 17865
12218 1 19 . 1 1 55 55 GLY H H 80 8.175 8.175 7.565 0.610 17865
12219 1 19 . 1 1 56 56 ILE N N 81 123.697 123.697 123.459 0.238 17865
12220 1 19 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.830 -0.035 17865
12221 1 19 . 1 1 56 56 ILE C C 81 177.334 177.334 178.157 -0.823 17865
12222 1 19 . 1 1 56 56 ILE CA C 81 65.281 65.281 65.559 -0.278 17865
12223 1 19 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.548 0.787 17865
12224 1 19 . 1 1 56 56 ILE H H 81 7.590 7.590 8.036 -0.446 17865
12225 1 19 . 1 1 57 57 ARG N N 82 118.161 118.161 118.397 -0.236 17865
12226 1 19 . 1 1 57 57 ARG HA H 82 3.935 3.935 3.923 0.012 17865
12227 1 19 . 1 1 57 57 ARG C C 82 178.662 178.662 178.921 -0.259 17865
12228 1 19 . 1 1 57 57 ARG CA C 82 59.702 59.702 58.859 0.843 17865
12229 1 19 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.176 0.723 17865
12230 1 19 . 1 1 57 57 ARG H H 82 7.569 7.569 8.331 -0.762 17865
12231 1 19 . 1 1 58 58 GLU N N 83 115.085 115.085 118.341 -3.256 17865
12232 1 19 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.083 -0.052 17865
12233 1 19 . 1 1 58 58 GLU C C 83 178.224 178.224 179.239 -1.015 17865
12234 1 19 . 1 1 58 58 GLU CA C 83 58.304 58.304 58.576 -0.272 17865
12235 1 19 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.207 0.824 17865
12236 1 19 . 1 1 58 58 GLU H H 83 7.786 7.786 7.699 0.087 17865
12237 1 19 . 1 1 59 59 LYS N N 84 119.183 119.183 118.924 0.259 17865
12238 1 19 . 1 1 59 59 LYS HA H 84 3.830 3.830 4.026 -0.196 17865
12239 1 19 . 1 1 59 59 LYS C C 84 177.933 177.933 178.737 -0.804 17865
12240 1 19 . 1 1 59 59 LYS CA C 84 59.043 59.043 58.514 0.529 17865
12241 1 19 . 1 1 59 59 LYS CB C 84 33.650 33.650 33.076 0.574 17865
12242 1 19 . 1 1 59 59 LYS H H 84 7.968 7.968 8.196 -0.228 17865
12243 1 19 . 1 1 60 60 TYR N N 85 113.663 113.663 116.403 -2.740 17865
12244 1 19 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.596 0.107 17865
12245 1 19 . 1 1 60 60 TYR C C 85 174.729 174.729 175.414 -0.685 17865
12246 1 19 . 1 1 60 60 TYR CA C 85 57.202 57.202 57.345 -0.143 17865
12247 1 19 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.361 0.541 17865
12248 1 19 . 1 1 60 60 TYR H H 85 7.562 7.562 8.066 -0.504 17865
12249 1 19 . 1 1 61 61 LYS N N 86 121.862 121.862 123.527 -1.665 17865
12250 1 19 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.409 0.103 17865
12251 1 19 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.991 -1.049 17865
12252 1 19 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.696 -0.594 17865
12253 1 19 . 1 1 61 61 LYS H H 86 7.222 7.222 7.741 -0.519 17865
12254 1 19 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.559 -0.236 17865
12255 1 19 . 1 1 62 62 PRO C C 87 176.576 176.576 176.300 0.276 17865
12256 1 19 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.824 0.196 17865
12257 1 19 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.517 -0.277 17865
12258 1 19 . 1 1 63 63 ALA N N 88 125.029 125.029 128.959 -3.930 17865
12259 1 19 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.212 0.042 17865
12260 1 19 . 1 1 63 63 ALA C C 88 177.301 177.301 176.741 0.560 17865
12261 1 19 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.651 -0.370 17865
12262 1 19 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.959 1.243 17865
12263 1 19 . 1 1 63 63 ALA H H 88 8.329 8.329 8.417 -0.088 17865
12264 1 19 . 1 1 64 64 VAL N N 89 121.843 121.843 119.395 2.448 17865
12265 1 19 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.403 -0.459 17865
12266 1 19 . 1 1 64 64 VAL C C 89 174.791 174.791 174.134 0.657 17865
12267 1 19 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.351 1.630 17865
12268 1 19 . 1 1 64 64 VAL CB C 89 33.485 33.485 34.961 -1.476 17865
12269 1 19 . 1 1 64 64 VAL H H 89 8.075 8.075 7.751 0.324 17865
12270 1 19 . 1 1 65 65 VAL N N 90 125.399 125.399 118.521 6.878 17865
12271 1 19 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.264 -0.126 17865
12272 1 19 . 1 1 65 65 VAL C C 90 174.340 174.340 175.267 -0.927 17865
12273 1 19 . 1 1 65 65 VAL CA C 90 61.162 61.162 61.901 -0.739 17865
12274 1 19 . 1 1 65 65 VAL CB C 90 33.866 33.866 31.557 2.309 17865
12275 1 19 . 1 1 65 65 VAL H H 90 8.229 8.229 7.919 0.310 17865
12276 1 19 . 1 1 66 66 TYR N N 91 124.848 124.848 127.556 -2.708 17865
12277 1 19 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.769 0.002 17865
12278 1 19 . 1 1 66 66 TYR C C 91 176.658 176.658 176.418 0.240 17865
12279 1 19 . 1 1 66 66 TYR CA C 91 58.084 58.084 57.988 0.096 17865
12280 1 19 . 1 1 66 66 TYR CB C 91 41.535 41.535 40.501 1.034 17865
12281 1 19 . 1 1 66 66 TYR H H 91 9.145 9.145 7.959 1.186 17865
12282 1 19 . 1 1 67 67 GLY N N 92 106.185 106.185 107.010 -0.825 17865
12283 1 19 . 1 1 67 67 GLY C C 92 175.681 175.681 175.096 0.585 17865
12284 1 19 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.593 0.382 17865
12285 1 19 . 1 1 67 67 GLY H H 92 8.730 8.730 8.741 -0.011 17865
12286 1 19 . 1 1 68 68 TYR N N 93 121.815 121.815 117.760 4.055 17865
12287 1 19 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.342 -0.367 17865
12288 1 19 . 1 1 68 68 TYR C C 93 176.035 176.035 176.267 -0.232 17865
12289 1 19 . 1 1 68 68 TYR CA C 93 61.046 61.046 60.390 0.656 17865
12290 1 19 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.052 0.373 17865
12291 1 19 . 1 1 68 68 TYR H H 93 8.711 8.711 8.597 0.114 17865
12292 1 19 . 1 1 69 69 ASP N N 94 115.507 115.507 118.368 -2.861 17865
12293 1 19 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.562 -0.275 17865
12294 1 19 . 1 1 69 69 ASP C C 94 177.063 177.063 177.376 -0.313 17865
12295 1 19 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.482 -0.471 17865
12296 1 19 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.801 -0.634 17865
12297 1 19 . 1 1 69 69 ASP H H 94 8.010 8.010 7.602 0.408 17865
12298 1 19 . 1 1 70 70 GLY N N 95 107.196 107.196 107.534 -0.338 17865
12299 1 19 . 1 1 70 70 GLY C C 95 173.936 173.936 174.290 -0.354 17865
12300 1 19 . 1 1 70 70 GLY CA C 95 45.392 45.392 44.837 0.555 17865
12301 1 19 . 1 1 70 70 GLY H H 95 7.986 7.986 7.572 0.414 17865
12302 1 19 . 1 1 71 71 LYS N N 96 121.258 121.258 121.087 0.171 17865
12303 1 19 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.574 0.210 17865
12304 1 19 . 1 1 71 71 LYS CA C 96 54.114 54.114 54.400 -0.286 17865
12305 1 19 . 1 1 71 71 LYS CB C 96 31.762 31.762 32.471 -0.709 17865
12306 1 19 . 1 1 71 71 LYS H H 96 7.877 7.877 7.625 0.252 17865
12307 1 19 . 1 1 72 72 PRO C C 97 177.170 177.170 175.959 1.211 17865
12308 1 19 . 1 1 72 72 PRO CA C 97 63.137 63.137 62.454 0.683 17865
12309 1 19 . 1 1 72 72 PRO CB C 97 32.240 32.240 30.683 1.557 17865
12310 1 19 . 1 1 73 73 LEU N N 98 123.503 123.503 119.061 4.442 17865
12311 1 19 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.535 -0.175 17865
12312 1 19 . 1 1 73 73 LEU C C 98 176.354 176.354 176.650 -0.296 17865
12313 1 19 . 1 1 73 73 LEU CA C 98 53.927 53.927 52.940 0.987 17865
12314 1 19 . 1 1 73 73 LEU CB C 98 42.272 42.272 42.267 0.005 17865
12315 1 19 . 1 1 73 73 LEU H H 98 8.850 8.850 7.548 1.302 17865
12316 1 19 . 1 1 74 74 ASP N N 99 122.212 122.212 121.560 0.652 17865
12317 1 19 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.662 -0.065 17865
12318 1 19 . 1 1 74 74 ASP C C 99 175.819 175.819 176.882 -1.063 17865
12319 1 19 . 1 1 74 74 ASP CA C 99 53.856 53.856 54.476 -0.620 17865
12320 1 19 . 1 1 74 74 ASP CB C 99 40.989 40.989 42.627 -1.637 17865
12321 1 19 . 1 1 74 74 ASP H H 99 8.517 8.517 8.406 0.111 17865
12322 1 19 . 1 1 75 75 LEU N N 100 125.874 125.874 112.367 13.507 17865
12323 1 19 . 1 1 75 75 LEU HA H 100 4.366 4.366 3.907 0.459 17865
12324 1 19 . 1 1 75 75 LEU C C 100 178.426 178.426 177.754 0.672 17865
12325 1 19 . 1 1 75 75 LEU CA C 100 53.631 53.631 55.771 -2.140 17865
12326 1 19 . 1 1 75 75 LEU CB C 100 40.676 40.676 39.408 1.268 17865
12327 1 19 . 1 1 75 75 LEU H H 100 8.281 8.281 8.562 -0.281 17865
12328 1 19 . 1 1 76 76 GLY N N 101 110.604 110.604 109.886 0.718 17865
12329 1 19 . 1 1 76 76 GLY C C 101 176.936 176.936 175.134 1.802 17865
12330 1 19 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.296 0.531 17865
12331 1 19 . 1 1 76 76 GLY H H 101 8.914 8.914 8.740 0.174 17865
12332 1 19 . 1 1 77 77 PHE N N 102 117.639 117.639 114.038 3.601 17865
12333 1 19 . 1 1 77 77 PHE HA H 102 4.381 4.381 5.003 -0.622 17865
12334 1 19 . 1 1 77 77 PHE C C 102 177.878 177.878 174.839 3.039 17865
12335 1 19 . 1 1 77 77 PHE CA C 102 59.139 59.139 55.622 3.517 17865
12336 1 19 . 1 1 77 77 PHE CB C 102 36.935 36.935 38.121 -1.186 17865
12337 1 19 . 1 1 77 77 PHE H H 102 7.992 7.992 7.797 0.195 17865
12338 1 19 . 1 1 78 78 CYS N N 103 121.136 121.136 118.301 2.835 17865
12339 1 19 . 1 1 78 78 CYS HA H 103 4.385 4.385 5.107 -0.722 17865
12340 1 19 . 1 1 78 78 CYS C C 103 172.780 172.780 176.596 -3.816 17865
12341 1 19 . 1 1 78 78 CYS CA C 103 53.696 53.696 58.328 -4.631 17865
12342 1 19 . 1 1 78 78 CYS CB C 103 34.237 34.237 28.196 6.041 17865
12343 1 19 . 1 1 78 78 CYS H H 103 7.362 7.362 7.381 -0.019 17865
12344 1 19 . 1 1 79 79 THR N N 104 114.773 114.773 115.779 -1.006 17865
12345 1 19 . 1 1 79 79 THR HA H 104 3.984 3.984 4.239 -0.255 17865
12346 1 19 . 1 1 79 79 THR C C 104 176.624 176.624 175.684 0.940 17865
12347 1 19 . 1 1 79 79 THR CA C 104 65.180 65.180 64.489 0.691 17865
12348 1 19 . 1 1 79 79 THR CB C 104 69.062 69.062 68.349 0.713 17865
12349 1 19 . 1 1 79 79 THR H H 104 7.864 7.864 7.683 0.181 17865
12350 1 19 . 1 1 80 80 LEU N N 105 119.785 119.785 120.378 -0.593 17865
12351 1 19 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.176 0.155 17865
12352 1 19 . 1 1 80 80 LEU C C 105 177.208 177.208 177.687 -0.479 17865
12353 1 19 . 1 1 80 80 LEU CA C 105 55.453 55.453 56.878 -1.425 17865
12354 1 19 . 1 1 80 80 LEU CB C 105 41.293 41.293 41.502 -0.209 17865
12355 1 19 . 1 1 80 80 LEU H H 105 7.238 7.238 7.980 -0.742 17865
12356 1 19 . 1 1 81 81 ALA N N 106 119.309 119.309 119.088 0.221 17865
12357 1 19 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.389 0.138 17865
12358 1 19 . 1 1 81 81 ALA C C 106 178.769 178.769 178.729 0.040 17865
12359 1 19 . 1 1 81 81 ALA CA C 106 52.049 52.049 52.804 -0.755 17865
12360 1 19 . 1 1 81 81 ALA CB C 106 18.820 18.820 19.870 -1.050 17865
12361 1 19 . 1 1 81 81 ALA H H 106 7.432 7.432 8.198 -0.766 17865
12362 1 19 . 1 1 82 82 GLY N N 107 109.793 109.793 107.382 2.411 17865
12363 1 19 . 1 1 82 82 GLY CA C 107 47.119 47.119 46.647 0.472 17865
12364 1 19 . 1 1 82 82 GLY H H 107 7.918 7.918 7.676 0.242 17865
12365 1 19 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.803 0.463 17865
12366 1 19 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.915 -0.652 17865
12367 1 19 . 1 1 83 83 ILE CB C 108 38.261 38.261 37.636 0.625 17865
12368 1 19 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.229 0.526 17865
12369 1 19 . 1 1 84 84 ARG C C 109 181.344 181.344 177.241 4.103 17865
12370 1 19 . 1 1 84 84 ARG CA C 109 55.939 55.939 55.245 0.694 17865
12371 1 19 . 1 1 84 84 ARG CB C 109 30.283 30.283 28.461 1.822 17865
12372 1 19 . 1 1 85 85 GLU N N 110 122.944 122.944 120.962 1.982 17865
12373 1 19 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.129 -0.512 17865
12374 1 19 . 1 1 85 85 GLU C C 110 177.797 177.797 178.168 -0.371 17865
12375 1 19 . 1 1 85 85 GLU CA C 110 60.728 60.728 60.061 0.667 17865
12376 1 19 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.476 -0.605 17865
12377 1 19 . 1 1 85 85 GLU H H 110 8.003 8.003 7.601 0.402 17865
12378 1 19 . 1 1 86 86 VAL N N 111 117.101 117.101 113.940 3.161 17865
12379 1 19 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.730 -0.219 17865
12380 1 19 . 1 1 86 86 VAL C C 111 177.710 177.710 177.596 0.114 17865
12381 1 19 . 1 1 86 86 VAL CA C 111 66.430 66.430 65.414 1.016 17865
12382 1 19 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.506 -0.293 17865
12383 1 19 . 1 1 86 86 VAL H H 111 8.106 8.106 7.970 0.136 17865
12384 1 19 . 1 1 87 87 ASP N N 112 122.242 122.242 119.665 2.577 17865
12385 1 19 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.467 -0.163 17865
12386 1 19 . 1 1 87 87 ASP C C 112 176.912 176.912 178.307 -1.395 17865
12387 1 19 . 1 1 87 87 ASP CA C 112 57.417 57.417 57.219 0.198 17865
12388 1 19 . 1 1 87 87 ASP CB C 112 40.476 40.476 41.226 -0.750 17865
12389 1 19 . 1 1 87 87 ASP H H 112 7.401 7.401 7.731 -0.330 17865
12390 1 19 . 1 1 88 88 CYS N N 113 120.819 120.819 120.884 -0.065 17865
12391 1 19 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.110 -0.801 17865
12392 1 19 . 1 1 88 88 CYS C C 113 175.270 175.270 176.535 -1.265 17865
12393 1 19 . 1 1 88 88 CYS CA C 113 59.759 59.759 61.074 -1.315 17865
12394 1 19 . 1 1 88 88 CYS CB C 113 33.835 33.835 25.971 7.864 17865
12395 1 19 . 1 1 88 88 CYS H H 113 7.785 7.785 8.480 -0.695 17865
12396 1 19 . 1 1 89 89 ARG N N 114 118.654 118.654 119.453 -0.799 17865
12397 1 19 . 1 1 89 89 ARG HA H 114 3.641 3.641 3.907 -0.266 17865
12398 1 19 . 1 1 89 89 ARG C C 114 179.018 179.018 178.324 0.694 17865
12399 1 19 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.315 0.879 17865
12400 1 19 . 1 1 89 89 ARG CB C 114 29.713 29.713 30.012 -0.299 17865
12401 1 19 . 1 1 89 89 ARG H H 114 8.142 8.142 7.771 0.371 17865
12402 1 19 . 1 1 90 90 LYS N N 115 120.964 120.964 116.809 4.155 17865
12403 1 19 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.150 -0.120 17865
12404 1 19 . 1 1 90 90 LYS C C 115 180.092 180.092 177.572 2.520 17865
12405 1 19 . 1 1 90 90 LYS CA C 115 59.568 59.568 58.948 0.620 17865
12406 1 19 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.366 -0.145 17865
12407 1 19 . 1 1 90 90 LYS H H 115 7.936 7.936 7.646 0.290 17865
12408 1 19 . 1 1 91 91 ASP N N 116 121.690 121.690 118.864 2.826 17865
12409 1 19 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.613 -0.100 17865
12410 1 19 . 1 1 91 91 ASP C C 116 179.419 179.419 178.021 1.398 17865
12411 1 19 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.651 0.586 17865
12412 1 19 . 1 1 91 91 ASP CB C 116 40.648 40.648 41.046 -0.398 17865
12413 1 19 . 1 1 91 91 ASP H H 116 8.558 8.558 7.375 1.183 17865
12414 1 19 . 1 1 92 92 ALA N N 117 122.784 122.784 123.137 -0.353 17865
12415 1 19 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.209 -0.186 17865
12416 1 19 . 1 1 92 92 ALA C C 117 178.789 178.789 179.587 -0.798 17865
12417 1 19 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.517 -0.466 17865
12418 1 19 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.613 0.561 17865
12419 1 19 . 1 1 92 92 ALA H H 117 8.703 8.703 8.286 0.417 17865
12420 1 19 . 1 1 93 93 GLN N N 118 115.510 115.510 115.097 0.413 17865
12421 1 19 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.221 -0.277 17865
12422 1 19 . 1 1 93 93 GLN C C 118 178.745 178.745 177.420 1.325 17865
12423 1 19 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.474 1.008 17865
12424 1 19 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.437 -0.040 17865
12425 1 19 . 1 1 93 93 GLN H H 118 7.664 7.664 8.576 -0.912 17865
12426 1 19 . 1 1 94 94 THR N N 119 110.110 110.110 109.942 0.168 17865
12427 1 19 . 1 1 94 94 THR HA H 119 4.237 4.237 4.363 -0.126 17865
12428 1 19 . 1 1 94 94 THR C C 119 175.861 175.861 175.766 0.095 17865
12429 1 19 . 1 1 94 94 THR CA C 119 64.604 64.604 63.709 0.895 17865
12430 1 19 . 1 1 94 94 THR CB C 119 69.716 69.716 68.801 0.915 17865
12431 1 19 . 1 1 94 94 THR H H 119 7.726 7.726 7.719 0.007 17865
12432 1 19 . 1 1 95 95 CYS N N 120 118.523 118.523 122.299 -3.776 17865
