data_18518
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18518
_Entry.PDB_ID 2LUE
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 18518
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 ALA HA H 2 4.336 4.336 5.061 -0.725 18518
2 1 1 . 1 1 2 2 ALA C C 2 177.974 177.974 177.195 0.779 18518
3 1 1 . 1 1 2 2 ALA CA C 2 52.785 52.785 52.324 0.461 18518
4 1 1 . 1 1 2 2 ALA CB C 2 19.444 19.444 20.392 -0.948 18518
5 1 1 . 1 1 3 3 MET N N 3 119.311 119.311 121.009 -1.698 18518
6 1 1 . 1 1 3 3 MET HA H 3 4.451 4.451 4.590 -0.139 18518
7 1 1 . 1 1 3 3 MET C C 3 176.913 176.913 175.547 1.366 18518
8 1 1 . 1 1 3 3 MET CA C 3 55.679 55.679 55.602 0.077 18518
9 1 1 . 1 1 3 3 MET CB C 3 32.590 32.590 34.841 -2.251 18518
10 1 1 . 1 1 3 3 MET H H 3 8.638 8.638 8.493 0.145 18518
11 1 1 . 1 1 4 4 GLY N N 4 110.281 110.281 113.047 -2.766 18518
12 1 1 . 1 1 4 4 GLY C C 4 174.180 174.180 173.728 0.452 18518
13 1 1 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.775 0.720 18518
14 1 1 . 1 1 4 4 GLY H H 4 8.552 8.552 8.645 -0.093 18518
15 1 1 . 1 1 5 5 LYS N N 5 120.818 120.818 126.395 -5.577 18518
16 1 1 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.727 -0.218 18518
17 1 1 . 1 1 5 5 LYS C C 5 177.605 177.605 176.522 1.083 18518
18 1 1 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.301 0.833 18518
19 1 1 . 1 1 5 5 LYS CB C 5 34.813 34.813 32.862 1.951 18518
20 1 1 . 1 1 5 5 LYS H H 5 8.133 8.133 7.823 0.310 18518
21 1 1 . 1 1 6 6 THR N N 6 114.781 114.781 117.455 -2.674 18518
22 1 1 . 1 1 6 6 THR HA H 6 4.421 4.421 4.333 0.088 18518
23 1 1 . 1 1 6 6 THR C C 6 175.524 175.524 175.807 -0.283 18518
24 1 1 . 1 1 6 6 THR CA C 6 61.127 61.127 60.834 0.293 18518
25 1 1 . 1 1 6 6 THR CB C 6 69.926 69.926 70.228 -0.302 18518
26 1 1 . 1 1 6 6 THR H H 6 8.483 8.483 8.439 0.044 18518
27 1 1 . 1 1 7 7 PHE N N 7 125.552 125.552 120.405 5.147 18518
28 1 1 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.219 -0.214 18518
29 1 1 . 1 1 7 7 PHE C C 7 177.397 177.397 176.572 0.825 18518
30 1 1 . 1 1 7 7 PHE CA C 7 63.393 63.393 60.664 2.729 18518
31 1 1 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.246 1.321 18518
32 1 1 . 1 1 7 7 PHE H H 7 10.245 10.245 9.196 1.049 18518
33 1 1 . 1 1 8 8 LYS N N 8 114.053 114.053 117.636 -3.583 18518
34 1 1 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.754 0.081 18518
35 1 1 . 1 1 8 8 LYS C C 8 175.520 175.520 178.432 -2.912 18518
36 1 1 . 1 1 8 8 LYS CA C 8 59.993 59.993 57.957 2.036 18518
37 1 1 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.448 2.241 18518
38 1 1 . 1 1 8 8 LYS H H 8 8.775 8.775 6.786 1.989 18518
39 1 1 . 1 1 9 9 GLN N N 9 113.516 113.516 117.910 -4.394 18518
40 1 1 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.109 0.040 18518
41 1 1 . 1 1 9 9 GLN C C 9 177.615 177.615 177.384 0.231 18518
42 1 1 . 1 1 9 9 GLN CA C 9 56.819 56.819 57.881 -1.062 18518
43 1 1 . 1 1 9 9 GLN CB C 9 30.019 30.019 29.182 0.837 18518
44 1 1 . 1 1 9 9 GLN H H 9 7.355 7.355 7.552 -0.197 18518
45 1 1 . 1 1 10 10 ARG N N 10 118.294 118.294 116.313 1.981 18518
46 1 1 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.236 0.066 18518