12433 1 19 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.391 0.342 17865
12434 1 19 . 1 1 95 95 CYS C C 120 175.165 175.165 175.193 -0.028 17865
12435 1 19 . 1 1 95 95 CYS CA C 120 52.973 52.973 59.386 -6.412 17865
12436 1 19 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.815 11.916 17865
12437 1 19 . 1 1 95 95 CYS H H 120 7.756 7.756 8.445 -0.689 17865
12438 1 19 . 1 1 96 96 ASP N N 121 119.081 119.081 121.499 -2.418 17865
12439 1 19 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.434 0.244 17865
12440 1 19 . 1 1 96 96 ASP CA C 121 56.224 56.224 57.214 -0.990 17865
12441 1 19 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.373 1.358 17865
12442 1 19 . 1 1 96 96 ASP H H 121 7.354 7.354 8.432 -1.078 17865
12443 1 19 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.455 -0.880 17865
12444 1 19 . 1 1 97 97 LYS C C 122 175.510 175.510 177.959 -2.449 17865
12445 1 19 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.323 0.516 17865
12446 1 19 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.943 -4.193 17865
12447 1 19 . 1 1 98 98 LYS N N 123 119.980 119.980 119.760 0.220 17865
12448 1 19 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.616 -0.322 17865
12449 1 19 . 1 1 98 98 LYS C C 123 176.968 176.968 178.205 -1.237 17865
12450 1 19 . 1 1 98 98 LYS CA C 123 55.904 55.904 57.950 -2.046 17865
12451 1 19 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.532 -0.301 17865
12452 1 19 . 1 1 98 98 LYS H H 123 7.799 7.799 8.510 -0.711 17865
12453 1 19 . 1 1 99 99 TYR N N 124 122.378 122.378 121.212 1.166 17865
12454 1 19 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.315 -0.420 17865
12455 1 19 . 1 1 99 99 TYR C C 124 177.126 177.126 176.251 0.875 17865
12456 1 19 . 1 1 99 99 TYR CA C 124 60.211 60.211 60.680 -0.469 17865
12457 1 19 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.602 -0.331 17865
12458 1 19 . 1 1 99 99 TYR H H 124 8.536 8.536 8.380 0.156 17865
12459 1 19 . 1 1 100 100 GLU N N 125 118.610 118.610 116.652 1.958 17865
12460 1 19 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.392 -0.124 17865
12461 1 19 . 1 1 100 100 GLU C C 125 177.387 177.387 177.387 0.000 17865
12462 1 19 . 1 1 100 100 GLU CA C 125 55.759 55.759 57.525 -1.766 17865
12463 1 19 . 1 1 100 100 GLU CB C 125 27.321 27.321 29.057 -1.736 17865
12464 1 19 . 1 1 100 100 GLU H H 125 8.385 8.385 8.637 -0.252 17865
12465 1 19 . 1 1 101 101 SER N N 126 115.949 115.949 116.282 -0.333 17865
12466 1 19 . 1 1 101 101 SER HA H 126 3.959 3.959 4.198 -0.239 17865
12467 1 19 . 1 1 101 101 SER C C 126 176.047 176.047 176.246 -0.199 17865
12468 1 19 . 1 1 101 101 SER CA C 126 62.439 62.439 61.260 1.179 17865
12469 1 19 . 1 1 101 101 SER CB C 126 63.299 63.299 62.852 0.447 17865
12470 1 19 . 1 1 101 101 SER H H 126 7.823 7.823 8.009 -0.186 17865
12471 1 19 . 1 1 102 102 ASP N N 127 120.920 120.920 122.003 -1.083 17865
12472 1 19 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.306 0.101 17865
12473 1 19 . 1 1 102 102 ASP C C 127 178.234 178.234 177.955 0.279 17865
12474 1 19 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.711 -0.300 17865
12475 1 19 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.810 -1.094 17865
12476 1 19 . 1 1 102 102 ASP H H 127 8.683 8.683 7.811 0.872 17865
12477 1 19 . 1 1 103 103 LYS N N 128 121.753 121.753 117.575 4.178 17865
12478 1 19 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.138 -0.134 17865
12479 1 19 . 1 1 103 103 LYS C C 128 179.395 179.395 178.350 1.045 17865
12480 1 19 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.267 1.204 17865
12481 1 19 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.684 0.717 17865
12482 1 19 . 1 1 103 103 LYS H H 128 7.771 7.771 8.162 -0.391 17865
12483 1 19 . 1 1 104 104 CYS N N 129 120.109 120.109 120.386 -0.277 17865
12484 1 19 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.413 -0.219 17865
12485 1 19 . 1 1 104 104 CYS C C 129 176.779 176.779 176.983 -0.204 17865
12486 1 19 . 1 1 104 104 CYS CA C 129 59.790 59.790 60.707 -0.917 17865
12487 1 19 . 1 1 104 104 CYS CB C 129 36.879 36.879 26.490 10.389 17865
12488 1 19 . 1 1 104 104 CYS H H 129 7.973 7.973 7.738 0.235 17865
12489 1 19 . 1 1 105 105 LEU N N 130 121.804 121.804 122.436 -0.632 17865
12490 1 19 . 1 1 105 105 LEU HA H 130 4.090 4.090 4.044 0.046 17865
12491 1 19 . 1 1 105 105 LEU C C 130 179.373 179.373 179.026 0.347 17865
12492 1 19 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.209 -0.841 17865
12493 1 19 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.141 0.957 17865
12494 1 19 . 1 1 105 105 LEU H H 130 8.666 8.666 8.763 -0.097 17865
12495 1 19 . 1 1 106 106 ASN N N 131 118.535 118.535 115.779 2.756 17865
12496 1 19 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.365 -0.127 17865
12497 1 19 . 1 1 106 106 ASN C C 131 177.830 177.830 177.260 0.570 17865
12498 1 19 . 1 1 106 106 ASN CA C 131 56.256 56.256 55.817 0.439 17865
12499 1 19 . 1 1 106 106 ASN CB C 131 37.817 37.817 38.122 -0.305 17865
12500 1 19 . 1 1 106 106 ASN H H 131 8.438 8.438 8.016 0.422 17865
12501 1 19 . 1 1 107 107 ALA N N 132 121.485 121.485 123.094 -1.609 17865
12502 1 19 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.241 -0.022 17865
12503 1 19 . 1 1 107 107 ALA C C 132 180.726 180.726 179.573 1.153 17865
12504 1 19 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.618 0.345 17865
12505 1 19 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.920 -1.099 17865
12506 1 19 . 1 1 107 107 ALA H H 132 7.541 7.541 7.396 0.145 17865
12507 1 19 . 1 1 108 108 ILE N N 133 120.979 120.979 118.700 2.279 17865
12508 1 19 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.781 0.150 17865
12509 1 19 . 1 1 108 108 ILE C C 133 178.114 178.114 178.272 -0.158 17865
12510 1 19 . 1 1 108 108 ILE CA C 133 63.353 63.353 63.883 -0.530 17865
12511 1 19 . 1 1 108 108 ILE CB C 133 36.454 36.454 36.754 -0.300 17865
12512 1 19 . 1 1 108 108 ILE H H 133 7.551 7.551 8.485 -0.934 17865
12513 1 19 . 1 1 109 109 LYS N N 134 121.415 121.415 118.442 2.973 17865
12514 1 19 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.063 -0.475 17865
12515 1 19 . 1 1 109 109 LYS C C 134 179.561 179.561 178.378 1.183 17865
12516 1 19 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.914 0.194 17865
12517 1 19 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.412 -0.251 17865
12518 1 19 . 1 1 109 109 LYS H H 134 8.414 8.414 7.630 0.784 17865
12519 1 19 . 1 1 110 110 GLU N N 135 116.099 116.099 118.450 -2.351 17865
12520 1 19 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.171 -0.242 17865
12521 1 19 . 1 1 110 110 GLU C C 135 178.239 178.239 178.792 -0.553 17865
12522 1 19 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.842 -0.195 17865
12523 1 19 . 1 1 110 110 GLU CB C 135 29.638 29.638 28.907 0.731 17865
12524 1 19 . 1 1 110 110 GLU H H 135 7.473 7.473 7.879 -0.406 17865
12525 1 19 . 1 1 111 111 LYS N N 136 119.805 119.805 119.079 0.726 17865
12526 1 19 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.059 -0.153 17865
12527 1 19 . 1 1 111 111 LYS C C 136 177.600 177.600 177.710 -0.110 17865
12528 1 19 . 1 1 111 111 LYS CA C 136 58.749 58.749 57.772 0.977 17865
12529 1 19 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.293 0.945 17865
12530 1 19 . 1 1 111 111 LYS H H 136 7.540 7.540 7.689 -0.149 17865
12531 1 19 . 1 1 112 112 TYR N N 137 114.768 114.768 116.804 -2.036 17865
12532 1 19 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.537 -0.014 17865
12533 1 19 . 1 1 112 112 TYR C C 137 174.690 174.690 174.624 0.066 17865
12534 1 19 . 1 1 112 112 TYR CA C 137 58.359 58.359 56.985 1.374 17865
12535 1 19 . 1 1 112 112 TYR CB C 137 38.328 38.328 37.620 0.708 17865
12536 1 19 . 1 1 112 112 TYR H H 137 7.488 7.488 7.419 0.069 17865
12537 1 19 . 1 1 113 113 LYS N N 138 123.694 123.694 121.580 2.114 17865
12538 1 19 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.363 0.138 17865
12539 1 19 . 1 1 113 113 LYS CA C 138 55.282 55.282 55.063 0.219 17865
12540 1 19 . 1 1 113 113 LYS CB C 138 32.124 32.124 31.961 0.163 17865
12541 1 19 . 1 1 113 113 LYS H H 138 7.217 7.217 7.258 -0.041 17865
12542 1 19 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.529 -0.077 17865
12543 1 19 . 1 1 114 114 PRO C C 139 176.974 176.974 176.823 0.151 17865
12544 1 19 . 1 1 114 114 PRO CA C 139 63.189 63.189 62.851 0.338 17865
12545 1 19 . 1 1 114 114 PRO CB C 139 32.251 32.251 32.323 -0.072 17865
12546 1 19 . 1 1 115 115 VAL N N 140 121.098 121.098 119.726 1.372 17865
12547 1 19 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.253 -0.151 17865
12548 1 19 . 1 1 115 115 VAL C C 140 176.207 176.207 176.454 -0.247 17865
12549 1 19 . 1 1 115 115 VAL CA C 140 62.356 62.356 62.352 0.004 17865
12550 1 19 . 1 1 115 115 VAL CB C 140 33.256 33.256 31.803 1.453 17865
12551 1 19 . 1 1 115 115 VAL H H 140 8.272 8.272 8.020 0.252 17865
12552 1 19 . 1 1 116 116 VAL N N 141 124.167 124.167 121.755 2.412 17865
12553 1 19 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.124 -0.002 17865
12554 1 19 . 1 1 116 116 VAL C C 141 175.415 175.415 176.177 -0.762 17865
12555 1 19 . 1 1 116 116 VAL CA C 141 61.731 61.731 62.348 -0.617 17865
12556 1 19 . 1 1 116 116 VAL CB C 141 33.145 33.145 32.397 0.748 17865
12557 1 19 . 1 1 116 116 VAL H H 141 8.142 8.142 7.525 0.617 17865
12558 1 19 . 1 1 117 117 ASP N N 142 126.737 126.737 125.267 1.470 17865
12559 1 19 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.768 0.044 17865
12560 1 19 . 1 1 117 117 ASP CA C 142 52.217 52.217 52.153 0.064 17865
12561 1 19 . 1 1 117 117 ASP CB C 142 41.368 41.368 40.504 0.864 17865
12562 1 19 . 1 1 117 117 ASP H H 142 8.419 8.419 8.309 0.110 17865
12563 1 19 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.453 -0.042 17865
12564 1 19 . 1 1 118 118 PRO C C 143 176.662 176.662 175.952 0.710 17865
12565 1 19 . 1 1 118 118 PRO CA C 143 63.247 63.247 62.585 0.662 17865
12566 1 19 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.262 0.048 17865
12567 1 19 . 1 1 119 119 ASN N N 144 119.287 119.287 119.193 0.094 17865
12568 1 19 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.931 0.016 17865
12569 1 19 . 1 1 119 119 ASN CA C 144 51.633 51.633 51.604 0.029 17865
12570 1 19 . 1 1 119 119 ASN CB C 144 38.859 38.859 38.498 0.361 17865
12571 1 19 . 1 1 119 119 ASN H H 144 8.432 8.432 8.390 0.042 17865
12572 1 19 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.544 0.136 17865
12573 1 19 . 1 1 120 120 PRO CA C 145 61.640 61.640 61.964 -0.324 17865
12574 1 19 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.663 -0.745 17865
12575 1 19 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.280 0.097 17865
12576 1 19 . 1 1 121 121 PRO C C 146 175.876 175.876 175.825 0.051 17865
12577 1 19 . 1 1 121 121 PRO CA C 146 63.174 63.174 63.635 -0.461 17865
12578 1 19 . 1 1 121 121 PRO CB C 146 31.939 31.939 31.088 0.851 17865
12579 1 20 . 1 1 2 2 ASP N N 27 121.041 121.041 117.299 3.742 17865
12580 1 20 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.323 0.315 17865
12581 1 20 . 1 1 2 2 ASP C C 27 175.878 175.878 175.808 0.070 17865
12582 1 20 . 1 1 2 2 ASP CA C 27 54.382 54.382 56.118 -1.736 17865
12583 1 20 . 1 1 2 2 ASP CB C 27 41.729 41.729 40.661 1.068 17865
12584 1 20 . 1 1 2 2 ASP H H 27 8.639 8.639 8.435 0.204 17865
12585 1 20 . 1 1 3 3 VAL N N 28 119.901 119.901 119.670 0.231 17865
12586 1 20 . 1 1 3 3 VAL HA H 28 4.033 4.033 3.989 0.044 17865
12587 1 20 . 1 1 3 3 VAL C C 28 175.521 175.521 175.757 -0.236 17865
12588 1 20 . 1 1 3 3 VAL CA C 28 62.216 62.216 61.862 0.354 17865
12589 1 20 . 1 1 3 3 VAL CB C 28 33.003 33.003 32.666 0.337 17865
12590 1 20 . 1 1 3 3 VAL H H 28 8.113 8.113 7.581 0.532 17865
12591 1 20 . 1 1 4 4 PHE N N 29 123.707 123.707 122.288 1.419 17865
12592 1 20 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.451 0.205 17865
12593 1 20 . 1 1 4 4 PHE C C 29 174.874 174.874 175.581 -0.707 17865
12594 1 20 . 1 1 4 4 PHE CA C 29 57.159 57.159 57.697 -0.538 17865
12595 1 20 . 1 1 4 4 PHE CB C 29 39.795 39.795 39.334 0.461 17865
12596 1 20 . 1 1 4 4 PHE H H 29 8.255 8.255 8.271 -0.016 17865
12597 1 20 . 1 1 5 5 ASP N N 30 124.203 124.203 121.277 2.926 17865
12598 1 20 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.687 0.151 17865
12599 1 20 . 1 1 5 5 ASP CA C 30 52.385 52.385 53.404 -1.020 17865
12600 1 20 . 1 1 5 5 ASP CB C 30 40.801 40.801 40.608 0.193 17865
12601 1 20 . 1 1 5 5 ASP H H 30 8.226 8.226 8.524 -0.298 17865
12602 1 20 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.625 -0.088 17865
12603 1 20 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.236 -0.572 17865
12604 1 20 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.460 -0.634 17865
12605 1 20 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.446 -0.020 17865
12606 1 20 . 1 1 7 7 PRO C C 32 177.226 177.226 176.895 0.331 17865
12607 1 20 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.252 -0.083 17865
12608 1 20 . 1 1 7 7 PRO CB C 32 31.948 31.948 32.263 -0.315 17865
12609 1 20 . 1 1 8 8 THR N N 33 114.158 114.158 117.772 -3.614 17865
12610 1 20 . 1 1 8 8 THR HA H 33 4.195 4.195 4.370 -0.175 17865
12611 1 20 . 1 1 8 8 THR C C 33 174.468 174.468 173.681 0.787 17865
12612 1 20 . 1 1 8 8 THR CA C 33 62.110 62.110 61.116 0.994 17865
12613 1 20 . 1 1 8 8 THR CB C 33 69.975 69.975 67.529 2.446 17865
12614 1 20 . 1 1 8 8 THR H H 33 8.096 8.096 8.463 -0.367 17865
12615 1 20 . 1 1 9 9 GLN N N 34 122.411 122.411 124.638 -2.227 17865
12616 1 20 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.310 -0.047 17865
12617 1 20 . 1 1 9 9 GLN C C 34 175.445 175.445 173.820 1.625 17865
12618 1 20 . 1 1 9 9 GLN CA C 34 55.763 55.763 55.109 0.654 17865
12619 1 20 . 1 1 9 9 GLN CB C 34 29.691 29.691 28.902 0.789 17865
12620 1 20 . 1 1 9 9 GLN H H 34 8.278 8.278 7.924 0.354 17865
12621 1 20 . 1 1 10 10 TYR N N 35 121.048 121.048 118.863 2.185 17865
12622 1 20 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.951 -0.431 17865
12623 1 20 . 1 1 10 10 TYR C C 35 176.314 176.314 174.096 2.218 17865
12624 1 20 . 1 1 10 10 TYR CA C 35 57.972 57.972 55.587 2.385 17865
12625 1 20 . 1 1 10 10 TYR CB C 35 38.936 38.936 40.438 -1.502 17865
12626 1 20 . 1 1 10 10 TYR H H 35 8.227 8.227 6.980 1.247 17865
12627 1 20 . 1 1 11 11 GLY N N 36 109.711 109.711 107.938 1.773 17865
12628 1 20 . 1 1 11 11 GLY C C 36 174.128 174.128 174.387 -0.259 17865
12629 1 20 . 1 1 11 11 GLY CA C 36 45.212 45.212 46.216 -1.004 17865
12630 1 20 . 1 1 11 11 GLY H H 36 8.247 8.247 8.397 -0.150 17865
12631 1 20 . 1 1 12 12 TYR N N 37 120.302 120.302 120.416 -0.114 17865
12632 1 20 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.634 -0.152 17865
12633 1 20 . 1 1 12 12 TYR C C 37 175.864 175.864 175.053 0.811 17865
12634 1 20 . 1 1 12 12 TYR CA C 37 58.541 58.541 58.938 -0.397 17865
12635 1 20 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.254 -0.539 17865
12636 1 20 . 1 1 12 12 TYR H H 37 8.101 8.101 7.879 0.222 17865
12637 1 20 . 1 1 13 13 ASP N N 38 121.883 121.883 117.853 4.030 17865
12638 1 20 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.427 0.059 17865
12639 1 20 . 1 1 13 13 ASP C C 38 176.538 176.538 174.770 1.768 17865
12640 1 20 . 1 1 13 13 ASP CA C 38 54.223 54.223 53.978 0.245 17865
12641 1 20 . 1 1 13 13 ASP CB C 38 40.988 40.988 41.033 -0.046 17865
12642 1 20 . 1 1 13 13 ASP H H 38 8.266 8.266 7.030 1.236 17865
12643 1 20 . 1 1 14 14 GLY N N 39 107.705 107.705 107.464 0.241 17865
12644 1 20 . 1 1 14 14 GLY C C 39 173.822 173.822 173.362 0.460 17865
12645 1 20 . 1 1 14 14 GLY CA C 39 45.404 45.404 44.883 0.521 17865
12646 1 20 . 1 1 14 14 GLY H H 39 7.647 7.647 7.859 -0.212 17865
12647 1 20 . 1 1 15 15 LYS N N 40 121.621 121.621 119.339 2.282 17865
12648 1 20 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.853 -0.278 17865
12649 1 20 . 1 1 15 15 LYS CA C 40 54.100 54.100 52.945 1.155 17865
12650 1 20 . 1 1 15 15 LYS CB C 40 32.510 32.510 33.442 -0.932 17865
12651 1 20 . 1 1 15 15 LYS H H 40 7.908 7.908 7.358 0.550 17865
12652 1 20 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.943 -0.591 17865
12653 1 20 . 1 1 16 16 PRO C C 41 176.806 176.806 176.617 0.189 17865
12654 1 20 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.400 0.358 17865
12655 1 20 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.947 -0.633 17865
12656 1 20 . 1 1 17 17 LEU N N 42 123.488 123.488 120.314 3.174 17865
12657 1 20 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.346 -0.297 17865
12658 1 20 . 1 1 17 17 LEU C C 42 174.973 174.973 176.695 -1.722 17865
12659 1 20 . 1 1 17 17 LEU CA C 42 55.436 55.436 54.997 0.439 17865
12660 1 20 . 1 1 17 17 LEU CB C 42 42.093 42.093 42.392 -0.299 17865
12661 1 20 . 1 1 17 17 LEU H H 42 8.499 8.499 8.436 0.063 17865
12662 1 20 . 1 1 18 18 ASP N N 43 123.354 123.354 123.522 -0.168 17865
12663 1 20 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.781 -0.283 17865
12664 1 20 . 1 1 18 18 ASP C C 43 175.947 175.947 176.910 -0.963 17865
12665 1 20 . 1 1 18 18 ASP CA C 43 52.858 52.858 52.915 -0.057 17865
12666 1 20 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.606 -2.385 17865
12667 1 20 . 1 1 18 18 ASP H H 43 7.789 7.789 8.169 -0.380 17865
12668 1 20 . 1 1 19 19 ALA N N 44 120.147 120.147 126.871 -6.724 17865
12669 1 20 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.216 -0.230 17865
12670 1 20 . 1 1 19 19 ALA C C 44 179.476 179.476 179.065 0.411 17865
12671 1 20 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.234 0.929 17865
12672 1 20 . 1 1 19 19 ALA CB C 44 18.387 18.387 19.164 -0.777 17865
12673 1 20 . 1 1 19 19 ALA H H 44 8.561 8.561 8.636 -0.075 17865
12674 1 20 . 1 1 20 20 SER N N 45 115.037 115.037 115.809 -0.772 17865
12675 1 20 . 1 1 20 20 SER HA H 45 4.151 4.151 4.110 0.041 17865
12676 1 20 . 1 1 20 20 SER C C 45 177.191 177.191 176.188 1.003 17865
12677 1 20 . 1 1 20 20 SER CA C 45 61.629 61.629 62.183 -0.554 17865
12678 1 20 . 1 1 20 20 SER CB C 45 62.804 62.804 63.023 -0.219 17865
12679 1 20 . 1 1 20 20 SER H H 45 8.466 8.466 8.676 -0.210 17865
12680 1 20 . 1 1 21 21 PHE N N 46 125.030 125.030 122.155 2.875 17865
12681 1 20 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.266 -0.035 17865
12682 1 20 . 1 1 21 21 PHE C C 46 176.850 176.850 177.349 -0.499 17865
12683 1 20 . 1 1 21 21 PHE CA C 46 60.806 60.806 61.965 -1.159 17865
12684 1 20 . 1 1 21 21 PHE CB C 46 39.881 39.881 38.987 0.894 17865
12685 1 20 . 1 1 21 21 PHE H H 46 8.034 8.034 7.762 0.272 17865
12686 1 20 . 1 1 22 22 CYS N N 47 113.943 113.943 117.826 -3.883 17865
12687 1 20 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.069 0.182 17865
12688 1 20 . 1 1 22 22 CYS C C 47 176.449 176.449 176.897 -0.448 17865
12689 1 20 . 1 1 22 22 CYS CA C 47 53.600 53.600 61.544 -7.944 17865
12690 1 20 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.598 10.793 17865
12691 1 20 . 1 1 22 22 CYS H H 47 7.691 7.691 8.606 -0.915 17865
12692 1 20 . 1 1 23 23 ARG N N 48 119.958 119.958 119.694 0.264 17865
12693 1 20 . 1 1 23 23 ARG HA H 48 4.080 4.080 3.969 0.111 17865
12694 1 20 . 1 1 23 23 ARG C C 48 177.904 177.904 178.197 -0.293 17865
12695 1 20 . 1 1 23 23 ARG CA C 48 58.907 58.907 59.399 -0.492 17865
12696 1 20 . 1 1 23 23 ARG CB C 48 30.171 30.171 30.083 0.088 17865
12697 1 20 . 1 1 23 23 ARG H H 48 7.628 7.628 8.446 -0.818 17865
12698 1 20 . 1 1 24 24 THR N N 49 106.445 106.445 108.086 -1.641 17865
12699 1 20 . 1 1 24 24 THR HA H 49 4.385 4.385 4.263 0.122 17865
12700 1 20 . 1 1 24 24 THR C C 49 174.758 174.758 174.960 -0.202 17865
12701 1 20 . 1 1 24 24 THR CA C 49 61.573 61.573 63.290 -1.717 17865
12702 1 20 . 1 1 24 24 THR CB C 49 68.794 68.794 68.884 -0.090 17865
12703 1 20 . 1 1 24 24 THR H H 49 7.307 7.307 7.562 -0.255 17865
12704 1 20 . 1 1 25 25 ALA N N 50 122.242 122.242 123.457 -1.215 17865
12705 1 20 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.093 0.311 17865
12706 1 20 . 1 1 25 25 ALA C C 50 178.554 178.554 178.349 0.205 17865
12707 1 20 . 1 1 25 25 ALA CA C 50 52.381 52.381 53.517 -1.136 17865
12708 1 20 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.430 -1.035 17865
12709 1 20 . 1 1 25 25 ALA H H 50 7.401 7.401 7.322 0.079 17865
12710 1 20 . 1 1 26 26 GLY N N 51 110.604 110.604 106.299 4.305 17865
12711 1 20 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.663 0.360 17865
12712 1 20 . 1 1 26 26 GLY H H 51 8.285 8.285 8.146 0.139 17865
12713 1 20 . 1 1 27 27 SER HA H 52 4.382 4.382 4.246 0.136 17865
12714 1 20 . 1 1 27 27 SER C C 52 175.774 175.774 175.034 0.740 17865
12715 1 20 . 1 1 27 27 SER CA C 52 60.803 60.803 60.889 -0.086 17865
12716 1 20 . 1 1 27 27 SER CB C 52 62.827 62.827 63.089 -0.262 17865
12717 1 20 . 1 1 28 28 ARG N N 53 119.682 119.682 116.871 2.811 17865
12718 1 20 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.670 0.210 17865
12719 1 20 . 1 1 28 28 ARG C C 53 175.796 175.796 175.786 0.010 17865
12720 1 20 . 1 1 28 28 ARG CA C 53 55.738 55.738 55.394 0.344 17865
12721 1 20 . 1 1 28 28 ARG CB C 53 30.237 30.237 29.355 0.882 17865
12722 1 20 . 1 1 28 28 ARG H H 53 7.894 7.894 8.294 -0.400 17865
12723 1 20 . 1 1 29 29 GLU N N 54 122.318 122.318 123.469 -1.151 17865
12724 1 20 . 1 1 29 29 GLU HA H 54 3.595 3.595 4.078 -0.483 17865
12725 1 20 . 1 1 29 29 GLU C C 54 177.523 177.523 177.291 0.232 17865
12726 1 20 . 1 1 29 29 GLU CA C 54 61.223 61.223 59.894 1.329 17865
12727 1 20 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.738 -0.801 17865
12728 1 20 . 1 1 29 29 GLU H H 54 7.730 7.730 7.840 -0.110 17865
12729 1 20 . 1 1 30 30 LYS N N 55 118.377 118.377 119.046 -0.669 17865
12730 1 20 . 1 1 30 30 LYS HA H 55 3.828 3.828 3.973 -0.145 17865
12731 1 20 . 1 1 30 30 LYS C C 55 179.205 179.205 178.323 0.882 17865
12732 1 20 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.938 0.489 17865
12733 1 20 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.116 -0.515 17865
12734 1 20 . 1 1 30 30 LYS H H 55 8.659 8.659 8.421 0.238 17865
12735 1 20 . 1 1 31 31 ASP N N 56 121.614 121.614 118.550 3.064 17865
12736 1 20 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.420 -0.109 17865
12737 1 20 . 1 1 31 31 ASP C C 56 177.393 177.393 177.669 -0.276 17865
12738 1 20 . 1 1 31 31 ASP CA C 56 57.316 57.316 57.264 0.052 17865
12739 1 20 . 1 1 31 31 ASP CB C 56 40.423 40.423 40.637 -0.214 17865
12740 1 20 . 1 1 31 31 ASP H H 56 7.646 7.646 8.357 -0.711 17865
12741 1 20 . 1 1 32 32 CYS N N 57 120.345 120.345 118.467 1.878 17865
12742 1 20 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.198 0.403 17865
12743 1 20 . 1 1 32 32 CYS C C 57 175.772 175.772 176.153 -0.381 17865
12744 1 20 . 1 1 32 32 CYS CA C 57 60.197 60.197 60.360 -0.163 17865
12745 1 20 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.774 8.192 17865
12746 1 20 . 1 1 32 32 CYS H H 57 8.042 8.042 7.606 0.436 17865
12747 1 20 . 1 1 33 33 ARG N N 58 120.293 120.293 121.154 -0.861 17865
12748 1 20 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.825 -0.149 17865
12749 1 20 . 1 1 33 33 ARG C C 58 179.633 179.633 178.446 1.187 17865
12750 1 20 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.853 0.533 17865
12751 1 20 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.902 -0.062 17865
12752 1 20 . 1 1 33 33 ARG H H 58 8.531 8.531 8.223 0.308 17865
12753 1 20 . 1 1 34 34 LYS N N 59 121.166 121.166 116.976 4.190 17865
12754 1 20 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.096 -0.060 17865
12755 1 20 . 1 1 34 34 LYS C C 59 179.220 179.220 179.104 0.116 17865
12756 1 20 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.764 0.766 17865
12757 1 20 . 1 1 34 34 LYS CB C 59 32.110 32.110 31.873 0.236 17865
12758 1 20 . 1 1 34 34 LYS H H 59 7.633 7.633 7.783 -0.150 17865
12759 1 20 . 1 1 35 35 ASP N N 60 122.166 122.166 120.458 1.708 17865
12760 1 20 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.532 -0.101 17865
12761 1 20 . 1 1 35 35 ASP C C 60 179.709 179.709 178.663 1.046 17865
12762 1 20 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.263 0.440 17865
12763 1 20 . 1 1 35 35 ASP CB C 60 40.672 40.672 41.206 -0.534 17865
12764 1 20 . 1 1 35 35 ASP H H 60 8.221 8.221 7.407 0.814 17865
12765 1 20 . 1 1 36 36 VAL N N 61 121.312 121.312 119.729 1.583 17865
12766 1 20 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.642 -0.241 17865
12767 1 20 . 1 1 36 36 VAL C C 61 178.339 178.339 177.298 1.041 17865
12768 1 20 . 1 1 36 36 VAL CA C 61 67.133 67.133 66.084 1.049 17865
12769 1 20 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.909 -0.252 17865
12770 1 20 . 1 1 36 36 VAL H H 61 8.916 8.916 8.228 0.688 17865
12771 1 20 . 1 1 37 37 GLN N N 62 119.166 119.166 115.932 3.234 17865
12772 1 20 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.077 -0.135 17865
12773 1 20 . 1 1 37 37 GLN C C 62 177.293 177.293 177.336 -0.043 17865
12774 1 20 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.354 0.926 17865
12775 1 20 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.703 -0.332 17865
12776 1 20 . 1 1 37 37 GLN H H 62 7.697 7.697 7.606 0.091 17865
12777 1 20 . 1 1 38 38 ALA N N 63 118.964 118.964 120.774 -1.810 17865
12778 1 20 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.257 -0.015 17865
12779 1 20 . 1 1 38 38 ALA C C 63 177.221 177.221 178.413 -1.192 17865
12780 1 20 . 1 1 38 38 ALA CA C 63 53.137 53.137 53.510 -0.373 17865
12781 1 20 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.237 -0.340 17865
12782 1 20 . 1 1 38 38 ALA H H 63 7.508 7.508 7.457 0.051 17865
12783 1 20 . 1 1 39 39 CYS N N 64 119.081 119.081 118.791 0.290 17865
12784 1 20 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.437 0.516 17865
12785 1 20 . 1 1 39 39 CYS C C 64 172.052 172.052 174.949 -2.897 17865
12786 1 20 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.047 -6.167 17865
12787 1 20 . 1 1 39 39 CYS CB C 64 34.328 34.328 24.630 9.698 17865
12788 1 20 . 1 1 39 39 CYS H H 64 7.354 7.354 7.869 -0.515 17865
12789 1 20 . 1 1 40 40 ASP N N 65 124.167 124.167 125.655 -1.488 17865
12790 1 20 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.424 -0.099 17865
12791 1 20 . 1 1 40 40 ASP C C 65 176.496 176.496 176.451 0.045 17865
12792 1 20 . 1 1 40 40 ASP CA C 65 56.724 56.724 57.005 -0.281 17865
12793 1 20 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.562 -0.249 17865
12794 1 20 . 1 1 40 40 ASP H H 65 8.142 8.142 8.032 0.110 17865
12795 1 20 . 1 1 41 41 LYS N N 66 118.844 118.844 119.033 -0.189 17865
12796 1 20 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.441 0.083 17865
12797 1 20 . 1 1 41 41 LYS C C 66 175.586 175.586 176.280 -0.694 17865
12798 1 20 . 1 1 41 41 LYS CA C 66 55.275 55.275 56.046 -0.771 17865
12799 1 20 . 1 1 41 41 LYS CB C 66 32.598 32.598 31.119 1.479 17865
12800 1 20 . 1 1 41 41 LYS H H 66 7.858 7.858 8.513 -0.655 17865
12801 1 20 . 1 1 42 42 LYS N N 67 126.081 126.081 121.226 4.855 17865
12802 1 20 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.165 -0.250 17865
12803 1 20 . 1 1 42 42 LYS C C 67 174.665 174.665 175.125 -0.460 17865
12804 1 20 . 1 1 42 42 LYS CA C 67 57.827 57.827 57.335 0.492 17865
12805 1 20 . 1 1 42 42 LYS CB C 67 34.059 34.059 33.295 0.764 17865
12806 1 20 . 1 1 42 42 LYS H H 67 8.790 8.790 7.887 0.903 17865
12807 1 20 . 1 1 43 43 TYR N N 68 114.138 114.138 115.873 -1.735 17865
12808 1 20 . 1 1 43 43 TYR HA H 68 5.259 5.259 5.051 0.208 17865
12809 1 20 . 1 1 43 43 TYR C C 68 175.767 175.767 174.752 1.015 17865
12810 1 20 . 1 1 43 43 TYR CA C 68 55.880 55.880 56.943 -1.063 17865
12811 1 20 . 1 1 43 43 TYR CB C 68 42.363 42.363 42.001 0.362 17865
12812 1 20 . 1 1 43 43 TYR H H 68 7.294 7.294 7.344 -0.050 17865
12813 1 20 . 1 1 44 44 ASP N N 69 121.807 121.807 121.928 -0.121 17865
12814 1 20 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.759 -0.119 17865
12815 1 20 . 1 1 44 44 ASP C C 69 177.812 177.812 177.733 0.079 17865
12816 1 20 . 1 1 44 44 ASP CA C 69 52.110 52.110 53.381 -1.271 17865
12817 1 20 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.585 -2.145 17865
12818 1 20 . 1 1 44 44 ASP H H 69 8.995 8.995 9.101 -0.106 17865
12819 1 20 . 1 1 45 45 ASP N N 70 116.686 116.686 121.719 -5.033 17865
12820 1 20 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.481 -0.057 17865
12821 1 20 . 1 1 45 45 ASP C C 70 177.054 177.054 177.021 0.033 17865
12822 1 20 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.517 -0.135 17865
12823 1 20 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.829 -0.581 17865
12824 1 20 . 1 1 45 45 ASP H H 70 8.369 8.369 8.792 -0.423 17865
12825 1 20 . 1 1 46 46 GLN N N 71 117.949 117.949 117.280 0.669 17865
12826 1 20 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.357 0.099 17865
12827 1 20 . 1 1 46 46 GLN C C 71 176.273 176.273 176.871 -0.598 17865
12828 1 20 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.829 -0.462 17865
12829 1 20 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.204 0.126 17865
12830 1 20 . 1 1 46 46 GLN H H 71 8.274 8.274 8.199 0.075 17865
12831 1 20 . 1 1 47 47 GLY N N 72 108.369 108.369 107.709 0.660 17865
12832 1 20 . 1 1 47 47 GLY C C 72 174.145 174.145 173.720 0.425 17865
12833 1 20 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.249 0.574 17865
12834 1 20 . 1 1 47 47 GLY H H 72 8.174 8.174 8.126 0.048 17865
12835 1 20 . 1 1 48 48 ARG N N 73 121.554 121.554 118.948 2.606 17865
12836 1 20 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.754 -0.269 17865
12837 1 20 . 1 1 48 48 ARG C C 73 176.855 176.855 175.262 1.593 17865
12838 1 20 . 1 1 48 48 ARG CA C 73 55.289 55.289 53.827 1.462 17865
12839 1 20 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.578 -1.020 17865
12840 1 20 . 1 1 48 48 ARG H H 73 8.462 8.462 7.889 0.573 17865
12841 1 20 . 1 1 49 49 GLU N N 74 122.784 122.784 120.319 2.465 17865
12842 1 20 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.731 -0.248 17865
12843 1 20 . 1 1 49 49 GLU C C 74 178.098 178.098 176.646 1.452 17865
12844 1 20 . 1 1 49 49 GLU CA C 74 57.184 57.184 55.466 1.718 17865
12845 1 20 . 1 1 49 49 GLU CB C 74 30.777 30.777 30.739 0.038 17865
12846 1 20 . 1 1 49 49 GLU H H 74 8.703 8.703 8.600 0.103 17865
12847 1 20 . 1 1 50 50 THR N N 75 114.563 114.563 111.775 2.788 17865
12848 1 20 . 1 1 50 50 THR HA H 75 4.212 4.212 4.409 -0.197 17865
12849 1 20 . 1 1 50 50 THR C C 75 175.170 175.170 175.557 -0.387 17865
12850 1 20 . 1 1 50 50 THR CA C 75 60.589 60.589 60.751 -0.162 17865
12851 1 20 . 1 1 50 50 THR CB C 75 70.952 70.952 70.266 0.686 17865
12852 1 20 . 1 1 50 50 THR H H 75 7.717 7.717 7.835 -0.118 17865
12853 1 20 . 1 1 51 51 ALA N N 76 122.097 122.097 122.260 -0.163 17865
12854 1 20 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.053 -0.015 17865
12855 1 20 . 1 1 51 51 ALA C C 76 181.906 181.906 179.484 2.422 17865
12856 1 20 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.141 0.513 17865
12857 1 20 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.245 -0.252 17865
12858 1 20 . 1 1 51 51 ALA H H 76 8.734 8.734 8.647 0.087 17865
12859 1 20 . 1 1 52 52 CYS N N 77 115.347 115.347 114.977 0.370 17865