47 1 1 . 1 1 10 10 ARG C C 10 179.380 179.380 177.034 2.346 18518
48 1 1 . 1 1 10 10 ARG CA C 10 57.268 57.268 56.918 0.350 18518
49 1 1 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.927 0.715 18518
50 1 1 . 1 1 10 10 ARG H H 10 7.936 7.936 7.768 0.168 18518
51 1 1 . 1 1 11 11 ARG N N 11 121.137 121.137 119.584 1.553 18518
52 1 1 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.961 -0.281 18518
53 1 1 . 1 1 11 11 ARG CA C 11 53.453 53.453 53.831 -0.378 18518
54 1 1 . 1 1 11 11 ARG CB C 11 32.938 32.938 31.287 1.651 18518
55 1 1 . 1 1 11 11 ARG H H 11 7.390 7.390 7.493 -0.103 18518
56 1 1 . 1 1 12 12 THR N N 12 116.819 116.819 119.483 -2.664 18518
57 1 1 . 1 1 12 12 THR HA H 12 4.359 4.359 4.313 0.046 18518
58 1 1 . 1 1 12 12 THR C C 12 174.989 174.989 175.665 -0.676 18518
59 1 1 . 1 1 12 12 THR CA C 12 61.748 61.748 63.380 -1.632 18518
60 1 1 . 1 1 12 12 THR CB C 12 71.068 71.068 70.463 0.605 18518
61 1 1 . 1 1 12 12 THR H H 12 8.953 8.953 8.609 0.344 18518
62 1 1 . 1 1 13 13 PHE N N 13 123.200 123.200 123.002 0.198 18518
63 1 1 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.231 -0.203 18518
64 1 1 . 1 1 13 13 PHE C C 13 176.029 176.029 177.005 -0.976 18518
65 1 1 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.651 0.213 18518
66 1 1 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.435 0.125 18518
67 1 1 . 1 1 13 13 PHE H H 13 9.284 9.284 8.994 0.290 18518
68 1 1 . 1 1 14 14 GLU N N 14 115.414 115.414 118.511 -3.097 18518
69 1 1 . 1 1 14 14 GLU HA H 14 3.794 3.794 4.033 -0.239 18518
70 1 1 . 1 1 14 14 GLU C C 14 180.081 180.081 179.098 0.983 18518
71 1 1 . 1 1 14 14 GLU CA C 14 60.619 60.619 60.149 0.470 18518
72 1 1 . 1 1 14 14 GLU CB C 14 28.852 28.852 28.718 0.134 18518
73 1 1 . 1 1 14 14 GLU H H 14 8.973 8.973 8.844 0.129 18518
74 1 1 . 1 1 15 15 GLN N N 15 119.276 119.276 118.085 1.191 18518
75 1 1 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.342 -0.342 18518
76 1 1 . 1 1 15 15 GLN C C 15 177.978 177.978 179.234 -1.256 18518
77 1 1 . 1 1 15 15 GLN CA C 15 58.835 58.835 59.020 -0.185 18518
78 1 1 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.485 0.885 18518
79 1 1 . 1 1 15 15 GLN H H 15 7.756 7.756 8.561 -0.805 18518
80 1 1 . 1 1 16 16 ARG N N 16 121.336 121.336 120.411 0.925 18518
81 1 1 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.166 0.104 18518
82 1 1 . 1 1 16 16 ARG C C 16 177.416 177.416 178.791 -1.375 18518
83 1 1 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.501 1.874 18518
84 1 1 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.212 0.393 18518
85 1 1 . 1 1 16 16 ARG H H 16 8.645 8.645 7.925 0.720 18518
86 1 1 . 1 1 17 17 VAL N N 17 117.630 117.630 117.763 -0.133 18518
87 1 1 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.716 0.141 18518
88 1 1 . 1 1 17 17 VAL C C 17 179.748 179.748 177.736 2.012 18518
89 1 1 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.699 0.027 18518
90 1 1 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.432 0.762 18518
91 1 1 . 1 1 17 17 VAL H H 17 8.373 8.373 8.042 0.331 18518
92 1 1 . 1 1 18 18 GLU N N 18 120.864 120.864 120.633 0.231 18518