12860 1 20 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.188 0.292 17865
12861 1 20 . 1 1 52 52 CYS C C 77 176.299 176.299 176.951 -0.652 17865
12862 1 20 . 1 1 52 52 CYS CA C 77 57.701 57.701 59.590 -1.889 17865
12863 1 20 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.571 10.060 17865
12864 1 20 . 1 1 52 52 CYS H H 77 9.073 9.073 8.152 0.921 17865
12865 1 20 . 1 1 53 53 ALA N N 78 128.517 128.517 125.219 3.298 17865
12866 1 20 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.913 -0.058 17865
12867 1 20 . 1 1 53 53 ALA C C 78 178.736 178.736 179.138 -0.402 17865
12868 1 20 . 1 1 53 53 ALA CA C 78 55.633 55.633 54.991 0.642 17865
12869 1 20 . 1 1 53 53 ALA CB C 78 19.191 19.191 18.302 0.889 17865
12870 1 20 . 1 1 53 53 ALA H H 78 7.174 7.174 7.642 -0.468 17865
12871 1 20 . 1 1 54 54 LYS N N 79 118.706 118.706 117.196 1.510 17865
12872 1 20 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.326 -0.523 17865
12873 1 20 . 1 1 54 54 LYS C C 79 179.611 179.611 178.881 0.730 17865
12874 1 20 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.209 1.516 17865
12875 1 20 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.275 0.378 17865
12876 1 20 . 1 1 54 54 LYS H H 79 8.313 8.313 7.967 0.346 17865
12877 1 20 . 1 1 55 55 GLY N N 80 104.822 104.822 108.817 -3.995 17865
12878 1 20 . 1 1 55 55 GLY C C 80 176.504 176.504 175.799 0.705 17865
12879 1 20 . 1 1 55 55 GLY CA C 80 46.839 46.839 46.927 -0.088 17865
12880 1 20 . 1 1 55 55 GLY H H 80 8.175 8.175 7.779 0.396 17865
12881 1 20 . 1 1 56 56 ILE N N 81 123.697 123.697 122.180 1.517 17865
12882 1 20 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.983 -0.188 17865
12883 1 20 . 1 1 56 56 ILE C C 81 177.334 177.334 178.116 -0.782 17865
12884 1 20 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.651 0.630 17865
12885 1 20 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.821 0.514 17865
12886 1 20 . 1 1 56 56 ILE H H 81 7.590 7.590 7.416 0.174 17865
12887 1 20 . 1 1 57 57 ARG N N 82 118.161 118.161 118.844 -0.683 17865
12888 1 20 . 1 1 57 57 ARG HA H 82 3.935 3.935 4.022 -0.087 17865
12889 1 20 . 1 1 57 57 ARG C C 82 178.662 178.662 178.843 -0.181 17865
12890 1 20 . 1 1 57 57 ARG CA C 82 59.702 59.702 58.738 0.964 17865
12891 1 20 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.313 0.586 17865
12892 1 20 . 1 1 57 57 ARG H H 82 7.569 7.569 7.551 0.018 17865
12893 1 20 . 1 1 58 58 GLU N N 83 115.085 115.085 118.462 -3.377 17865
12894 1 20 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.118 -0.087 17865
12895 1 20 . 1 1 58 58 GLU C C 83 178.224 178.224 178.357 -0.133 17865
12896 1 20 . 1 1 58 58 GLU CA C 83 58.304 58.304 58.758 -0.454 17865
12897 1 20 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.437 0.594 17865
12898 1 20 . 1 1 58 58 GLU H H 83 7.786 7.786 7.983 -0.197 17865
12899 1 20 . 1 1 59 59 LYS N N 84 119.183 119.183 118.838 0.345 17865
12900 1 20 . 1 1 59 59 LYS HA H 84 3.830 3.830 4.024 -0.194 17865
12901 1 20 . 1 1 59 59 LYS C C 84 177.933 177.933 178.936 -1.003 17865
12902 1 20 . 1 1 59 59 LYS CA C 84 59.043 59.043 58.266 0.777 17865
12903 1 20 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.800 0.850 17865
12904 1 20 . 1 1 59 59 LYS H H 84 7.968 7.968 7.742 0.226 17865
12905 1 20 . 1 1 60 60 TYR N N 85 113.663 113.663 116.224 -2.561 17865
12906 1 20 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.610 0.093 17865
12907 1 20 . 1 1 60 60 TYR C C 85 174.729 174.729 175.285 -0.556 17865
12908 1 20 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.196 1.006 17865
12909 1 20 . 1 1 60 60 TYR CB C 85 37.902 37.902 36.639 1.263 17865
12910 1 20 . 1 1 60 60 TYR H H 85 7.562 7.562 7.538 0.024 17865
12911 1 20 . 1 1 61 61 LYS N N 86 121.862 121.862 120.802 1.060 17865
12912 1 20 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.298 0.214 17865
12913 1 20 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.991 -1.049 17865
12914 1 20 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.003 0.099 17865
12915 1 20 . 1 1 61 61 LYS H H 86 7.222 7.222 7.722 -0.500 17865
12916 1 20 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.420 -0.097 17865
12917 1 20 . 1 1 62 62 PRO C C 87 176.576 176.576 176.528 0.048 17865
12918 1 20 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.594 0.425 17865
12919 1 20 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.373 -0.133 17865
12920 1 20 . 1 1 63 63 ALA N N 88 125.029 125.029 125.337 -0.308 17865
12921 1 20 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.258 -0.004 17865
12922 1 20 . 1 1 63 63 ALA C C 88 177.301 177.301 176.819 0.482 17865
12923 1 20 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.513 -0.232 17865
12924 1 20 . 1 1 63 63 ALA CB C 88 19.202 19.202 18.308 0.894 17865
12925 1 20 . 1 1 63 63 ALA H H 88 8.329 8.329 8.715 -0.386 17865
12926 1 20 . 1 1 64 64 VAL N N 89 121.843 121.843 123.245 -1.402 17865
12927 1 20 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.202 -0.258 17865
12928 1 20 . 1 1 64 64 VAL C C 89 174.791 174.791 174.455 0.336 17865
12929 1 20 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.641 1.340 17865
12930 1 20 . 1 1 64 64 VAL CB C 89 33.485 33.485 34.600 -1.115 17865
12931 1 20 . 1 1 64 64 VAL H H 89 8.075 8.075 7.864 0.211 17865
12932 1 20 . 1 1 65 65 VAL N N 90 125.399 125.399 124.918 0.481 17865
12933 1 20 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.283 -0.145 17865
12934 1 20 . 1 1 65 65 VAL C C 90 174.340 174.340 174.661 -0.321 17865
12935 1 20 . 1 1 65 65 VAL CA C 90 61.162 61.162 62.154 -0.993 17865
12936 1 20 . 1 1 65 65 VAL CB C 90 33.866 33.866 30.142 3.724 17865
12937 1 20 . 1 1 65 65 VAL H H 90 8.229 8.229 8.209 0.020 17865
12938 1 20 . 1 1 66 66 TYR N N 91 124.848 124.848 127.366 -2.518 17865
12939 1 20 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.895 -0.124 17865
12940 1 20 . 1 1 66 66 TYR C C 91 176.658 176.658 175.836 0.822 17865
12941 1 20 . 1 1 66 66 TYR CA C 91 58.084 58.084 55.854 2.230 17865
12942 1 20 . 1 1 66 66 TYR CB C 91 41.535 41.535 42.328 -0.793 17865
12943 1 20 . 1 1 66 66 TYR H H 91 9.145 9.145 8.092 1.053 17865
12944 1 20 . 1 1 67 67 GLY N N 92 106.185 106.185 107.140 -0.955 17865
12945 1 20 . 1 1 67 67 GLY C C 92 175.681 175.681 174.918 0.763 17865
12946 1 20 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.794 0.181 17865
12947 1 20 . 1 1 67 67 GLY H H 92 8.730 8.730 8.561 0.169 17865
12948 1 20 . 1 1 68 68 TYR N N 93 121.815 121.815 117.322 4.493 17865
12949 1 20 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.426 -0.451 17865
12950 1 20 . 1 1 68 68 TYR C C 93 176.035 176.035 175.772 0.263 17865
12951 1 20 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.887 1.159 17865
12952 1 20 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.455 -0.030 17865
12953 1 20 . 1 1 68 68 TYR H H 93 8.711 8.711 8.648 0.063 17865
12954 1 20 . 1 1 69 69 ASP N N 94 115.507 115.507 119.421 -3.914 17865
12955 1 20 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.312 -0.024 17865
12956 1 20 . 1 1 69 69 ASP C C 94 177.063 177.063 176.974 0.089 17865
12957 1 20 . 1 1 69 69 ASP CA C 94 53.011 53.011 52.917 0.094 17865
12958 1 20 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.102 0.064 17865
12959 1 20 . 1 1 69 69 ASP H H 94 8.010 8.010 7.437 0.573 17865
12960 1 20 . 1 1 70 70 GLY N N 95 107.196 107.196 107.334 -0.138 17865
12961 1 20 . 1 1 70 70 GLY C C 95 173.936 173.936 173.462 0.474 17865
12962 1 20 . 1 1 70 70 GLY CA C 95 45.392 45.392 45.317 0.075 17865
12963 1 20 . 1 1 70 70 GLY H H 95 7.986 7.986 7.545 0.441 17865
12964 1 20 . 1 1 71 71 LYS N N 96 121.258 121.258 120.855 0.403 17865
12965 1 20 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.335 0.449 17865
12966 1 20 . 1 1 71 71 LYS CA C 96 54.114 54.114 53.294 0.820 17865
12967 1 20 . 1 1 71 71 LYS CB C 96 31.762 31.762 32.442 -0.680 17865
12968 1 20 . 1 1 71 71 LYS H H 96 7.877 7.877 7.541 0.336 17865
12969 1 20 . 1 1 72 72 PRO C C 97 177.170 177.170 175.777 1.393 17865
12970 1 20 . 1 1 72 72 PRO CA C 97 63.137 63.137 63.134 0.003 17865
12971 1 20 . 1 1 72 72 PRO CB C 97 32.240 32.240 31.318 0.922 17865
12972 1 20 . 1 1 73 73 LEU N N 98 123.503 123.503 125.661 -2.158 17865
12973 1 20 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.566 -0.206 17865
12974 1 20 . 1 1 73 73 LEU C C 98 176.354 176.354 175.205 1.149 17865
12975 1 20 . 1 1 73 73 LEU CA C 98 53.927 53.927 53.882 0.045 17865
12976 1 20 . 1 1 73 73 LEU CB C 98 42.272 42.272 45.094 -2.822 17865
12977 1 20 . 1 1 73 73 LEU H H 98 8.850 8.850 7.949 0.901 17865
12978 1 20 . 1 1 74 74 ASP N N 99 122.212 122.212 127.662 -5.450 17865
12979 1 20 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.640 -0.043 17865
12980 1 20 . 1 1 74 74 ASP C C 99 175.819 175.819 176.435 -0.616 17865
12981 1 20 . 1 1 74 74 ASP CA C 99 53.856 53.856 54.985 -1.129 17865
12982 1 20 . 1 1 74 74 ASP CB C 99 40.989 40.989 42.040 -1.051 17865
12983 1 20 . 1 1 74 74 ASP H H 99 8.517 8.517 8.684 -0.167 17865
12984 1 20 . 1 1 75 75 LEU N N 100 125.874 125.874 116.431 9.443 17865
12985 1 20 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.090 0.276 17865
12986 1 20 . 1 1 75 75 LEU C C 100 178.426 178.426 177.100 1.326 17865
12987 1 20 . 1 1 75 75 LEU CA C 100 53.631 53.631 55.662 -2.031 17865
12988 1 20 . 1 1 75 75 LEU CB C 100 40.676 40.676 38.965 1.711 17865
12989 1 20 . 1 1 75 75 LEU H H 100 8.281 8.281 8.616 -0.335 17865
12990 1 20 . 1 1 76 76 GLY N N 101 110.604 110.604 108.425 2.179 17865
12991 1 20 . 1 1 76 76 GLY C C 101 176.936 176.936 175.639 1.297 17865
12992 1 20 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.316 0.511 17865
12993 1 20 . 1 1 76 76 GLY H H 101 8.914 8.914 8.049 0.865 17865
12994 1 20 . 1 1 77 77 PHE N N 102 117.639 117.639 120.252 -2.613 17865
12995 1 20 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.709 -0.328 17865
12996 1 20 . 1 1 77 77 PHE C C 102 177.878 177.878 176.008 1.870 17865
12997 1 20 . 1 1 77 77 PHE CA C 102 59.139 59.139 58.394 0.745 17865
12998 1 20 . 1 1 77 77 PHE CB C 102 36.935 36.935 39.726 -2.791 17865
12999 1 20 . 1 1 77 77 PHE H H 102 7.992 7.992 8.218 -0.226 17865
13000 1 20 . 1 1 78 78 CYS N N 103 121.136 121.136 118.095 3.041 17865
13001 1 20 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.627 -0.242 17865
13002 1 20 . 1 1 78 78 CYS C C 103 172.780 172.780 176.032 -3.252 17865
13003 1 20 . 1 1 78 78 CYS CA C 103 53.696 53.696 58.584 -4.888 17865
13004 1 20 . 1 1 78 78 CYS CB C 103 34.237 34.237 26.755 7.482 17865
13005 1 20 . 1 1 78 78 CYS H H 103 7.362 7.362 7.891 -0.529 17865
13006 1 20 . 1 1 79 79 THR N N 104 114.773 114.773 117.019 -2.246 17865
13007 1 20 . 1 1 79 79 THR HA H 104 3.984 3.984 4.494 -0.510 17865
13008 1 20 . 1 1 79 79 THR C C 104 176.624 176.624 174.916 1.708 17865
13009 1 20 . 1 1 79 79 THR CA C 104 65.180 65.180 64.467 0.713 17865
13010 1 20 . 1 1 79 79 THR CB C 104 69.062 69.062 68.351 0.711 17865
13011 1 20 . 1 1 79 79 THR H H 104 7.864 7.864 7.753 0.111 17865
13012 1 20 . 1 1 80 80 LEU N N 105 119.785 119.785 119.703 0.082 17865
13013 1 20 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.204 0.127 17865
13014 1 20 . 1 1 80 80 LEU C C 105 177.208 177.208 176.446 0.762 17865
13015 1 20 . 1 1 80 80 LEU CA C 105 55.453 55.453 54.885 0.568 17865
13016 1 20 . 1 1 80 80 LEU CB C 105 41.293 41.293 41.541 -0.248 17865
13017 1 20 . 1 1 80 80 LEU H H 105 7.238 7.238 7.435 -0.197 17865
13018 1 20 . 1 1 81 81 ALA N N 106 119.309 119.309 121.176 -1.867 17865
13019 1 20 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.724 -0.197 17865
13020 1 20 . 1 1 81 81 ALA C C 106 178.769 178.769 176.401 2.368 17865
13021 1 20 . 1 1 81 81 ALA CA C 106 52.049 52.049 50.977 1.072 17865
13022 1 20 . 1 1 81 81 ALA CB C 106 18.820 18.820 21.467 -2.647 17865
13023 1 20 . 1 1 81 81 ALA H H 106 7.432 7.432 7.546 -0.114 17865
13024 1 20 . 1 1 82 82 GLY N N 107 109.793 109.793 107.063 2.730 17865
13025 1 20 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.344 1.775 17865
13026 1 20 . 1 1 82 82 GLY H H 107 7.918 7.918 8.251 -0.333 17865
13027 1 20 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.927 0.339 17865
13028 1 20 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.096 0.167 17865
13029 1 20 . 1 1 83 83 ILE CB C 108 38.261 38.261 38.207 0.054 17865
13030 1 20 . 1 1 84 84 ARG HA H 109 4.755 4.755 3.950 0.805 17865
13031 1 20 . 1 1 84 84 ARG C C 109 181.344 181.344 177.980 3.364 17865
13032 1 20 . 1 1 84 84 ARG CA C 109 55.939 55.939 58.686 -2.747 17865
13033 1 20 . 1 1 84 84 ARG CB C 109 30.283 30.283 29.306 0.977 17865
13034 1 20 . 1 1 85 85 GLU N N 110 122.944 122.944 120.685 2.259 17865
13035 1 20 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.152 -0.535 17865
13036 1 20 . 1 1 85 85 GLU C C 110 177.797 177.797 178.279 -0.482 17865
13037 1 20 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.462 1.266 17865
13038 1 20 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.557 -0.686 17865
13039 1 20 . 1 1 85 85 GLU H H 110 8.003 8.003 7.553 0.450 17865
13040 1 20 . 1 1 86 86 VAL N N 111 117.101 117.101 118.416 -1.315 17865
13041 1 20 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.649 -0.138 17865
13042 1 20 . 1 1 86 86 VAL C C 111 177.710 177.710 178.150 -0.440 17865
13043 1 20 . 1 1 86 86 VAL CA C 111 66.430 66.430 65.961 0.469 17865
13044 1 20 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.227 -0.014 17865
13045 1 20 . 1 1 86 86 VAL H H 111 8.106 8.106 7.566 0.540 17865
13046 1 20 . 1 1 87 87 ASP N N 112 122.242 122.242 119.875 2.367 17865
13047 1 20 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.392 -0.088 17865
13048 1 20 . 1 1 87 87 ASP C C 112 176.912 176.912 178.815 -1.903 17865
13049 1 20 . 1 1 87 87 ASP CA C 112 57.417 57.417 57.805 -0.388 17865
13050 1 20 . 1 1 87 87 ASP CB C 112 40.476 40.476 40.776 -0.300 17865
13051 1 20 . 1 1 87 87 ASP H H 112 7.401 7.401 7.635 -0.234 17865
13052 1 20 . 1 1 88 88 CYS N N 113 120.819 120.819 120.049 0.770 17865
13053 1 20 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.104 -0.795 17865
13054 1 20 . 1 1 88 88 CYS C C 113 175.270 175.270 176.481 -1.211 17865
13055 1 20 . 1 1 88 88 CYS CA C 113 59.759 59.759 62.129 -2.370 17865
13056 1 20 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.335 7.500 17865
13057 1 20 . 1 1 88 88 CYS H H 113 7.785 7.785 8.216 -0.431 17865
13058 1 20 . 1 1 89 89 ARG N N 114 118.654 118.654 119.560 -0.906 17865
13059 1 20 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.167 -0.526 17865
13060 1 20 . 1 1 89 89 ARG C C 114 179.018 179.018 178.374 0.644 17865
13061 1 20 . 1 1 89 89 ARG CA C 114 60.193 60.193 58.735 1.458 17865
13062 1 20 . 1 1 89 89 ARG CB C 114 29.713 29.713 28.966 0.747 17865
13063 1 20 . 1 1 89 89 ARG H H 114 8.142 8.142 7.835 0.307 17865
13064 1 20 . 1 1 90 90 LYS N N 115 120.964 120.964 118.768 2.196 17865
13065 1 20 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.179 -0.149 17865
13066 1 20 . 1 1 90 90 LYS C C 115 180.092 180.092 177.844 2.248 17865
13067 1 20 . 1 1 90 90 LYS CA C 115 59.568 59.568 59.332 0.236 17865
13068 1 20 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.383 -0.162 17865
13069 1 20 . 1 1 90 90 LYS H H 115 7.936 7.936 7.667 0.269 17865
13070 1 20 . 1 1 91 91 ASP N N 116 121.690 121.690 119.166 2.524 17865
13071 1 20 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.520 -0.007 17865
13072 1 20 . 1 1 91 91 ASP C C 116 179.419 179.419 178.497 0.922 17865
13073 1 20 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.915 0.322 17865
13074 1 20 . 1 1 91 91 ASP CB C 116 40.648 40.648 41.334 -0.686 17865
13075 1 20 . 1 1 91 91 ASP H H 116 8.558 8.558 7.514 1.044 17865
13076 1 20 . 1 1 92 92 ALA N N 117 122.784 122.784 122.580 0.204 17865
13077 1 20 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.102 -0.079 17865
13078 1 20 . 1 1 92 92 ALA C C 117 178.789 178.789 179.302 -0.513 17865
13079 1 20 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.201 -0.150 17865
13080 1 20 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.723 0.452 17865
13081 1 20 . 1 1 92 92 ALA H H 117 8.703 8.703 8.419 0.284 17865
13082 1 20 . 1 1 93 93 GLN N N 118 115.510 115.510 115.007 0.503 17865
13083 1 20 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.116 -0.172 17865
13084 1 20 . 1 1 93 93 GLN C C 118 178.745 178.745 177.305 1.440 17865
13085 1 20 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.971 0.511 17865
13086 1 20 . 1 1 93 93 GLN CB C 118 28.397 28.397 27.715 0.682 17865
13087 1 20 . 1 1 93 93 GLN H H 118 7.664 7.664 8.574 -0.910 17865
13088 1 20 . 1 1 94 94 THR N N 119 110.110 110.110 114.037 -3.927 17865
13089 1 20 . 1 1 94 94 THR HA H 119 4.237 4.237 4.329 -0.092 17865
13090 1 20 . 1 1 94 94 THR C C 119 175.861 175.861 176.101 -0.240 17865
13091 1 20 . 1 1 94 94 THR CA C 119 64.604 64.604 64.252 0.352 17865
13092 1 20 . 1 1 94 94 THR CB C 119 69.716 69.716 69.279 0.437 17865
13093 1 20 . 1 1 94 94 THR H H 119 7.726 7.726 7.498 0.228 17865
13094 1 20 . 1 1 95 95 CYS N N 120 118.523 118.523 121.799 -3.276 17865
13095 1 20 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.291 0.442 17865
13096 1 20 . 1 1 95 95 CYS C C 120 175.165 175.165 174.647 0.518 17865
13097 1 20 . 1 1 95 95 CYS CA C 120 52.973 52.973 60.279 -7.306 17865
13098 1 20 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.309 12.422 17865
13099 1 20 . 1 1 95 95 CYS H H 120 7.756 7.756 7.928 -0.172 17865
13100 1 20 . 1 1 96 96 ASP N N 121 119.081 119.081 122.192 -3.111 17865
13101 1 20 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.552 0.126 17865
13102 1 20 . 1 1 96 96 ASP CA C 121 56.224 56.224 57.498 -1.274 17865
13103 1 20 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.678 1.053 17865
13104 1 20 . 1 1 96 96 ASP H H 121 7.354 7.354 8.613 -1.259 17865
13105 1 20 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.427 -0.852 17865
13106 1 20 . 1 1 97 97 LYS C C 122 175.510 175.510 178.487 -2.977 17865
13107 1 20 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.759 0.080 17865
13108 1 20 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.918 -4.168 17865
13109 1 20 . 1 1 98 98 LYS N N 123 119.980 119.980 118.786 1.194 17865
13110 1 20 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.491 -0.197 17865
13111 1 20 . 1 1 98 98 LYS C C 123 176.968 176.968 177.579 -0.611 17865
13112 1 20 . 1 1 98 98 LYS CA C 123 55.904 55.904 58.035 -2.131 17865
13113 1 20 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.477 -0.245 17865
13114 1 20 . 1 1 98 98 LYS H H 123 7.799 7.799 8.858 -1.059 17865
13115 1 20 . 1 1 99 99 TYR N N 124 122.378 122.378 121.664 0.714 17865
13116 1 20 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.404 -0.509 17865
13117 1 20 . 1 1 99 99 TYR C C 124 177.126 177.126 177.358 -0.232 17865
13118 1 20 . 1 1 99 99 TYR CA C 124 60.211 60.211 61.328 -1.117 17865
13119 1 20 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.451 -0.180 17865
13120 1 20 . 1 1 99 99 TYR H H 124 8.536 8.536 8.702 -0.166 17865
13121 1 20 . 1 1 100 100 GLU N N 125 118.610 118.610 118.125 0.485 17865
13122 1 20 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.205 0.063 17865
13123 1 20 . 1 1 100 100 GLU C C 125 177.387 177.387 178.626 -1.239 17865
13124 1 20 . 1 1 100 100 GLU CA C 125 55.759 55.759 59.330 -3.571 17865
13125 1 20 . 1 1 100 100 GLU CB C 125 27.321 27.321 28.586 -1.265 17865
13126 1 20 . 1 1 100 100 GLU H H 125 8.385 8.385 9.086 -0.701 17865
13127 1 20 . 1 1 101 101 SER N N 126 115.949 115.949 116.408 -0.459 17865
13128 1 20 . 1 1 101 101 SER HA H 126 3.959 3.959 4.085 -0.126 17865
13129 1 20 . 1 1 101 101 SER C C 126 176.047 176.047 176.020 0.027 17865
13130 1 20 . 1 1 101 101 SER CA C 126 62.439 62.439 62.175 0.264 17865
13131 1 20 . 1 1 101 101 SER CB C 126 63.299 63.299 63.080 0.220 17865
13132 1 20 . 1 1 101 101 SER H H 126 7.823 7.823 7.451 0.372 17865
13133 1 20 . 1 1 102 102 ASP N N 127 120.920 120.920 120.210 0.710 17865
13134 1 20 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.288 0.119 17865
13135 1 20 . 1 1 102 102 ASP C C 127 178.234 178.234 178.194 0.040 17865
13136 1 20 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.034 0.377 17865
13137 1 20 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.055 -0.339 17865
13138 1 20 . 1 1 102 102 ASP H H 127 8.683 8.683 7.803 0.880 17865
13139 1 20 . 1 1 103 103 LYS N N 128 121.753 121.753 119.038 2.715 17865
13140 1 20 . 1 1 103 103 LYS HA H 128 4.004 4.004 3.981 0.023 17865
13141 1 20 . 1 1 103 103 LYS C C 128 179.395 179.395 178.367 1.028 17865
13142 1 20 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.548 0.923 17865
13143 1 20 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.626 0.775 17865
13144 1 20 . 1 1 103 103 LYS H H 128 7.771 7.771 7.757 0.014 17865
13145 1 20 . 1 1 104 104 CYS N N 129 120.109 120.109 119.303 0.806 17865
13146 1 20 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.356 -0.162 17865
13147 1 20 . 1 1 104 104 CYS C C 129 176.779 176.779 176.544 0.235 17865
13148 1 20 . 1 1 104 104 CYS CA C 129 59.790 59.790 60.894 -1.103 17865
13149 1 20 . 1 1 104 104 CYS CB C 129 36.879 36.879 26.596 10.283 17865
13150 1 20 . 1 1 104 104 CYS H H 129 7.973 7.973 7.622 0.351 17865
13151 1 20 . 1 1 105 105 LEU N N 130 121.804 121.804 122.671 -0.867 17865
13152 1 20 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.954 0.136 17865
13153 1 20 . 1 1 105 105 LEU C C 130 179.373 179.373 178.749 0.624 17865
13154 1 20 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.354 -0.986 17865
13155 1 20 . 1 1 105 105 LEU CB C 130 42.098 42.098 42.181 -0.083 17865
13156 1 20 . 1 1 105 105 LEU H H 130 8.666 8.666 8.680 -0.014 17865
13157 1 20 . 1 1 106 106 ASN N N 131 118.535 118.535 116.114 2.421 17865
13158 1 20 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.462 -0.224 17865
13159 1 20 . 1 1 106 106 ASN C C 131 177.830 177.830 177.396 0.434 17865
13160 1 20 . 1 1 106 106 ASN CA C 131 56.256 56.256 55.829 0.427 17865
13161 1 20 . 1 1 106 106 ASN CB C 131 37.817 37.817 38.020 -0.203 17865
13162 1 20 . 1 1 106 106 ASN H H 131 8.438 8.438 8.339 0.099 17865
13163 1 20 . 1 1 107 107 ALA N N 132 121.485 121.485 123.403 -1.918 17865
13164 1 20 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.200 0.019 17865
13165 1 20 . 1 1 107 107 ALA C C 132 180.726 180.726 179.587 1.139 17865
13166 1 20 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.714 0.249 17865
13167 1 20 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.786 -0.965 17865
13168 1 20 . 1 1 107 107 ALA H H 132 7.541 7.541 7.417 0.124 17865
13169 1 20 . 1 1 108 108 ILE N N 133 120.979 120.979 117.637 3.342 17865
13170 1 20 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.636 0.295 17865
13171 1 20 . 1 1 108 108 ILE C C 133 178.114 178.114 178.011 0.103 17865
13172 1 20 . 1 1 108 108 ILE CA C 133 63.353 63.353 63.598 -0.245 17865
13173 1 20 . 1 1 108 108 ILE CB C 133 36.454 36.454 36.736 -0.282 17865
13174 1 20 . 1 1 108 108 ILE H H 133 7.551 7.551 8.552 -1.001 17865
13175 1 20 . 1 1 109 109 LYS N N 134 121.415 121.415 118.169 3.246 17865
13176 1 20 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.181 -0.593 17865
13177 1 20 . 1 1 109 109 LYS C C 134 179.561 179.561 179.080 0.481 17865
13178 1 20 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.556 0.552 17865
13179 1 20 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.314 -0.153 17865
13180 1 20 . 1 1 109 109 LYS H H 134 8.414 8.414 7.543 0.871 17865
13181 1 20 . 1 1 110 110 GLU N N 135 116.099 116.099 118.951 -2.852 17865
13182 1 20 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.182 -0.253 17865
13183 1 20 . 1 1 110 110 GLU C C 135 178.239 178.239 178.856 -0.617 17865
13184 1 20 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.545 0.101 17865
13185 1 20 . 1 1 110 110 GLU CB C 135 29.638 29.638 28.877 0.761 17865
13186 1 20 . 1 1 110 110 GLU H H 135 7.473 7.473 7.865 -0.392 17865
13187 1 20 . 1 1 111 111 LYS N N 136 119.805 119.805 119.892 -0.087 17865
13188 1 20 . 1 1 111 111 LYS HA H 136 3.906 3.906 3.975 -0.069 17865
13189 1 20 . 1 1 111 111 LYS C C 136 177.600 177.600 177.190 0.410 17865
13190 1 20 . 1 1 111 111 LYS CA C 136 58.749 58.749 57.837 0.912 17865
13191 1 20 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.070 1.168 17865
13192 1 20 . 1 1 111 111 LYS H H 136 7.540 7.540 7.511 0.029 17865
13193 1 20 . 1 1 112 112 TYR N N 137 114.768 114.768 115.546 -0.778 17865
13194 1 20 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.683 -0.160 17865
13195 1 20 . 1 1 112 112 TYR C C 137 174.690 174.690 175.351 -0.661 17865
13196 1 20 . 1 1 112 112 TYR CA C 137 58.359 58.359 56.472 1.887 17865
13197 1 20 . 1 1 112 112 TYR CB C 137 38.328 38.328 37.761 0.567 17865
13198 1 20 . 1 1 112 112 TYR H H 137 7.488 7.488 7.380 0.108 17865
13199 1 20 . 1 1 113 113 LYS N N 138 123.694 123.694 123.133 0.561 17865
13200 1 20 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.489 0.012 17865
13201 1 20 . 1 1 113 113 LYS CA C 138 55.282 55.282 55.178 0.104 17865
13202 1 20 . 1 1 113 113 LYS CB C 138 32.124 32.124 32.374 -0.251 17865
13203 1 20 . 1 1 113 113 LYS H H 138 7.217 7.217 7.289 -0.072 17865
13204 1 20 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.553 -0.101 17865
13205 1 20 . 1 1 114 114 PRO C C 139 176.974 176.974 176.343 0.631 17865
13206 1 20 . 1 1 114 114 PRO CA C 139 63.189 63.189 62.905 0.284 17865
13207 1 20 . 1 1 114 114 PRO CB C 139 32.251 32.251 29.781 2.470 17865
13208 1 20 . 1 1 115 115 VAL N N 140 121.098 121.098 115.570 5.528 17865
13209 1 20 . 1 1 115 115 VAL HA H 140 4.102 4.102 3.981 0.121 17865
13210 1 20 . 1 1 115 115 VAL C C 140 176.207 176.207 175.889 0.318 17865
13211 1 20 . 1 1 115 115 VAL CA C 140 62.356 62.356 63.349 -0.993 17865
13212 1 20 . 1 1 115 115 VAL CB C 140 33.256 33.256 31.866 1.390 17865
13213 1 20 . 1 1 115 115 VAL H H 140 8.272 8.272 7.772 0.500 17865
13214 1 20 . 1 1 116 116 VAL N N 141 124.167 124.167 122.085 2.082 17865
13215 1 20 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.062 0.060 17865
13216 1 20 . 1 1 116 116 VAL C C 141 175.415 175.415 175.794 -0.379 17865
13217 1 20 . 1 1 116 116 VAL CA C 141 61.731 61.731 61.773 -0.042 17865
13218 1 20 . 1 1 116 116 VAL CB C 141 33.145 33.145 30.644 2.501 17865
13219 1 20 . 1 1 116 116 VAL H H 141 8.142 8.142 7.646 0.496 17865
13220 1 20 . 1 1 117 117 ASP N N 142 126.737 126.737 129.077 -2.340 17865
13221 1 20 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.744 0.068 17865
13222 1 20 . 1 1 117 117 ASP CA C 142 52.217 52.217 52.884 -0.667 17865
13223 1 20 . 1 1 117 117 ASP CB C 142 41.368 41.368 41.102 0.266 17865
13224 1 20 . 1 1 117 117 ASP H H 142 8.419 8.419 8.105 0.314 17865
13225 1 20 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.278 0.133 17865
13226 1 20 . 1 1 118 118 PRO C C 143 176.662 176.662 176.032 0.630 17865
13227 1 20 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.681 -0.434 17865
13228 1 20 . 1 1 118 118 PRO CB C 143 32.310 32.310 31.472 0.838 17865
13229 1 20 . 1 1 119 119 ASN N N 144 119.287 119.287 124.317 -5.030 17865
13230 1 20 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.948 -0.001 17865
13231 1 20 . 1 1 119 119 ASN CA C 144 51.633 51.633 51.497 0.136 17865
13232 1 20 . 1 1 119 119 ASN CB C 144 38.859 38.859 38.639 0.220 17865
13233 1 20 . 1 1 119 119 ASN H H 144 8.432 8.432 8.134 0.298 17865
13234 1 20 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.486 0.194 17865
13235 1 20 . 1 1 120 120 PRO CA C 145 61.640 61.640 62.488 -0.848 17865
13236 1 20 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.436 -0.518 17865
13237 1 20 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.273 0.104 17865
13238 1 20 . 1 1 121 121 PRO C C 146 175.876 175.876 176.282 -0.406 17865
13239 1 20 . 1 1 121 121 PRO CA C 146 63.174 63.174 63.643 -0.469 17865
13240 1 20 . 1 1 121 121 PRO CB C 146 31.939 31.939 31.968 -0.029 17865
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Entity_delta_chem_shifts_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Data_low_range
_SPARTA_output.Data_high_range
_SPARTA_output.Entry_ID
1 1 1 "Average Difference" N 107 2.889 -0.376 2.878 17865
2 1 1 "Average Difference" HA 128 0.272 0.047 0.269 17865
3 1 1 "Average Difference" C 107 1.052 -0.160 1.045 17865
4 1 1 "Average Difference" CA 120 1.459 0.083 1.463 17865
5 1 1 "Average Difference" CB 111 2.697 -0.674 2.623 17865
6 1 1 "Average Difference" HN 107 0.471 -0.097 0.463 17865
7 1 2 "Average Difference" N 107 2.821 -0.500 2.789 17865
8 1 2 "Average Difference" HA 128 0.270 0.048 0.267 17865
9 1 2 "Average Difference" C 107 1.081 -0.184 1.070 17865
10 1 2 "Average Difference" CA 120 1.535 0.128 1.536 17865
11 1 2 "Average Difference" CB 111 2.752 -0.685 2.677 17865
12 1 2 "Average Difference" HN 107 0.521 -0.081 0.517 17865
13 1 3 "Average Difference" N 107 2.401 -0.312 2.392 17865
14 1 3 "Average Difference" HA 128 0.288 0.070 0.280 17865
15 1 3 "Average Difference" C 107 1.048 -0.305 1.007 17865
16 1 3 "Average Difference" CA 120 1.463 -0.025 1.469 17865
17 1 3 "Average Difference" CB 111 2.734 -0.587 2.682 17865
18 1 3 "Average Difference" HN 107 0.445 -0.077 0.440 17865
19 1 4 "Average Difference" N 107 2.605 -0.464 2.575 17865
20 1 4 "Average Difference" HA 128 0.303 0.042 0.301 17865
21 1 4 "Average Difference" C 107 1.095 -0.210 1.080 17865
22 1 4 "Average Difference" CA 120 1.479 0.079 1.483 17865
23 1 4 "Average Difference" CB 111 2.749 -0.708 2.668 17865
24 1 4 "Average Difference" HN 107 0.473 -0.075 0.469 17865
25 1 5 "Average Difference" N 107 2.697 -0.450 2.671 17865
26 1 5 "Average Difference" HA 128 0.280 0.026 0.280 17865
27 1 5 "Average Difference" C 107 1.023 -0.181 1.012 17865
28 1 5 "Average Difference" CA 120 1.409 0.061 1.413 17865
29 1 5 "Average Difference" CB 111 2.720 -0.600 2.665 17865
30 1 5 "Average Difference" HN 107 0.478 -0.065 0.475 17865
31 1 6 "Average Difference" N 107 2.685 -0.360 2.674 17865
32 1 6 "Average Difference" HA 128 0.281 0.034 0.280 17865
33 1 6 "Average Difference" C 107 0.986 -0.164 0.977 17865
34 1 6 "Average Difference" CA 120 1.480 -0.015 1.486 17865
35 1 6 "Average Difference" CB 111 2.716 -0.685 2.641 17865
36 1 6 "Average Difference" HN 107 0.464 -0.004 0.466 17865
37 1 7 "Average Difference" N 107 2.644 -0.540 2.601 17865
38 1 7 "Average Difference" HA 128 0.281 0.081 0.270 17865
39 1 7 "Average Difference" C 107 1.145 -0.252 1.122 17865
40 1 7 "Average Difference" CA 120 1.488 0.063 1.493 17865
41 1 7 "Average Difference" CB 111 2.606 -0.492 2.571 17865
42 1 7 "Average Difference" HN 107 0.496 -0.017 0.499 17865
43 1 8 "Average Difference" N 107 3.143 -0.078 3.157 17865
44 1 8 "Average Difference" HA 128 0.272 0.024 0.272 17865
45 1 8 "Average Difference" C 107 1.016 -0.169 1.006 17865
46 1 8 "Average Difference" CA 120 1.475 0.067 1.479 17865
47 1 8 "Average Difference" CB 111 2.696 -0.694 2.617 17865
48 1 8 "Average Difference" HN 107 0.448 -0.061 0.446 17865
49 1 9 "Average Difference" N 107 2.505 -0.284 2.501 17865
50 1 9 "Average Difference" HA 128 0.287 0.043 0.285 17865