93 1 1 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.892 0.410 18518
94 1 1 . 1 1 18 18 GLU C C 18 177.728 177.728 178.353 -0.625 18518
95 1 1 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.908 -1.422 18518
96 1 1 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.467 -0.085 18518
97 1 1 . 1 1 18 18 GLU H H 18 7.368 7.368 8.192 -0.824 18518
98 1 1 . 1 1 19 19 ASP N N 19 121.425 121.425 120.139 1.286 18518
99 1 1 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.408 0.026 18518
100 1 1 . 1 1 19 19 ASP C C 19 179.978 179.978 178.522 1.456 18518
101 1 1 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.120 0.303 18518
102 1 1 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.578 0.709 18518
103 1 1 . 1 1 19 19 ASP H H 19 8.671 8.671 7.927 0.744 18518
104 1 1 . 1 1 20 20 VAL N N 20 119.730 119.730 119.998 -0.268 18518
105 1 1 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.379 -0.174 18518
106 1 1 . 1 1 20 20 VAL C C 20 176.284 176.284 178.055 -1.771 18518
107 1 1 . 1 1 20 20 VAL CA C 20 66.315 66.315 66.464 -0.149 18518
108 1 1 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.255 -0.148 18518
109 1 1 . 1 1 20 20 VAL H H 20 7.999 7.999 8.227 -0.228 18518
110 1 1 . 1 1 21 21 ARG N N 21 121.455 121.455 119.526 1.929 18518
111 1 1 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.965 -0.151 18518
112 1 1 . 1 1 21 21 ARG C C 21 180.120 180.120 178.681 1.439 18518
113 1 1 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.954 0.876 18518
114 1 1 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.245 0.701 18518
115 1 1 . 1 1 21 21 ARG H H 21 8.098 8.098 8.340 -0.242 18518
116 1 1 . 1 1 22 22 LEU N N 22 117.826 117.826 121.397 -3.571 18518
117 1 1 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.080 -0.032 18518
118 1 1 . 1 1 22 22 LEU C C 22 180.115 180.115 178.560 1.555 18518
119 1 1 . 1 1 22 22 LEU CA C 22 57.790 57.790 57.748 0.042 18518
120 1 1 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.564 0.578 18518
121 1 1 . 1 1 22 22 LEU H H 22 8.207 8.207 8.233 -0.026 18518
122 1 1 . 1 1 23 23 ILE N N 23 121.450 121.450 119.944 1.506 18518
123 1 1 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.922 0.091 18518
124 1 1 . 1 1 23 23 ILE C C 23 178.149 178.149 178.853 -0.704 18518
125 1 1 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.450 -2.279 18518
126 1 1 . 1 1 23 23 ILE CB C 23 38.106 38.106 36.802 1.304 18518
127 1 1 . 1 1 23 23 ILE H H 23 8.105 8.105 8.462 -0.357 18518
128 1 1 . 1 1 24 24 ARG N N 24 121.139 121.139 118.691 2.448 18518
129 1 1 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.046 -0.059 18518
130 1 1 . 1 1 24 24 ARG C C 24 178.702 178.702 179.008 -0.306 18518
131 1 1 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.723 -1.005 18518
132 1 1 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.562 -0.793 18518
133 1 1 . 1 1 24 24 ARG H H 24 8.601 8.601 8.292 0.309 18518
134 1 1 . 1 1 25 25 GLU N N 25 118.054 118.054 119.224 -1.170 18518
135 1 1 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.108 -0.082 18518
136 1 1 . 1 1 25 25 GLU C C 25 178.492 178.492 178.119 0.373 18518
137 1 1 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.396 0.384 18518