51 1 9 "Average Difference" C 107 1.092 -0.202 1.078 17865
52 1 9 "Average Difference" CA 120 1.584 0.091 1.588 17865
53 1 9 "Average Difference" CB 111 2.762 -0.670 2.691 17865
54 1 9 "Average Difference" HN 107 0.469 -0.041 0.469 17865
55 1 10 "Average Difference" N 107 2.457 -0.334 2.445 17865
56 1 10 "Average Difference" HA 128 0.281 0.064 0.275 17865
57 1 10 "Average Difference" C 107 1.104 -0.261 1.077 17865
58 1 10 "Average Difference" CA 120 1.398 0.067 1.402 17865
59 1 10 "Average Difference" CB 111 2.739 -0.644 2.674 17865
60 1 10 "Average Difference" HN 107 0.465 -0.063 0.463 17865
61 1 11 "Average Difference" N 107 2.782 -0.158 2.791 17865
62 1 11 "Average Difference" HA 128 0.260 0.055 0.255 17865
63 1 11 "Average Difference" C 107 1.096 -0.274 1.066 17865
64 1 11 "Average Difference" CA 120 1.593 0.052 1.599 17865
65 1 11 "Average Difference" CB 111 2.630 -0.569 2.580 17865
66 1 11 "Average Difference" HN 107 0.449 -0.036 0.450 17865
67 1 12 "Average Difference" N 107 3.028 -0.177 3.037 17865
68 1 12 "Average Difference" HA 128 0.286 0.022 0.286 17865
69 1 12 "Average Difference" C 107 1.117 -0.093 1.119 17865
70 1 12 "Average Difference" CA 120 1.506 0.191 1.500 17865
71 1 12 "Average Difference" CB 111 2.771 -0.647 2.706 17865
72 1 12 "Average Difference" HN 107 0.504 -0.053 0.504 17865
73 1 13 "Average Difference" N 107 2.316 0.106 2.324 17865
74 1 13 "Average Difference" HA 128 0.262 0.054 0.257 17865
75 1 13 "Average Difference" C 107 1.085 -0.171 1.076 17865
76 1 13 "Average Difference" CA 120 1.394 0.157 1.391 17865
77 1 13 "Average Difference" CB 111 2.815 -0.586 2.765 17865
78 1 13 "Average Difference" HN 107 0.418 -0.032 0.418 17865
79 1 14 "Average Difference" N 107 2.614 -0.435 2.590 17865
80 1 14 "Average Difference" HA 128 0.321 0.057 0.317 17865
81 1 14 "Average Difference" C 107 1.083 -0.240 1.061 17865
82 1 14 "Average Difference" CA 120 1.513 -0.064 1.518 17865
83 1 14 "Average Difference" CB 111 2.749 -0.647 2.684 17865
84 1 14 "Average Difference" HN 107 0.481 -0.101 0.473 17865
85 1 15 "Average Difference" N 107 2.651 -0.257 2.651 17865
86 1 15 "Average Difference" HA 128 0.285 0.066 0.278 17865
87 1 15 "Average Difference" C 107 1.090 -0.236 1.070 17865
88 1 15 "Average Difference" CA 120 1.446 0.108 1.448 17865
89 1 15 "Average Difference" CB 111 2.568 -0.539 2.522 17865
90 1 15 "Average Difference" HN 107 0.501 -0.005 0.503 17865
91 1 16 "Average Difference" N 107 2.654 -0.507 2.617 17865
92 1 16 "Average Difference" HA 128 0.273 0.050 0.270 17865
93 1 16 "Average Difference" C 107 1.053 -0.305 1.013 17865
94 1 16 "Average Difference" CA 120 1.549 0.077 1.554 17865
95 1 16 "Average Difference" CB 111 2.751 -0.604 2.696 17865
96 1 16 "Average Difference" HN 107 0.505 -0.114 0.494 17865
97 1 17 "Average Difference" N 107 2.697 -0.138 2.706 17865
98 1 17 "Average Difference" HA 128 0.276 0.061 0.270 17865
99 1 17 "Average Difference" C 107 1.105 -0.211 1.089 17865
100 1 17 "Average Difference" CA 120 1.512 0.002 1.518 17865
101 1 17 "Average Difference" CB 111 2.680 -0.601 2.624 17865
102 1 17 "Average Difference" HN 107 0.498 -0.031 0.500 17865
103 1 18 "Average Difference" N 107 2.896 -0.340 2.889 17865
104 1 18 "Average Difference" HA 128 0.275 0.073 0.266 17865
105 1 18 "Average Difference" C 107 1.047 -0.266 1.017 17865
106 1 18 "Average Difference" CA 120 1.313 0.023 1.319 17865
107 1 18 "Average Difference" CB 111 2.734 -0.655 2.666 17865
108 1 18 "Average Difference" HN 107 0.465 -0.086 0.459 17865
109 1 19 "Average Difference" N 107 3.031 -0.348 3.025 17865
110 1 19 "Average Difference" HA 128 0.292 0.055 0.288 17865
111 1 19 "Average Difference" C 107 1.092 -0.136 1.089 17865
112 1 19 "Average Difference" CA 120 1.634 0.126 1.636 17865
113 1 19 "Average Difference" CB 111 2.661 -0.645 2.593 17865
114 1 19 "Average Difference" HN 107 0.486 -0.015 0.488 17865
115 1 20 "Average Difference" N 107 2.640 -0.310 2.634 17865
116 1 20 "Average Difference" HA 128 0.285 0.045 0.282 17865
117 1 20 "Average Difference" C 107 1.079 -0.205 1.064 17865
118 1 20 "Average Difference" CA 120 1.572 0.179 1.568 17865
119 1 20 "Average Difference" CB 111 2.810 -0.687 2.737 17865
120 1 20 "Average Difference" HN 107 0.494 -0.066 0.492 17865
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 17865
_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 ASP N N 27 121.041 121.041 121.848 -0.807 17865
2 1 . 1 1 2 2 ASP HA H 27 4.638 4.638 4.781 -0.143 17865
3 1 . 1 1 2 2 ASP C C 27 175.878 175.878 175.539 0.339 17865
4 1 . 1 1 2 2 ASP CA C 27 54.382 54.382 54.414 -0.032 17865
5 1 . 1 1 2 2 ASP CB C 27 41.729 41.729 41.466 0.263 17865
6 1 . 1 1 2 2 ASP H H 27 8.639 8.639 8.486 0.153 17865
7 1 . 1 1 3 3 VAL N N 28 119.901 119.901 120.796 -0.895 17865
8 1 . 1 1 3 3 VAL HA H 28 4.033 4.033 4.092 -0.059 17865
9 1 . 1 1 3 3 VAL C C 28 175.521 175.521 174.846 0.675 17865
10 1 . 1 1 3 3 VAL CA C 28 62.216 62.216 62.338 -0.122 17865
11 1 . 1 1 3 3 VAL CB C 28 33.003 33.003 31.711 1.292 17865
12 1 . 1 1 3 3 VAL H H 28 8.113 8.113 7.963 0.150 17865
13 1 . 1 1 4 4 PHE N N 29 123.707 123.707 123.505 0.202 17865
14 1 . 1 1 4 4 PHE HA H 29 4.656 4.656 4.612 0.044 17865
15 1 . 1 1 4 4 PHE C C 29 174.874 174.874 175.078 -0.204 17865
16 1 . 1 1 4 4 PHE CA C 29 57.159 57.159 57.378 -0.219 17865
17 1 . 1 1 4 4 PHE CB C 29 39.795 39.795 39.984 -0.189 17865
18 1 . 1 1 4 4 PHE H H 29 8.255 8.255 8.044 0.211 17865
19 1 . 1 1 5 5 ASP N N 30 124.203 124.203 123.960 0.243 17865
20 1 . 1 1 5 5 ASP HA H 30 4.838 4.838 4.705 0.133 17865
21 1 . 1 1 5 5 ASP CA C 30 52.385 52.385 52.696 -0.311 17865
22 1 . 1 1 5 5 ASP CB C 30 40.801 40.801 41.322 -0.521 17865
23 1 . 1 1 5 5 ASP H H 30 8.226 8.226 8.332 -0.106 17865
24 1 . 1 1 6 6 PRO HA H 31 4.537 4.537 4.578 -0.041 17865
25 1 . 1 1 6 6 PRO CA C 31 61.664 61.664 62.077 -0.413 17865
26 1 . 1 1 6 6 PRO CB C 31 30.826 30.826 31.453 -0.627 17865
27 1 . 1 1 7 7 PRO HA H 32 4.426 4.426 4.432 -0.006 17865
28 1 . 1 1 7 7 PRO C C 32 177.226 177.226 176.588 0.638 17865
29 1 . 1 1 7 7 PRO CA C 32 63.169 63.169 63.263 -0.094 17865
30 1 . 1 1 7 7 PRO CB C 32 31.948 31.948 31.817 0.131 17865
31 1 . 1 1 8 8 THR N N 33 114.158 114.158 117.496 -3.338 17865
32 1 . 1 1 8 8 THR HA H 33 4.195 4.195 4.294 -0.099 17865
33 1 . 1 1 8 8 THR C C 33 174.468 174.468 174.224 0.244 17865
34 1 . 1 1 8 8 THR CA C 33 62.110 62.110 62.235 -0.125 17865
35 1 . 1 1 8 8 THR CB C 33 69.975 69.975 69.133 0.842 17865
36 1 . 1 1 8 8 THR H H 33 8.096 8.096 8.253 -0.157 17865
37 1 . 1 1 9 9 GLN N N 34 122.411 122.411 123.583 -1.171 17865
38 1 . 1 1 9 9 GLN HA H 34 4.263 4.263 4.169 0.094 17865
39 1 . 1 1 9 9 GLN C C 34 175.445 175.445 174.907 0.538 17865
40 1 . 1 1 9 9 GLN CA C 34 55.763 55.763 55.570 0.193 17865
41 1 . 1 1 9 9 GLN CB C 34 29.691 29.691 28.566 1.125 17865
42 1 . 1 1 9 9 GLN H H 34 8.278 8.278 8.205 0.073 17865
43 1 . 1 1 10 10 TYR N N 35 121.048 121.048 118.816 2.232 17865
44 1 . 1 1 10 10 TYR HA H 35 4.520 4.520 4.477 0.043 17865
45 1 . 1 1 10 10 TYR C C 35 176.314 176.314 175.430 0.884 17865
46 1 . 1 1 10 10 TYR CA C 35 57.972 57.972 57.491 0.481 17865
47 1 . 1 1 10 10 TYR CB C 35 38.936 38.936 39.314 -0.378 17865
48 1 . 1 1 10 10 TYR H H 35 8.227 8.227 7.447 0.780 17865
49 1 . 1 1 11 11 GLY N N 36 109.711 109.711 107.693 2.018 17865
50 1 . 1 1 11 11 GLY C C 36 174.128 174.128 173.774 0.354 17865
51 1 . 1 1 11 11 GLY CA C 36 45.212 45.212 45.637 -0.425 17865
52 1 . 1 1 11 11 GLY H H 36 8.247 8.247 8.218 0.029 17865
53 1 . 1 1 12 12 TYR N N 37 120.302 120.302 118.393 1.909 17865
54 1 . 1 1 12 12 TYR HA H 37 4.482 4.482 4.823 -0.341 17865
55 1 . 1 1 12 12 TYR C C 37 175.864 175.864 174.603 1.261 17865
56 1 . 1 1 12 12 TYR CA C 37 58.541 58.541 56.440 2.101 17865
57 1 . 1 1 12 12 TYR CB C 37 38.715 38.715 39.516 -0.801 17865
58 1 . 1 1 12 12 TYR H H 37 8.101 8.101 7.518 0.583 17865
59 1 . 1 1 13 13 ASP N N 38 121.883 121.883 119.938 1.945 17865
60 1 . 1 1 13 13 ASP HA H 38 4.486 4.486 4.474 0.012 17865
61 1 . 1 1 13 13 ASP C C 38 176.538 176.538 176.081 0.457 17865
62 1 . 1 1 13 13 ASP CA C 38 54.223 54.223 54.295 -0.072 17865
63 1 . 1 1 13 13 ASP CB C 38 40.988 40.988 41.435 -0.447 17865
64 1 . 1 1 13 13 ASP H H 38 8.266 8.266 7.698 0.569 17865
65 1 . 1 1 14 14 GLY N N 39 107.705 107.705 110.574 -2.869 17865
66 1 . 1 1 14 14 GLY C C 39 173.822 173.822 173.437 0.385 17865
67 1 . 1 1 14 14 GLY CA C 39 45.404 45.404 45.081 0.323 17865
68 1 . 1 1 14 14 GLY H H 39 7.647 7.647 7.909 -0.262 17865
69 1 . 1 1 15 15 LYS N N 40 121.621 121.621 121.334 0.287 17865
70 1 . 1 1 15 15 LYS HA H 40 4.575 4.575 4.768 -0.193 17865
71 1 . 1 1 15 15 LYS CA C 40 54.100 54.100 53.148 0.952 17865
72 1 . 1 1 15 15 LYS CB C 40 32.510 32.510 33.934 -1.424 17865
73 1 . 1 1 15 15 LYS H H 40 7.908 7.908 7.596 0.312 17865
74 1 . 1 1 16 16 PRO HA H 41 4.352 4.352 4.607 -0.255 17865
75 1 . 1 1 16 16 PRO C C 41 176.806 176.806 176.658 0.148 17865
76 1 . 1 1 16 16 PRO CA C 41 62.758 62.758 62.798 -0.040 17865
77 1 . 1 1 16 16 PRO CB C 41 32.314 32.314 32.588 -0.274 17865
78 1 . 1 1 17 17 LEU N N 42 123.488 123.488 120.096 3.392 17865
79 1 . 1 1 17 17 LEU HA H 42 4.049 4.049 4.366 -0.317 17865
80 1 . 1 1 17 17 LEU C C 42 174.973 174.973 175.909 -0.936 17865
81 1 . 1 1 17 17 LEU CA C 42 55.436 55.436 55.370 0.066 17865
82 1 . 1 1 17 17 LEU CB C 42 42.093 42.093 41.963 0.130 17865
83 1 . 1 1 17 17 LEU H H 42 8.499 8.499 8.214 0.285 17865
84 1 . 1 1 18 18 ASP N N 43 123.354 123.354 124.142 -0.788 17865
85 1 . 1 1 18 18 ASP HA H 43 4.498 4.498 4.795 -0.297 17865
86 1 . 1 1 18 18 ASP C C 43 175.947 175.947 176.634 -0.687 17865
87 1 . 1 1 18 18 ASP CA C 43 52.858 52.858 52.919 -0.061 17865
88 1 . 1 1 18 18 ASP CB C 43 42.221 42.221 44.246 -2.025 17865
89 1 . 1 1 18 18 ASP H H 43 7.789 7.789 8.156 -0.367 17865
90 1 . 1 1 19 19 ALA N N 44 120.147 120.147 123.760 -3.613 17865
91 1 . 1 1 19 19 ALA HA H 44 3.986 3.986 4.166 -0.180 17865
92 1 . 1 1 19 19 ALA C C 44 179.476 179.476 179.035 0.441 17865
93 1 . 1 1 19 19 ALA CA C 44 55.163 55.163 54.412 0.751 17865
94 1 . 1 1 19 19 ALA CB C 44 18.387 18.387 18.865 -0.478 17865
95 1 . 1 1 19 19 ALA H H 44 8.561 8.561 8.628 -0.067 17865
96 1 . 1 1 20 20 SER N N 45 115.037 115.037 115.273 -0.236 17865
97 1 . 1 1 20 20 SER HA H 45 4.151 4.151 4.154 -0.003 17865
98 1 . 1 1 20 20 SER C C 45 177.191 177.191 176.462 0.729 17865
99 1 . 1 1 20 20 SER CA C 45 61.629 61.629 61.440 0.189 17865
100 1 . 1 1 20 20 SER CB C 45 62.804 62.804 62.974 -0.170 17865
101 1 . 1 1 20 20 SER H H 45 8.466 8.466 8.463 0.003 17865
102 1 . 1 1 21 21 PHE N N 46 125.030 125.030 122.338 2.692 17865
103 1 . 1 1 21 21 PHE HA H 46 4.231 4.231 4.366 -0.135 17865
104 1 . 1 1 21 21 PHE C C 46 176.850 176.850 176.686 0.164 17865
105 1 . 1 1 21 21 PHE CA C 46 60.806 60.806 60.850 -0.044 17865
106 1 . 1 1 21 21 PHE CB C 46 39.881 39.881 39.198 0.683 17865
107 1 . 1 1 21 21 PHE H H 46 8.034 8.034 7.777 0.257 17865
108 1 . 1 1 22 22 CYS N N 47 113.943 113.943 116.996 -3.053 17865
109 1 . 1 1 22 22 CYS HA H 47 4.251 4.251 4.256 -0.005 17865
110 1 . 1 1 22 22 CYS C C 47 176.449 176.449 176.260 0.189 17865
111 1 . 1 1 22 22 CYS CA C 47 53.600 53.600 59.432 -5.832 17865
112 1 . 1 1 22 22 CYS CB C 47 36.391 36.391 25.654 10.737 17865
113 1 . 1 1 22 22 CYS H H 47 7.691 7.691 8.006 -0.315 17865
114 1 . 1 1 23 23 ARG N N 48 119.958 119.958 120.453 -0.495 17865
115 1 . 1 1 23 23 ARG HA H 48 4.080 4.080 4.108 -0.028 17865
116 1 . 1 1 23 23 ARG C C 48 177.904 177.904 177.524 0.380 17865
117 1 . 1 1 23 23 ARG CA C 48 58.907 58.907 58.674 0.234 17865
118 1 . 1 1 23 23 ARG CB C 48 30.171 30.171 29.711 0.460 17865
119 1 . 1 1 23 23 ARG H H 48 7.628 7.628 7.636 -0.008 17865
120 1 . 1 1 24 24 THR N N 49 106.445 106.445 111.635 -5.190 17865
121 1 . 1 1 24 24 THR HA H 49 4.385 4.385 4.267 0.118 17865
122 1 . 1 1 24 24 THR C C 49 174.758 174.758 174.820 -0.062 17865
123 1 . 1 1 24 24 THR CA C 49 61.573 61.573 63.197 -1.624 17865
124 1 . 1 1 24 24 THR CB C 49 68.794 68.794 68.730 0.064 17865
125 1 . 1 1 24 24 THR H H 49 7.307 7.307 7.488 -0.181 17865
126 1 . 1 1 25 25 ALA N N 50 122.242 122.242 122.388 -0.146 17865
127 1 . 1 1 25 25 ALA HA H 50 4.404 4.404 4.283 0.121 17865
128 1 . 1 1 25 25 ALA C C 50 178.554 178.554 178.178 0.376 17865
129 1 . 1 1 25 25 ALA CA C 50 52.381 52.381 53.103 -0.722 17865
130 1 . 1 1 25 25 ALA CB C 50 18.395 18.395 19.659 -1.264 17865
131 1 . 1 1 25 25 ALA H H 50 7.401 7.401 7.455 -0.054 17865
132 1 . 1 1 26 26 GLY N N 51 110.604 110.604 106.888 3.716 17865
133 1 . 1 1 26 26 GLY CA C 51 47.022 47.022 46.380 0.642 17865
134 1 . 1 1 26 26 GLY H H 51 8.285 8.285 7.856 0.429 17865
135 1 . 1 1 27 27 SER HA H 52 4.382 4.382 4.253 0.129 17865
136 1 . 1 1 27 27 SER C C 52 175.774 175.774 175.692 0.082 17865
137 1 . 1 1 27 27 SER CA C 52 60.803 60.803 60.876 -0.073 17865
138 1 . 1 1 27 27 SER CB C 52 62.827 62.827 63.087 -0.260 17865
139 1 . 1 1 28 28 ARG N N 53 119.682 119.682 118.942 0.740 17865
140 1 . 1 1 28 28 ARG HA H 53 4.880 4.880 4.683 0.197 17865
141 1 . 1 1 28 28 ARG C C 53 175.796 175.796 176.929 -1.133 17865
142 1 . 1 1 28 28 ARG CA C 53 55.738 55.738 55.671 0.067 17865
143 1 . 1 1 28 28 ARG CB C 53 30.237 30.237 29.649 0.588 17865
144 1 . 1 1 28 28 ARG H H 53 7.894 7.894 8.050 -0.156 17865
145 1 . 1 1 29 29 GLU N N 54 122.318 122.318 121.819 0.499 17865
146 1 . 1 1 29 29 GLU HA H 54 3.595 3.595 4.024 -0.429 17865
147 1 . 1 1 29 29 GLU C C 54 177.523 177.523 177.789 -0.266 17865
148 1 . 1 1 29 29 GLU CA C 54 61.223 61.223 59.935 1.288 17865
149 1 . 1 1 29 29 GLU CB C 54 28.937 28.937 29.474 -0.537 17865
150 1 . 1 1 29 29 GLU H H 54 7.730 7.730 7.863 -0.133 17865
151 1 . 1 1 30 30 LYS N N 55 118.377 118.377 117.876 0.501 17865
152 1 . 1 1 30 30 LYS HA H 55 3.828 3.828 4.042 -0.214 17865
153 1 . 1 1 30 30 LYS C C 55 179.205 179.205 178.849 0.356 17865
154 1 . 1 1 30 30 LYS CA C 55 60.427 60.427 59.326 1.101 17865
155 1 . 1 1 30 30 LYS CB C 55 31.601 31.601 32.216 -0.615 17865
156 1 . 1 1 30 30 LYS H H 55 8.659 8.659 7.930 0.729 17865
157 1 . 1 1 31 31 ASP N N 56 121.614 121.614 119.568 2.046 17865
158 1 . 1 1 31 31 ASP HA H 56 4.311 4.311 4.548 -0.237 17865
159 1 . 1 1 31 31 ASP C C 56 177.393 177.393 177.829 -0.436 17865
160 1 . 1 1 31 31 ASP CA C 56 57.316 57.316 57.195 0.122 17865
161 1 . 1 1 31 31 ASP CB C 56 40.423 40.423 40.994 -0.571 17865
162 1 . 1 1 31 31 ASP H H 56 7.646 7.646 8.043 -0.397 17865
163 1 . 1 1 32 32 CYS N N 57 120.345 120.345 119.700 0.645 17865
164 1 . 1 1 32 32 CYS HA H 57 3.601 3.601 3.800 -0.199 17865
165 1 . 1 1 32 32 CYS C C 57 175.772 175.772 176.480 -0.708 17865
166 1 . 1 1 32 32 CYS CA C 57 60.197 60.197 60.961 -0.764 17865
167 1 . 1 1 32 32 CYS CB C 57 33.966 33.966 25.899 8.067 17865
168 1 . 1 1 32 32 CYS H H 57 8.042 8.042 7.995 0.047 17865
169 1 . 1 1 33 33 ARG N N 58 120.293 120.293 119.365 0.928 17865
170 1 . 1 1 33 33 ARG HA H 58 3.676 3.676 3.940 -0.264 17865
171 1 . 1 1 33 33 ARG C C 58 179.633 179.633 178.441 1.192 17865
172 1 . 1 1 33 33 ARG CA C 58 60.386 60.386 59.333 1.053 17865
173 1 . 1 1 33 33 ARG CB C 58 29.841 29.841 29.510 0.331 17865
174 1 . 1 1 33 33 ARG H H 58 8.531 8.531 8.148 0.383 17865
175 1 . 1 1 34 34 LYS N N 59 121.166 121.166 119.295 1.871 17865
176 1 . 1 1 34 34 LYS HA H 59 4.036 4.036 4.158 -0.122 17865
177 1 . 1 1 34 34 LYS C C 59 179.220 179.220 178.559 0.661 17865
178 1 . 1 1 34 34 LYS CA C 59 59.530 59.530 58.650 0.880 17865
179 1 . 1 1 34 34 LYS CB C 59 32.110 32.110 32.067 0.043 17865
180 1 . 1 1 34 34 LYS H H 59 7.633 7.633 7.543 0.090 17865
181 1 . 1 1 35 35 ASP N N 60 122.166 122.166 120.054 2.112 17865
182 1 . 1 1 35 35 ASP HA H 60 4.431 4.431 4.475 -0.044 17865
183 1 . 1 1 35 35 ASP C C 60 179.709 179.709 178.569 1.140 17865
184 1 . 1 1 35 35 ASP CA C 60 57.703 57.703 57.233 0.470 17865
185 1 . 1 1 35 35 ASP CB C 60 40.672 40.672 41.000 -0.328 17865
186 1 . 1 1 35 35 ASP H H 60 8.221 8.221 7.911 0.310 17865
187 1 . 1 1 36 36 VAL N N 61 121.312 121.312 118.693 2.619 17865
188 1 . 1 1 36 36 VAL HA H 61 3.401 3.401 3.730 -0.329 17865
189 1 . 1 1 36 36 VAL C C 61 178.339 178.339 177.568 0.771 17865
190 1 . 1 1 36 36 VAL CA C 61 67.133 67.133 65.631 1.502 17865
191 1 . 1 1 36 36 VAL CB C 61 31.657 31.657 31.792 -0.135 17865
192 1 . 1 1 36 36 VAL H H 61 8.916 8.916 8.166 0.750 17865
193 1 . 1 1 37 37 GLN N N 62 119.166 119.166 117.850 1.316 17865
194 1 . 1 1 37 37 GLN HA H 62 3.942 3.942 4.127 -0.185 17865
195 1 . 1 1 37 37 GLN C C 62 177.293 177.293 177.352 -0.059 17865
196 1 . 1 1 37 37 GLN CA C 62 58.280 58.280 57.759 0.521 17865
197 1 . 1 1 37 37 GLN CB C 62 28.371 28.371 28.563 -0.192 17865
198 1 . 1 1 37 37 GLN H H 62 7.697 7.697 7.618 0.079 17865
199 1 . 1 1 38 38 ALA N N 63 118.964 118.964 120.854 -1.890 17865
200 1 . 1 1 38 38 ALA HA H 63 4.242 4.242 4.280 -0.038 17865
201 1 . 1 1 38 38 ALA C C 63 177.221 177.221 177.450 -0.229 17865
202 1 . 1 1 38 38 ALA CA C 63 53.137 53.137 52.843 0.294 17865
203 1 . 1 1 38 38 ALA CB C 63 18.897 18.897 19.156 -0.260 17865
204 1 . 1 1 38 38 ALA H H 63 7.508 7.508 7.648 -0.140 17865
205 1 . 1 1 39 39 CYS N N 64 119.081 119.081 118.765 0.316 17865
206 1 . 1 1 39 39 CYS HA H 64 4.953 4.953 4.526 0.427 17865
207 1 . 1 1 39 39 CYS C C 64 172.052 172.052 174.773 -2.721 17865
208 1 . 1 1 39 39 CYS CA C 64 51.880 51.880 58.811 -6.931 17865
209 1 . 1 1 39 39 CYS CB C 64 34.328 34.328 26.272 8.057 17865
210 1 . 1 1 39 39 CYS H H 64 7.354 7.354 7.671 -0.317 17865
211 1 . 1 1 40 40 ASP N N 65 124.167 124.167 126.406 -2.239 17865
212 1 . 1 1 40 40 ASP HA H 65 4.325 4.325 4.458 -0.133 17865
213 1 . 1 1 40 40 ASP C C 65 176.496 176.496 176.695 -0.198 17865
214 1 . 1 1 40 40 ASP CA C 65 56.724 56.724 56.569 0.155 17865
215 1 . 1 1 40 40 ASP CB C 65 41.313 41.313 41.469 -0.156 17865
216 1 . 1 1 40 40 ASP H H 65 8.142 8.142 8.573 -0.431 17865
217 1 . 1 1 41 41 LYS N N 66 118.844 118.844 119.627 -0.783 17865
218 1 . 1 1 41 41 LYS HA H 66 4.524 4.524 4.387 0.137 17865
219 1 . 1 1 41 41 LYS C C 66 175.586 175.586 176.829 -1.243 17865
220 1 . 1 1 41 41 LYS CA C 66 55.275 55.275 56.460 -1.185 17865
221 1 . 1 1 41 41 LYS CB C 66 32.598 32.598 32.088 0.510 17865
222 1 . 1 1 41 41 LYS H H 66 7.858 7.858 8.387 -0.529 17865
223 1 . 1 1 42 42 LYS N N 67 126.081 126.081 119.700 6.381 17865
224 1 . 1 1 42 42 LYS HA H 67 3.915 3.915 4.069 -0.154 17865
225 1 . 1 1 42 42 LYS C C 67 174.665 174.665 175.396 -0.731 17865
226 1 . 1 1 42 42 LYS CA C 67 57.827 57.827 57.369 0.458 17865
227 1 . 1 1 42 42 LYS CB C 67 34.059 34.059 32.469 1.591 17865
228 1 . 1 1 42 42 LYS H H 67 8.790 8.790 8.424 0.366 17865
229 1 . 1 1 43 43 TYR N N 68 114.138 114.138 116.766 -2.628 17865
230 1 . 1 1 43 43 TYR HA H 68 5.259 5.259 4.870 0.389 17865
231 1 . 1 1 43 43 TYR C C 68 175.767 175.767 175.262 0.505 17865
232 1 . 1 1 43 43 TYR CA C 68 55.880 55.880 57.000 -1.120 17865
233 1 . 1 1 43 43 TYR CB C 68 42.363 42.363 41.613 0.749 17865
234 1 . 1 1 43 43 TYR H H 68 7.294 7.294 7.604 -0.310 17865
235 1 . 1 1 44 44 ASP N N 69 121.807 121.807 121.818 -0.011 17865
236 1 . 1 1 44 44 ASP HA H 69 4.640 4.640 4.664 -0.024 17865
237 1 . 1 1 44 44 ASP C C 69 177.812 177.812 177.393 0.419 17865
238 1 . 1 1 44 44 ASP CA C 69 52.110 52.110 53.941 -1.831 17865
239 1 . 1 1 44 44 ASP CB C 69 41.440 41.440 43.243 -1.803 17865
240 1 . 1 1 44 44 ASP H H 69 8.995 8.995 8.917 0.078 17865
241 1 . 1 1 45 45 ASP N N 70 116.686 116.686 121.316 -4.630 17865
242 1 . 1 1 45 45 ASP HA H 70 4.424 4.424 4.450 -0.026 17865
243 1 . 1 1 45 45 ASP C C 70 177.054 177.054 177.022 0.032 17865
244 1 . 1 1 45 45 ASP CA C 70 56.381 56.381 56.497 -0.116 17865
245 1 . 1 1 45 45 ASP CB C 70 40.248 40.248 40.836 -0.588 17865
246 1 . 1 1 45 45 ASP H H 70 8.369 8.369 8.758 -0.389 17865
247 1 . 1 1 46 46 GLN N N 71 117.949 117.949 117.035 0.914 17865
248 1 . 1 1 46 46 GLN HA H 71 4.456 4.456 4.395 0.061 17865
249 1 . 1 1 46 46 GLN C C 71 176.273 176.273 176.672 -0.399 17865
250 1 . 1 1 46 46 GLN CA C 71 55.367 55.367 55.419 -0.052 17865
251 1 . 1 1 46 46 GLN CB C 71 29.330 29.330 29.247 0.083 17865
252 1 . 1 1 46 46 GLN H H 71 8.274 8.274 8.238 0.036 17865
253 1 . 1 1 47 47 GLY N N 72 108.369 108.369 107.052 1.317 17865
254 1 . 1 1 47 47 GLY C C 72 174.145 174.145 174.113 0.032 17865
255 1 . 1 1 47 47 GLY CA C 72 45.823 45.823 45.100 0.723 17865
256 1 . 1 1 47 47 GLY H H 72 8.174 8.174 8.071 0.103 17865
257 1 . 1 1 48 48 ARG N N 73 121.554 121.554 119.369 2.185 17865
258 1 . 1 1 48 48 ARG HA H 73 4.485 4.485 4.640 -0.155 17865
259 1 . 1 1 48 48 ARG C C 73 176.855 176.855 175.592 1.263 17865
260 1 . 1 1 48 48 ARG CA C 73 55.289 55.289 53.727 1.562 17865
261 1 . 1 1 48 48 ARG CB C 73 30.558 30.558 31.494 -0.936 17865
262 1 . 1 1 48 48 ARG H H 73 8.462 8.462 8.195 0.267 17865
263 1 . 1 1 49 49 GLU N N 74 122.784 122.784 120.920 1.864 17865
264 1 . 1 1 49 49 GLU HA H 74 4.483 4.483 4.362 0.121 17865
265 1 . 1 1 49 49 GLU C C 74 178.098 178.098 176.799 1.299 17865
266 1 . 1 1 49 49 GLU CA C 74 57.184 57.184 56.837 0.347 17865
267 1 . 1 1 49 49 GLU CB C 74 30.777 30.777 30.103 0.674 17865
268 1 . 1 1 49 49 GLU H H 74 8.703 8.703 8.638 0.065 17865
269 1 . 1 1 50 50 THR N N 75 114.563 114.563 114.639 -0.076 17865
270 1 . 1 1 50 50 THR HA H 75 4.212 4.212 4.431 -0.219 17865
271 1 . 1 1 50 50 THR C C 75 175.170 175.170 175.565 -0.395 17865
272 1 . 1 1 50 50 THR CA C 75 60.589 60.589 60.534 0.055 17865
273 1 . 1 1 50 50 THR CB C 75 70.952 70.952 70.496 0.456 17865
274 1 . 1 1 50 50 THR H H 75 7.717 7.717 8.026 -0.309 17865
275 1 . 1 1 51 51 ALA N N 76 122.097 122.097 122.564 -0.467 17865
276 1 . 1 1 51 51 ALA HA H 76 4.038 4.038 4.044 -0.006 17865
277 1 . 1 1 51 51 ALA C C 76 181.906 181.906 179.244 2.662 17865
278 1 . 1 1 51 51 ALA CA C 76 55.654 55.654 55.037 0.617 17865
279 1 . 1 1 51 51 ALA CB C 76 17.993 17.993 18.181 -0.188 17865
280 1 . 1 1 51 51 ALA H H 76 8.734 8.734 8.652 0.082 17865
281 1 . 1 1 52 52 CYS N N 77 115.347 115.347 116.582 -1.235 17865
282 1 . 1 1 52 52 CYS HA H 77 4.480 4.480 4.220 0.260 17865
283 1 . 1 1 52 52 CYS C C 77 176.299 176.299 176.770 -0.471 17865
284 1 . 1 1 52 52 CYS CA C 77 57.701 57.701 60.160 -2.459 17865
285 1 . 1 1 52 52 CYS CB C 77 35.631 35.631 25.707 9.924 17865
286 1 . 1 1 52 52 CYS H H 77 9.073 9.073 8.114 0.959 17865
287 1 . 1 1 53 53 ALA N N 78 128.517 128.517 123.282 5.236 17865
288 1 . 1 1 53 53 ALA HA H 78 3.855 3.855 3.847 0.008 17865
289 1 . 1 1 53 53 ALA C C 78 178.736 178.736 179.140 -0.404 17865
290 1 . 1 1 53 53 ALA CA C 78 55.633 55.633 55.072 0.561 17865
291 1 . 1 1 53 53 ALA CB C 78 19.191 19.191 17.972 1.219 17865
292 1 . 1 1 53 53 ALA H H 78 7.174 7.174 7.946 -0.772 17865
293 1 . 1 1 54 54 LYS N N 79 118.706 118.706 118.635 0.072 17865
294 1 . 1 1 54 54 LYS HA H 79 3.803 3.803 4.179 -0.376 17865
295 1 . 1 1 54 54 LYS C C 79 179.611 179.611 178.797 0.814 17865
296 1 . 1 1 54 54 LYS CA C 79 59.725 59.725 58.544 1.181 17865
297 1 . 1 1 54 54 LYS CB C 79 32.653 32.653 32.373 0.280 17865
298 1 . 1 1 54 54 LYS H H 79 8.313 8.313 7.946 0.367 17865
299 1 . 1 1 55 55 GLY N N 80 104.822 104.822 107.889 -3.067 17865
300 1 . 1 1 55 55 GLY C C 80 176.504 176.504 176.145 0.359 17865
301 1 . 1 1 55 55 GLY CA C 80 46.839 46.839 46.946 -0.107 17865
302 1 . 1 1 55 55 GLY H H 80 8.175 8.175 7.689 0.486 17865
303 1 . 1 1 56 56 ILE N N 81 123.697 123.697 122.927 0.770 17865
304 1 . 1 1 56 56 ILE HA H 81 3.795 3.795 3.857 -0.062 17865
305 1 . 1 1 56 56 ILE C C 81 177.334 177.334 177.762 -0.428 17865
306 1 . 1 1 56 56 ILE CA C 81 65.281 65.281 64.909 0.372 17865
307 1 . 1 1 56 56 ILE CB C 81 38.335 38.335 37.913 0.421 17865
308 1 . 1 1 56 56 ILE H H 81 7.590 7.590 7.737 -0.147 17865
309 1 . 1 1 57 57 ARG N N 82 118.161 118.161 118.947 -0.786 17865
310 1 . 1 1 57 57 ARG HA H 82 3.935 3.935 4.005 -0.070 17865
311 1 . 1 1 57 57 ARG C C 82 178.662 178.662 178.433 0.229 17865
312 1 . 1 1 57 57 ARG CA C 82 59.702 59.702 59.289 0.413 17865
313 1 . 1 1 57 57 ARG CB C 82 29.899 29.899 29.580 0.319 17865
314 1 . 1 1 57 57 ARG H H 82 7.569 7.569 7.774 -0.205 17865
315 1 . 1 1 58 58 GLU N N 83 115.085 115.085 117.779 -2.694 17865
316 1 . 1 1 58 58 GLU HA H 83 4.031 4.031 4.059 -0.028 17865
317 1 . 1 1 58 58 GLU C C 83 178.224 178.224 178.702 -0.478 17865
318 1 . 1 1 58 58 GLU CA C 83 58.304 58.304 58.379 -0.075 17865
319 1 . 1 1 58 58 GLU CB C 83 30.031 30.031 29.283 0.748 17865
320 1 . 1 1 58 58 GLU H H 83 7.786 7.786 7.901 -0.115 17865
321 1 . 1 1 59 59 LYS N N 84 119.183 119.183 119.587 -0.404 17865
322 1 . 1 1 59 59 LYS HA H 84 3.830 3.830 3.955 -0.125 17865
323 1 . 1 1 59 59 LYS C C 84 177.933 177.933 178.136 -0.203 17865
324 1 . 1 1 59 59 LYS CA C 84 59.043 59.043 58.568 0.475 17865
325 1 . 1 1 59 59 LYS CB C 84 33.650 33.650 32.755 0.895 17865
326 1 . 1 1 59 59 LYS H H 84 7.968 7.968 7.843 0.125 17865
327 1 . 1 1 60 60 TYR N N 85 113.663 113.663 115.834 -2.171 17865
328 1 . 1 1 60 60 TYR HA H 85 4.703 4.703 4.651 0.052 17865
329 1 . 1 1 60 60 TYR C C 85 174.729 174.729 174.775 -0.046 17865
330 1 . 1 1 60 60 TYR CA C 85 57.202 57.202 56.600 0.602 17865
331 1 . 1 1 60 60 TYR CB C 85 37.902 37.902 37.352 0.550 17865
332 1 . 1 1 60 60 TYR H H 85 7.562 7.562 7.851 -0.289 17865
333 1 . 1 1 61 61 LYS N N 86 121.862 121.862 122.266 -0.404 17865
334 1 . 1 1 61 61 LYS HA H 86 4.512 4.512 4.435 0.077 17865
335 1 . 1 1 61 61 LYS CA C 86 54.942 54.942 55.421 -0.479 17865
336 1 . 1 1 61 61 LYS CB C 86 32.102 32.102 32.302 -0.200 17865
337 1 . 1 1 61 61 LYS H H 86 7.222 7.222 7.450 -0.228 17865
338 1 . 1 1 62 62 PRO HA H 87 4.323 4.323 4.471 -0.148 17865
339 1 . 1 1 62 62 PRO C C 87 176.576 176.576 176.307 0.269 17865
340 1 . 1 1 62 62 PRO CA C 87 63.020 63.020 62.696 0.324 17865
341 1 . 1 1 62 62 PRO CB C 87 32.240 32.240 32.477 -0.237 17865
342 1 . 1 1 63 63 ALA N N 88 125.029 125.029 124.114 0.915 17865
343 1 . 1 1 63 63 ALA HA H 88 4.254 4.254 4.335 -0.081 17865
344 1 . 1 1 63 63 ALA C C 88 177.301 177.301 176.530 0.771 17865
345 1 . 1 1 63 63 ALA CA C 88 52.281 52.281 52.261 0.020 17865
346 1 . 1 1 63 63 ALA CB C 88 19.202 19.202 17.853 1.349 17865
347 1 . 1 1 63 63 ALA H H 88 8.329 8.329 8.288 0.041 17865
348 1 . 1 1 64 64 VAL N N 89 121.843 121.843 120.569 1.274 17865
349 1 . 1 1 64 64 VAL HA H 89 3.944 3.944 4.425 -0.481 17865
350 1 . 1 1 64 64 VAL C C 89 174.791 174.791 174.493 0.298 17865
351 1 . 1 1 64 64 VAL CA C 89 61.981 61.981 60.411 1.570 17865
352 1 . 1 1 64 64 VAL CB C 89 33.485 33.485 34.848 -1.363 17865
353 1 . 1 1 64 64 VAL H H 89 8.075 8.075 7.763 0.312 17865
354 1 . 1 1 65 65 VAL N N 90 125.399 125.399 120.342 5.057 17865
355 1 . 1 1 65 65 VAL HA H 90 4.138 4.138 4.340 -0.202 17865
356 1 . 1 1 65 65 VAL C C 90 174.340 174.340 174.624 -0.284 17865
357 1 . 1 1 65 65 VAL CA C 90 61.162 61.162 61.975 -0.813 17865
358 1 . 1 1 65 65 VAL CB C 90 33.866 33.866 31.597 2.269 17865
359 1 . 1 1 65 65 VAL H H 90 8.229 8.229 8.154 0.075 17865
360 1 . 1 1 66 66 TYR N N 91 124.848 124.848 126.949 -2.101 17865
361 1 . 1 1 66 66 TYR HA H 91 4.771 4.771 4.824 -0.053 17865
362 1 . 1 1 66 66 TYR C C 91 176.658 176.658 176.263 0.395 17865
363 1 . 1 1 66 66 TYR CA C 91 58.084 58.084 57.354 0.730 17865
364 1 . 1 1 66 66 TYR CB C 91 41.535 41.535 41.242 0.293 17865
365 1 . 1 1 66 66 TYR H H 91 9.145 9.145 8.263 0.882 17865
366 1 . 1 1 67 67 GLY N N 92 106.185 106.185 108.500 -2.315 17865
367 1 . 1 1 67 67 GLY C C 92 175.681 175.681 174.864 0.817 17865
368 1 . 1 1 67 67 GLY CA C 92 43.975 43.975 43.685 0.290 17865
369 1 . 1 1 67 67 GLY H H 92 8.730 8.730 8.856 -0.126 17865
370 1 . 1 1 68 68 TYR N N 93 121.815 121.815 118.084 3.731 17865
371 1 . 1 1 68 68 TYR HA H 93 3.975 3.975 4.329 -0.354 17865
372 1 . 1 1 68 68 TYR C C 93 176.035 176.035 176.077 -0.042 17865
373 1 . 1 1 68 68 TYR CA C 93 61.046 61.046 59.553 1.493 17865
374 1 . 1 1 68 68 TYR CB C 93 38.425 38.425 38.080 0.345 17865
375 1 . 1 1 68 68 TYR H H 93 8.711 8.711 8.598 0.113 17865
376 1 . 1 1 69 69 ASP N N 94 115.507 115.507 118.493 -2.986 17865
377 1 . 1 1 69 69 ASP HA H 94 4.288 4.288 4.466 -0.178 17865
378 1 . 1 1 69 69 ASP C C 94 177.063 177.063 177.206 -0.143 17865
379 1 . 1 1 69 69 ASP CA C 94 53.011 53.011 53.747 -0.736 17865
380 1 . 1 1 69 69 ASP CB C 94 40.167 40.167 40.657 -0.490 17865
381 1 . 1 1 69 69 ASP H H 94 8.010 8.010 7.667 0.343 17865
382 1 . 1 1 70 70 GLY N N 95 107.196 107.196 107.571 -0.374 17865
383 1 . 1 1 70 70 GLY C C 95 173.936 173.936 173.725 0.211 17865
384 1 . 1 1 70 70 GLY CA C 95 45.392 45.392 45.087 0.305 17865
385 1 . 1 1 70 70 GLY H H 95 7.986 7.986 7.756 0.230 17865
386 1 . 1 1 71 71 LYS N N 96 121.258 121.258 120.411 0.847 17865
387 1 . 1 1 71 71 LYS HA H 96 4.784 4.784 4.675 0.109 17865
388 1 . 1 1 71 71 LYS CA C 96 54.114 54.114 53.327 0.787 17865
389 1 . 1 1 71 71 LYS CB C 96 31.762 31.762 33.102 -1.339 17865
390 1 . 1 1 71 71 LYS H H 96 7.877 7.877 7.616 0.261 17865
391 1 . 1 1 72 72 PRO C C 97 177.170 177.170 175.663 1.507 17865
392 1 . 1 1 72 72 PRO CA C 97 63.137 63.137 62.778 0.359 17865
393 1 . 1 1 72 72 PRO CB C 97 32.240 32.240 30.549 1.691 17865
394 1 . 1 1 73 73 LEU N N 98 123.503 123.503 122.082 1.421 17865
395 1 . 1 1 73 73 LEU HA H 98 4.360 4.360 4.693 -0.333 17865
396 1 . 1 1 73 73 LEU C C 98 176.354 176.354 175.513 0.841 17865
397 1 . 1 1 73 73 LEU CA C 98 53.927 53.927 53.274 0.653 17865
398 1 . 1 1 73 73 LEU CB C 98 42.272 42.272 44.954 -2.682 17865
399 1 . 1 1 73 73 LEU H H 98 8.850 8.850 7.718 1.132 17865
400 1 . 1 1 74 74 ASP N N 99 122.212 122.212 123.058 -0.846 17865
401 1 . 1 1 74 74 ASP HA H 99 4.597 4.597 4.715 -0.118 17865
402 1 . 1 1 74 74 ASP C C 99 175.819 175.819 175.996 -0.177 17865
403 1 . 1 1 74 74 ASP CA C 99 53.856 53.856 54.212 -0.356 17865
404 1 . 1 1 74 74 ASP CB C 99 40.989 40.989 40.950 0.039 17865
405 1 . 1 1 74 74 ASP H H 99 8.517 8.517 8.572 -0.055 17865
406 1 . 1 1 75 75 LEU N N 100 125.874 125.874 117.390 8.484 17865
407 1 . 1 1 75 75 LEU HA H 100 4.366 4.366 4.210 0.156 17865
408 1 . 1 1 75 75 LEU C C 100 178.426 178.426 177.568 0.858 17865
409 1 . 1 1 75 75 LEU CA C 100 53.631 53.631 55.529 -1.898 17865
410 1 . 1 1 75 75 LEU CB C 100 40.676 40.676 41.231 -0.556 17865
411 1 . 1 1 75 75 LEU H H 100 8.281 8.281 8.280 0.001 17865
412 1 . 1 1 76 76 GLY N N 101 110.604 110.604 109.178 1.426 17865
413 1 . 1 1 76 76 GLY C C 101 176.936 176.936 175.327 1.609 17865
414 1 . 1 1 76 76 GLY CA C 101 47.827 47.827 47.443 0.384 17865
415 1 . 1 1 76 76 GLY H H 101 8.914 8.914 8.251 0.663 17865
416 1 . 1 1 77 77 PHE N N 102 117.639 117.639 116.795 0.844 17865
417 1 . 1 1 77 77 PHE HA H 102 4.381 4.381 4.855 -0.474 17865
418 1 . 1 1 77 77 PHE C C 102 177.878 177.878 175.580 2.298 17865
419 1 . 1 1 77 77 PHE CA C 102 59.139 59.139 57.401 1.738 17865
420 1 . 1 1 77 77 PHE CB C 102 36.935 36.935 38.915 -1.980 17865
421 1 . 1 1 77 77 PHE H H 102 7.992 7.992 7.927 0.065 17865
422 1 . 1 1 78 78 CYS N N 103 121.136 121.136 118.116 3.020 17865
423 1 . 1 1 78 78 CYS HA H 103 4.385 4.385 4.702 -0.317 17865
424 1 . 1 1 78 78 CYS C C 103 172.780 172.780 176.527 -3.747 17865