138 1 1 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.728 0.273 18518
139 1 1 . 1 1 25 25 GLU H H 25 7.423 7.423 7.776 -0.353 18518
140 1 1 . 1 1 26 26 GLN N N 26 116.350 116.350 117.019 -0.669 18518
141 1 1 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.040 -0.104 18518
142 1 1 . 1 1 26 26 GLN C C 26 176.305 176.305 176.963 -0.658 18518
143 1 1 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.611 -0.108 18518
144 1 1 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.430 0.777 18518
145 1 1 . 1 1 26 26 GLN H H 26 7.524 7.524 8.060 -0.536 18518
146 1 1 . 1 1 27 27 HIS N N 27 116.017 116.017 119.006 -2.989 18518
147 1 1 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.091 -0.161 18518
148 1 1 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.925 0.130 18518
149 1 1 . 1 1 27 27 HIS CB C 27 30.747 30.747 29.502 1.245 18518
150 1 1 . 1 1 27 27 HIS H H 27 8.284 8.284 8.135 0.149 18518
151 1 1 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.561 0.020 18518
152 1 1 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.586 0.333 18518
153 1 1 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.204 0.251 18518
154 1 1 . 1 1 29 29 THR N N 29 107.011 107.011 107.788 -0.777 18518
155 1 1 . 1 1 29 29 THR HA H 29 4.599 4.599 4.368 0.231 18518
156 1 1 . 1 1 29 29 THR C C 29 172.884 172.884 173.788 -0.904 18518
157 1 1 . 1 1 29 29 THR CA C 29 60.810 60.810 61.551 -0.741 18518
158 1 1 . 1 1 29 29 THR CB C 29 68.531 68.531 68.493 0.037 18518
159 1 1 . 1 1 29 29 THR H H 29 7.890 7.890 8.402 -0.512 18518
160 1 1 . 1 1 30 30 LYS N N 30 117.679 117.679 121.218 -3.539 18518
161 1 1 . 1 1 30 30 LYS HA H 30 4.858 4.858 5.077 -0.219 18518
162 1 1 . 1 1 30 30 LYS C C 30 174.310 174.310 174.549 -0.239 18518
163 1 1 . 1 1 30 30 LYS CA C 30 53.751 53.751 53.830 -0.079 18518
164 1 1 . 1 1 30 30 LYS CB C 30 35.804 35.804 36.059 -0.255 18518
165 1 1 . 1 1 30 30 LYS H H 30 7.441 7.441 7.612 -0.171 18518
166 1 1 . 1 1 31 31 ILE N N 31 122.849 122.849 122.951 -0.102 18518
167 1 1 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.386 -0.281 18518
168 1 1 . 1 1 31 31 ILE CA C 31 54.801 54.801 56.120 -1.319 18518
169 1 1 . 1 1 31 31 ILE CB C 31 38.265 38.265 38.630 -0.365 18518
170 1 1 . 1 1 31 31 ILE H H 31 9.304 9.304 8.891 0.413 18518
171 1 1 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.955 0.204 18518
172 1 1 . 1 1 32 32 PRO C C 32 174.164 174.164 175.661 -1.497 18518
173 1 1 . 1 1 32 32 PRO CA C 32 61.503 61.503 61.793 -0.290 18518
174 1 1 . 1 1 32 32 PRO CB C 32 31.145 31.145 30.628 0.517 18518
175 1 1 . 1 1 33 33 VAL N N 33 125.606 125.606 126.162 -0.556 18518
176 1 1 . 1 1 33 33 VAL HA H 33 5.213 5.213 4.931 0.282 18518
177 1 1 . 1 1 33 33 VAL C C 33 173.654 173.654 174.035 -0.381 18518
178 1 1 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.685 0.359 18518
179 1 1 . 1 1 33 33 VAL CB C 33 35.604 35.604 35.879 -0.275 18518
180 1 1 . 1 1 33 33 VAL H H 33 9.424 9.424 8.454 0.970 18518
181 1 1 . 1 1 34 34 ILE N N 34 128.241 128.241 129.140 -0.899 18518
182 1 1 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.631 0.202 18518
183 1 1 . 1 1 34 34 ILE C C 34 175.605 175.605 174.954 0.651 18518
184 1 1 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.522 -1.756 18518
185 1 1 . 1 1 34 34 ILE CB C 34 36.799 36.799 37.969 -1.170 18518
186 1 1 . 1 1 34 34 ILE H H 34 8.721 8.721 8.895 -0.174 18518
187 1 1 . 1 1 35 35 ILE N N 35 125.650 125.650 128.187 -2.537 18518
188 1 1 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.587 0.249 18518
189 1 1 . 1 1 35 35 ILE C C 35 174.887 174.887 174.311 0.576 18518
190 1 1 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.298 0.647 18518
191 1 1 . 1 1 35 35 ILE CB C 35 39.210 39.210 39.504 -0.294 18518
192 1 1 . 1 1 35 35 ILE H H 35 9.034 9.034 8.875 0.159 18518
193 1 1 . 1 1 36 36 GLU N N 36 122.657 122.657 127.333 -4.676 18518
194 1 1 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.881 -0.020 18518
195 1 1 . 1 1 36 36 GLU C C 36 173.848 173.848 174.696 -0.848 18518
196 1 1 . 1 1 36 36 GLU CA C 36 53.932 53.932 53.882 0.050 18518
197 1 1 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.487 0.795 18518
198 1 1 . 1 1 36 36 GLU H H 36 8.303 8.303 8.647 -0.344 18518
199 1 1 . 1 1 37 37 ARG N N 37 123.228 123.228 126.379 -3.151 18518
200 1 1 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.656 -0.930 18518
201 1 1 . 1 1 37 37 ARG C C 37 176.359 176.359 176.003 0.356 18518
202 1 1 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.339 0.020 18518
203 1 1 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.830 0.511 18518
204 1 1 . 1 1 37 37 ARG H H 37 8.856 8.856 8.706 0.150 18518
205 1 1 . 1 1 38 38 TYR N N 38 128.981 128.981 128.217 0.764 18518
206 1 1 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.433 -0.081 18518
207 1 1 . 1 1 38 38 TYR C C 38 177.316 177.316 176.879 0.437 18518
208 1 1 . 1 1 38 38 TYR CA C 38 57.712 57.712 57.501 0.211 18518
209 1 1 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.038 -0.566 18518
210 1 1 . 1 1 38 38 TYR H H 38 8.628 8.628 8.258 0.370 18518
211 1 1 . 1 1 39 39 LYS N N 39 130.635 130.635 127.004 3.631 18518
212 1 1 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.825 -0.003 18518
213 1 1 . 1 1 39 39 LYS CA C 39 58.887 58.887 58.089 0.798 18518
214 1 1 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.639 0.132 18518
215 1 1 . 1 1 39 39 LYS H H 39 8.594 8.594 8.695 -0.101 18518
216 1 1 . 1 1 40 40 GLY C C 40 173.447 173.447 173.159 0.288 18518
217 1 1 . 1 1 40 40 GLY CA C 40 44.663 44.663 43.291 1.372 18518
218 1 1 . 1 1 40 40 GLY H H 40 5.188 5.188 5.904 -0.716 18518
219 1 1 . 1 1 41 41 GLU N N 41 122.836 122.836 121.394 1.442 18518
220 1 1 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.221 0.036 18518
221 1 1 . 1 1 41 41 GLU C C 41 176.524 176.524 175.722 0.802 18518
222 1 1 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.669 -0.143 18518
223 1 1 . 1 1 41 41 GLU CB C 41 30.985 30.985 28.889 2.096 18518
224 1 1 . 1 1 41 41 GLU H H 41 7.380 7.380 7.410 -0.030 18518
225 1 1 . 1 1 42 42 LYS N N 42 124.040 124.040 125.338 -1.298 18518
226 1 1 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.318 0.357 18518
227 1 1 . 1 1 42 42 LYS C C 42 177.538 177.538 177.982 -0.444 18518