425 1 . 1 1 78 78 CYS CA C 103 53.696 53.696 58.684 -4.988 17865
426 1 . 1 1 78 78 CYS CB C 103 34.237 34.237 27.831 6.406 17865
427 1 . 1 1 78 78 CYS H H 103 7.362 7.362 7.983 -0.621 17865
428 1 . 1 1 79 79 THR N N 104 114.773 114.773 117.352 -2.579 17865
429 1 . 1 1 79 79 THR HA H 104 3.984 3.984 4.164 -0.180 17865
430 1 . 1 1 79 79 THR C C 104 176.624 176.624 175.675 0.949 17865
431 1 . 1 1 79 79 THR CA C 104 65.180 65.180 65.315 -0.135 17865
432 1 . 1 1 79 79 THR CB C 104 69.062 69.062 68.506 0.556 17865
433 1 . 1 1 79 79 THR H H 104 7.864 7.864 8.117 -0.253 17865
434 1 . 1 1 80 80 LEU N N 105 119.785 119.785 118.721 1.064 17865
435 1 . 1 1 80 80 LEU HA H 105 4.331 4.331 4.322 0.009 17865
436 1 . 1 1 80 80 LEU C C 105 177.208 177.208 176.920 0.288 17865
437 1 . 1 1 80 80 LEU CA C 105 55.453 55.453 55.605 -0.152 17865
438 1 . 1 1 80 80 LEU CB C 105 41.293 41.293 40.897 0.396 17865
439 1 . 1 1 80 80 LEU H H 105 7.238 7.238 7.816 -0.578 17865
440 1 . 1 1 81 81 ALA N N 106 119.309 119.309 120.626 -1.317 17865
441 1 . 1 1 81 81 ALA HA H 106 4.527 4.527 4.533 -0.006 17865
442 1 . 1 1 81 81 ALA C C 106 178.769 178.769 177.483 1.286 17865
443 1 . 1 1 81 81 ALA CA C 106 52.049 52.049 51.966 0.083 17865
444 1 . 1 1 81 81 ALA CB C 106 18.820 18.820 20.534 -1.714 17865
445 1 . 1 1 81 81 ALA H H 106 7.432 7.432 7.680 -0.248 17865
446 1 . 1 1 82 82 GLY N N 107 109.793 109.793 107.729 2.064 17865
447 1 . 1 1 82 82 GLY CA C 107 47.119 47.119 45.689 1.430 17865
448 1 . 1 1 82 82 GLY H H 107 7.918 7.918 8.042 -0.124 17865
449 1 . 1 1 83 83 ILE HA H 108 4.266 4.266 3.931 0.335 17865
450 1 . 1 1 83 83 ILE CA C 108 63.263 63.263 63.206 0.056 17865
451 1 . 1 1 83 83 ILE CB C 108 38.261 38.261 38.003 0.258 17865
452 1 . 1 1 84 84 ARG HA H 109 4.755 4.755 4.184 0.571 17865
453 1 . 1 1 84 84 ARG C C 109 181.344 181.344 177.659 3.685 17865
454 1 . 1 1 84 84 ARG CA C 109 55.939 55.939 57.231 -1.292 17865
455 1 . 1 1 84 84 ARG CB C 109 30.283 30.283 29.053 1.230 17865
456 1 . 1 1 85 85 GLU N N 110 122.944 122.944 120.839 2.105 17865
457 1 . 1 1 85 85 GLU HA H 110 3.617 3.617 4.137 -0.520 17865
458 1 . 1 1 85 85 GLU C C 110 177.797 177.797 178.215 -0.418 17865
459 1 . 1 1 85 85 GLU CA C 110 60.728 60.728 59.423 1.305 17865
460 1 . 1 1 85 85 GLU CB C 110 28.871 28.871 29.305 -0.434 17865
461 1 . 1 1 85 85 GLU H H 110 8.003 8.003 7.850 0.153 17865
462 1 . 1 1 86 86 VAL N N 111 117.101 117.101 118.499 -1.398 17865
463 1 . 1 1 86 86 VAL HA H 111 3.511 3.511 3.663 -0.152 17865
464 1 . 1 1 86 86 VAL C C 111 177.710 177.710 178.004 -0.294 17865
465 1 . 1 1 86 86 VAL CA C 111 66.430 66.430 66.165 0.265 17865
466 1 . 1 1 86 86 VAL CB C 111 31.213 31.213 31.407 -0.195 17865
467 1 . 1 1 86 86 VAL H H 111 8.106 8.106 7.569 0.537 17865
468 1 . 1 1 87 87 ASP N N 112 122.242 122.242 119.275 2.967 17865
469 1 . 1 1 87 87 ASP HA H 112 4.304 4.304 4.447 -0.143 17865
470 1 . 1 1 87 87 ASP C C 112 176.912 176.912 178.132 -1.220 17865
471 1 . 1 1 87 87 ASP CA C 112 57.417 57.417 57.102 0.315 17865
472 1 . 1 1 87 87 ASP CB C 112 40.476 40.476 40.825 -0.349 17865
473 1 . 1 1 87 87 ASP H H 112 7.401 7.401 7.890 -0.489 17865
474 1 . 1 1 88 88 CYS N N 113 120.819 120.819 119.096 1.723 17865
475 1 . 1 1 88 88 CYS HA H 113 3.309 3.309 4.167 -0.858 17865
476 1 . 1 1 88 88 CYS C C 113 175.270 175.270 176.769 -1.499 17865
477 1 . 1 1 88 88 CYS CA C 113 59.759 59.759 61.578 -1.819 17865
478 1 . 1 1 88 88 CYS CB C 113 33.835 33.835 26.315 7.520 17865
479 1 . 1 1 88 88 CYS H H 113 7.785 7.785 8.120 -0.335 17865
480 1 . 1 1 89 89 ARG N N 114 118.654 118.654 119.852 -1.198 17865
481 1 . 1 1 89 89 ARG HA H 114 3.641 3.641 4.053 -0.412 17865
482 1 . 1 1 89 89 ARG C C 114 179.018 179.018 178.280 0.738 17865
483 1 . 1 1 89 89 ARG CA C 114 60.193 60.193 59.126 1.067 17865
484 1 . 1 1 89 89 ARG CB C 114 29.713 29.713 29.750 -0.037 17865
485 1 . 1 1 89 89 ARG H H 114 8.142 8.142 7.891 0.251 17865
486 1 . 1 1 90 90 LYS N N 115 120.964 120.964 118.128 2.836 17865
487 1 . 1 1 90 90 LYS HA H 115 4.030 4.030 4.164 -0.134 17865
488 1 . 1 1 90 90 LYS C C 115 180.092 180.092 178.432 1.660 17865
489 1 . 1 1 90 90 LYS CA C 115 59.568 59.568 59.018 0.550 17865
490 1 . 1 1 90 90 LYS CB C 115 32.221 32.221 32.391 -0.170 17865
491 1 . 1 1 90 90 LYS H H 115 7.936 7.936 7.649 0.287 17865
492 1 . 1 1 91 91 ASP N N 116 121.690 121.690 119.134 2.556 17865
493 1 . 1 1 91 91 ASP HA H 116 4.513 4.513 4.595 -0.082 17865
494 1 . 1 1 91 91 ASP C C 116 179.419 179.419 178.162 1.257 17865
495 1 . 1 1 91 91 ASP CA C 116 57.237 57.237 56.758 0.479 17865
496 1 . 1 1 91 91 ASP CB C 116 40.648 40.648 41.121 -0.473 17865
497 1 . 1 1 91 91 ASP H H 116 8.558 8.558 7.755 0.803 17865
498 1 . 1 1 92 92 ALA N N 117 122.784 122.784 123.076 -0.292 17865
499 1 . 1 1 92 92 ALA HA H 117 4.023 4.023 4.091 -0.069 17865
500 1 . 1 1 92 92 ALA C C 117 178.789 178.789 179.284 -0.495 17865
501 1 . 1 1 92 92 ALA CA C 117 55.051 55.051 55.122 -0.071 17865
502 1 . 1 1 92 92 ALA CB C 117 19.175 19.175 18.550 0.625 17865
503 1 . 1 1 92 92 ALA H H 117 8.703 8.703 8.074 0.629 17865
504 1 . 1 1 93 93 GLN N N 118 115.510 115.510 115.969 -0.459 17865
505 1 . 1 1 93 93 GLN HA H 118 3.944 3.944 4.136 -0.193 17865
506 1 . 1 1 93 93 GLN C C 118 178.745 178.745 177.398 1.347 17865
507 1 . 1 1 93 93 GLN CA C 118 58.482 58.482 57.746 0.736 17865
508 1 . 1 1 93 93 GLN CB C 118 28.397 28.397 28.194 0.203 17865
509 1 . 1 1 93 93 GLN H H 118 7.664 7.664 8.432 -0.768 17865
510 1 . 1 1 94 94 THR N N 119 110.110 110.110 113.511 -3.401 17865
511 1 . 1 1 94 94 THR HA H 119 4.237 4.237 4.255 -0.018 17865
512 1 . 1 1 94 94 THR C C 119 175.861 175.861 175.614 0.247 17865
513 1 . 1 1 94 94 THR CA C 119 64.604 64.604 64.570 0.034 17865
514 1 . 1 1 94 94 THR CB C 119 69.716 69.716 69.029 0.687 17865
515 1 . 1 1 94 94 THR H H 119 7.726 7.726 7.675 0.051 17865
516 1 . 1 1 95 95 CYS N N 120 118.523 118.523 121.418 -2.895 17865
517 1 . 1 1 95 95 CYS HA H 120 4.733 4.733 4.437 0.296 17865
518 1 . 1 1 95 95 CYS C C 120 175.165 175.165 175.076 0.089 17865
519 1 . 1 1 95 95 CYS CA C 120 52.973 52.973 59.153 -6.180 17865
520 1 . 1 1 95 95 CYS CB C 120 36.731 36.731 24.923 11.808 17865
521 1 . 1 1 95 95 CYS H H 120 7.756 7.756 7.977 -0.221 17865
522 1 . 1 1 96 96 ASP N N 121 119.081 119.081 122.705 -3.624 17865
523 1 . 1 1 96 96 ASP HA H 121 4.678 4.678 4.415 0.263 17865
524 1 . 1 1 96 96 ASP CA C 121 56.224 56.224 56.882 -0.658 17865
525 1 . 1 1 96 96 ASP CB C 121 42.731 42.731 41.189 1.542 17865
526 1 . 1 1 96 96 ASP H H 121 7.354 7.354 8.416 -1.062 17865
527 1 . 1 1 97 97 LYS HA H 122 3.575 3.575 4.446 -0.871 17865
528 1 . 1 1 97 97 LYS C C 122 175.510 175.510 177.370 -1.860 17865
529 1 . 1 1 97 97 LYS CA C 122 57.839 57.839 57.259 0.581 17865
530 1 . 1 1 97 97 LYS CB C 122 30.750 30.750 34.162 -3.412 17865
531 1 . 1 1 98 98 LYS N N 123 119.980 119.980 118.619 1.361 17865
532 1 . 1 1 98 98 LYS HA H 123 4.294 4.294 4.480 -0.186 17865
533 1 . 1 1 98 98 LYS C C 123 176.968 176.968 178.095 -1.127 17865
534 1 . 1 1 98 98 LYS CA C 123 55.904 55.904 57.177 -1.273 17865
535 1 . 1 1 98 98 LYS CB C 123 33.232 33.232 33.339 -0.107 17865
536 1 . 1 1 98 98 LYS H H 123 7.799 7.799 8.218 -0.419 17865
537 1 . 1 1 99 99 TYR N N 124 122.378 122.378 121.592 0.786 17865
538 1 . 1 1 99 99 TYR HA H 124 3.895 3.895 4.244 -0.349 17865
539 1 . 1 1 99 99 TYR C C 124 177.126 177.126 177.154 -0.028 17865
540 1 . 1 1 99 99 TYR CA C 124 60.211 60.211 60.856 -0.645 17865
541 1 . 1 1 99 99 TYR CB C 124 38.271 38.271 38.446 -0.175 17865
542 1 . 1 1 99 99 TYR H H 124 8.536 8.536 8.241 0.295 17865
543 1 . 1 1 100 100 GLU N N 125 118.610 118.610 117.187 1.423 17865
544 1 . 1 1 100 100 GLU HA H 125 4.268 4.268 4.256 0.012 17865
545 1 . 1 1 100 100 GLU C C 125 177.387 177.387 177.822 -0.435 17865
546 1 . 1 1 100 100 GLU CA C 125 55.759 55.759 57.076 -1.317 17865
547 1 . 1 1 100 100 GLU CB C 125 27.321 27.321 29.032 -1.711 17865
548 1 . 1 1 100 100 GLU H H 125 8.385 8.385 8.609 -0.224 17865
549 1 . 1 1 101 101 SER N N 126 115.949 115.949 116.686 -0.737 17865
550 1 . 1 1 101 101 SER HA H 126 3.959 3.959 4.162 -0.203 17865
551 1 . 1 1 101 101 SER C C 126 176.047 176.047 175.995 0.052 17865
552 1 . 1 1 101 101 SER CA C 126 62.439 62.439 61.925 0.514 17865
553 1 . 1 1 101 101 SER CB C 126 63.299 63.299 62.974 0.325 17865
554 1 . 1 1 101 101 SER H H 126 7.823 7.823 7.863 -0.040 17865
555 1 . 1 1 102 102 ASP N N 127 120.920 120.920 121.115 -0.195 17865
556 1 . 1 1 102 102 ASP HA H 127 4.407 4.407 4.294 0.113 17865
557 1 . 1 1 102 102 ASP C C 127 178.234 178.234 178.133 0.101 17865
558 1 . 1 1 102 102 ASP CA C 127 57.411 57.411 57.695 -0.284 17865
559 1 . 1 1 102 102 ASP CB C 127 39.716 39.716 40.519 -0.803 17865
560 1 . 1 1 102 102 ASP H H 127 8.683 8.683 7.977 0.706 17865
561 1 . 1 1 103 103 LYS N N 128 121.753 121.753 118.567 3.186 17865
562 1 . 1 1 103 103 LYS HA H 128 4.004 4.004 4.077 -0.072 17865
563 1 . 1 1 103 103 LYS C C 128 179.395 179.395 178.661 0.734 17865
564 1 . 1 1 103 103 LYS CA C 128 59.471 59.471 58.528 0.943 17865
565 1 . 1 1 103 103 LYS CB C 128 32.401 32.401 31.779 0.622 17865
566 1 . 1 1 103 103 LYS H H 128 7.771 7.771 7.938 -0.167 17865
567 1 . 1 1 104 104 CYS N N 129 120.109 120.109 119.906 0.203 17865
568 1 . 1 1 104 104 CYS HA H 129 4.194 4.194 4.292 -0.098 17865
569 1 . 1 1 104 104 CYS C C 129 176.779 176.779 176.816 -0.037 17865
570 1 . 1 1 104 104 CYS CA C 129 59.790 59.790 61.394 -1.604 17865
571 1 . 1 1 104 104 CYS CB C 129 36.879 36.879 26.201 10.678 17865
572 1 . 1 1 104 104 CYS H H 129 7.973 7.973 8.006 -0.033 17865
573 1 . 1 1 105 105 LEU N N 130 121.804 121.804 122.141 -0.337 17865
574 1 . 1 1 105 105 LEU HA H 130 4.090 4.090 3.963 0.127 17865
575 1 . 1 1 105 105 LEU C C 130 179.373 179.373 178.713 0.660 17865
576 1 . 1 1 105 105 LEU CA C 130 57.368 57.368 58.338 -0.970 17865
577 1 . 1 1 105 105 LEU CB C 130 42.098 42.098 41.693 0.405 17865
578 1 . 1 1 105 105 LEU H H 130 8.666 8.666 8.529 0.137 17865
579 1 . 1 1 106 106 ASN N N 131 118.535 118.535 116.628 1.907 17865
580 1 . 1 1 106 106 ASN HA H 131 4.238 4.238 4.430 -0.192 17865
581 1 . 1 1 106 106 ASN C C 131 177.830 177.830 177.407 0.423 17865
582 1 . 1 1 106 106 ASN CA C 131 56.256 56.256 56.054 0.202 17865
583 1 . 1 1 106 106 ASN CB C 131 37.817 37.817 38.033 -0.216 17865
584 1 . 1 1 106 106 ASN H H 131 8.438 8.438 8.055 0.383 17865
585 1 . 1 1 107 107 ALA N N 132 121.485 121.485 122.518 -1.033 17865
586 1 . 1 1 107 107 ALA HA H 132 4.219 4.219 4.245 -0.026 17865
587 1 . 1 1 107 107 ALA C C 132 180.726 180.726 179.164 1.562 17865
588 1 . 1 1 107 107 ALA CA C 132 54.963 54.963 54.456 0.507 17865
589 1 . 1 1 107 107 ALA CB C 132 17.821 17.821 18.845 -1.024 17865
590 1 . 1 1 107 107 ALA H H 132 7.541 7.541 7.416 0.125 17865
591 1 . 1 1 108 108 ILE N N 133 120.979 120.979 118.103 2.876 17865
592 1 . 1 1 108 108 ILE HA H 133 3.931 3.931 3.799 0.132 17865
593 1 . 1 1 108 108 ILE C C 133 178.114 178.114 177.816 0.298 17865
594 1 . 1 1 108 108 ILE CA C 133 63.353 63.353 63.157 0.196 17865
595 1 . 1 1 108 108 ILE CB C 133 36.454 36.454 37.210 -0.756 17865
596 1 . 1 1 108 108 ILE H H 133 7.551 7.551 8.089 -0.538 17865
597 1 . 1 1 109 109 LYS N N 134 121.415 121.415 119.010 2.405 17865
598 1 . 1 1 109 109 LYS HA H 134 3.588 3.588 4.142 -0.554 17865
599 1 . 1 1 109 109 LYS C C 134 179.561 179.561 178.538 1.023 17865
600 1 . 1 1 109 109 LYS CA C 134 60.108 60.108 59.514 0.594 17865
601 1 . 1 1 109 109 LYS CB C 134 32.161 32.161 32.183 -0.022 17865
602 1 . 1 1 109 109 LYS H H 134 8.414 8.414 7.766 0.648 17865
603 1 . 1 1 110 110 GLU N N 135 116.099 116.099 118.457 -2.358 17865
604 1 . 1 1 110 110 GLU HA H 135 3.929 3.929 4.184 -0.255 17865
605 1 . 1 1 110 110 GLU C C 135 178.239 178.239 178.711 -0.472 17865
606 1 . 1 1 110 110 GLU CA C 135 58.646 58.646 58.581 0.065 17865
607 1 . 1 1 110 110 GLU CB C 135 29.638 29.638 28.983 0.655 17865
608 1 . 1 1 110 110 GLU H H 135 7.473 7.473 7.884 -0.411 17865
609 1 . 1 1 111 111 LYS N N 136 119.805 119.805 119.368 0.437 17865
610 1 . 1 1 111 111 LYS HA H 136 3.906 3.906 4.036 -0.130 17865
611 1 . 1 1 111 111 LYS C C 136 177.600 177.600 177.424 0.176 17865
612 1 . 1 1 111 111 LYS CA C 136 58.749 58.749 57.894 0.855 17865
613 1 . 1 1 111 111 LYS CB C 136 33.238 33.238 32.252 0.986 17865
614 1 . 1 1 111 111 LYS H H 136 7.540 7.540 7.618 -0.078 17865
615 1 . 1 1 112 112 TYR N N 137 114.768 114.768 116.660 -1.892 17865
616 1 . 1 1 112 112 TYR HA H 137 4.523 4.523 4.608 -0.085 17865
617 1 . 1 1 112 112 TYR C C 137 174.690 174.690 174.937 -0.247 17865
618 1 . 1 1 112 112 TYR CA C 137 58.359 58.359 56.667 1.692 17865
619 1 . 1 1 112 112 TYR CB C 137 38.328 38.328 37.653 0.675 17865
620 1 . 1 1 112 112 TYR H H 137 7.488 7.488 7.465 0.023 17865
621 1 . 1 1 113 113 LYS N N 138 123.694 123.694 122.351 1.343 17865
622 1 . 1 1 113 113 LYS HA H 138 4.501 4.501 4.484 0.017 17865
623 1 . 1 1 113 113 LYS CA C 138 55.282 55.282 54.638 0.644 17865
624 1 . 1 1 113 113 LYS CB C 138 32.124 32.124 32.389 -0.265 17865
625 1 . 1 1 113 113 LYS H H 138 7.217 7.217 7.399 -0.182 17865
626 1 . 1 1 114 114 PRO HA H 139 4.452 4.452 4.512 -0.060 17865
627 1 . 1 1 114 114 PRO C C 139 176.974 176.974 176.283 0.691 17865
628 1 . 1 1 114 114 PRO CA C 139 63.189 63.189 62.974 0.215 17865
629 1 . 1 1 114 114 PRO CB C 139 32.251 32.251 30.756 1.495 17865
630 1 . 1 1 115 115 VAL N N 140 121.098 121.098 119.475 1.623 17865
631 1 . 1 1 115 115 VAL HA H 140 4.102 4.102 4.188 -0.086 17865
632 1 . 1 1 115 115 VAL C C 140 176.207 176.207 175.793 0.414 17865
633 1 . 1 1 115 115 VAL CA C 140 62.356 62.356 62.397 -0.041 17865
634 1 . 1 1 115 115 VAL CB C 140 33.256 33.256 31.968 1.288 17865
635 1 . 1 1 115 115 VAL H H 140 8.272 8.272 7.964 0.308 17865
636 1 . 1 1 116 116 VAL N N 141 124.167 124.167 122.400 1.767 17865
637 1 . 1 1 116 116 VAL HA H 141 4.122 4.122 4.185 -0.063 17865
638 1 . 1 1 116 116 VAL C C 141 175.415 175.415 175.637 -0.222 17865
639 1 . 1 1 116 116 VAL CA C 141 61.731 61.731 61.974 -0.243 17865
640 1 . 1 1 116 116 VAL CB C 141 33.145 33.145 32.649 0.496 17865
641 1 . 1 1 116 116 VAL H H 141 8.142 8.142 7.658 0.484 17865
642 1 . 1 1 117 117 ASP N N 142 126.737 126.737 127.013 -0.276 17865
643 1 . 1 1 117 117 ASP HA H 142 4.812 4.812 4.801 0.011 17865
644 1 . 1 1 117 117 ASP CA C 142 52.217 52.217 52.530 -0.313 17865
645 1 . 1 1 117 117 ASP CB C 142 41.368 41.368 41.200 0.168 17865
646 1 . 1 1 117 117 ASP H H 142 8.419 8.419 8.357 0.062 17865
647 1 . 1 1 118 118 PRO HA H 143 4.411 4.411 4.394 0.017 17865
648 1 . 1 1 118 118 PRO C C 143 176.662 176.662 176.157 0.505 17865
649 1 . 1 1 118 118 PRO CA C 143 63.247 63.247 63.191 0.056 17865
650 1 . 1 1 118 118 PRO CB C 143 32.310 32.310 32.212 0.098 17865
651 1 . 1 1 119 119 ASN N N 144 119.287 119.287 119.695 -0.408 17865
652 1 . 1 1 119 119 ASN HA H 144 4.947 4.947 4.840 0.107 17865
653 1 . 1 1 119 119 ASN CA C 144 51.633 51.633 51.592 0.041 17865
654 1 . 1 1 119 119 ASN CB C 144 38.859 38.859 38.847 0.012 17865
655 1 . 1 1 119 119 ASN H H 144 8.432 8.432 8.257 0.175 17865
656 1 . 1 1 120 120 PRO HA H 145 4.680 4.680 4.653 0.027 17865
657 1 . 1 1 120 120 PRO CA C 145 61.640 61.640 62.116 -0.477 17865
658 1 . 1 1 120 120 PRO CB C 145 30.918 30.918 31.343 -0.425 17865
659 1 . 1 1 121 121 PRO HA H 146 4.377 4.377 4.431 -0.054 17865
660 1 . 1 1 121 121 PRO C C 146 175.876 175.876 176.168 -0.292 17865
661 1 . 1 1 121 121 PRO CA C 146 63.174 63.174 63.108 0.066 17865
662 1 . 1 1 121 121 PRO CB C 146 31.939 31.939 31.952 -0.013 17865
stop_
save_