228 1 1 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.997 -1.157 18518
229 1 1 . 1 1 42 42 LYS CB C 42 34.979 34.979 32.817 2.162 18518
230 1 1 . 1 1 42 42 LYS H H 42 9.034 9.034 8.272 0.762 18518
231 1 1 . 1 1 43 43 GLN N N 43 119.259 119.259 119.491 -0.232 18518
232 1 1 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.217 0.325 18518
233 1 1 . 1 1 43 43 GLN C C 43 177.336 177.336 176.339 0.997 18518
234 1 1 . 1 1 43 43 GLN CA C 43 57.673 57.673 57.443 0.230 18518
235 1 1 . 1 1 43 43 GLN CB C 43 30.782 30.782 28.544 2.237 18518
236 1 1 . 1 1 43 43 GLN H H 43 8.435 8.435 8.349 0.086 18518
237 1 1 . 1 1 44 44 LEU N N 44 120.760 120.760 123.601 -2.841 18518
238 1 1 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.589 0.106 18518
239 1 1 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.903 0.342 18518
240 1 1 . 1 1 44 44 LEU CB C 44 43.596 43.596 41.374 2.221 18518
241 1 1 . 1 1 44 44 LEU H H 44 9.126 9.126 7.895 1.231 18518
242 1 1 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.576 0.141 18518
243 1 1 . 1 1 45 45 PRO C C 45 175.797 175.797 176.221 -0.424 18518
244 1 1 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.188 -0.077 18518
245 1 1 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.623 -0.031 18518
246 1 1 . 1 1 46 46 VAL N N 46 119.052 119.052 119.747 -0.695 18518
247 1 1 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.409 -0.542 18518
248 1 1 . 1 1 46 46 VAL C C 46 175.640 175.640 175.875 -0.235 18518
249 1 1 . 1 1 46 46 VAL CA C 46 62.944 62.944 61.280 1.664 18518
250 1 1 . 1 1 46 46 VAL CB C 46 32.799 32.799 33.535 -0.736 18518
251 1 1 . 1 1 46 46 VAL H H 46 8.543 8.543 8.228 0.315 18518
252 1 1 . 1 1 47 47 LEU N N 47 130.203 130.203 128.664 1.539 18518
253 1 1 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.459 -0.150 18518
254 1 1 . 1 1 47 47 LEU C C 47 176.198 176.198 177.271 -1.073 18518
255 1 1 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.292 -0.286 18518
256 1 1 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.420 1.412 18518
257 1 1 . 1 1 47 47 LEU H H 47 7.799 7.799 8.348 -0.549 18518
258 1 1 . 1 1 48 48 ASP N N 48 122.403 122.403 122.193 0.210 18518
259 1 1 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.509 -0.246 18518
260 1 1 . 1 1 48 48 ASP C C 48 175.294 175.294 176.139 -0.845 18518
261 1 1 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.939 -0.107 18518
262 1 1 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.337 -1.153 18518
263 1 1 . 1 1 48 48 ASP H H 48 8.780 8.780 8.476 0.304 18518
264 1 1 . 1 1 49 49 LYS N N 49 119.569 119.569 116.084 3.485 18518
265 1 1 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.598 -0.013 18518
266 1 1 . 1 1 49 49 LYS C C 49 174.678 174.678 175.513 -0.835 18518
267 1 1 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.285 -1.633 18518
268 1 1 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.814 1.131 18518
269 1 1 . 1 1 49 49 LYS H H 49 7.280 7.280 7.534 -0.254 18518
270 1 1 . 1 1 50 50 THR N N 50 110.862 110.862 113.967 -3.105 18518
271 1 1 . 1 1 50 50 THR HA H 50 4.811 4.811 4.834 -0.023 18518
272 1 1 . 1 1 50 50 THR C C 50 172.425 172.425 173.880 -1.455 18518
273 1 1 . 1 1 50 50 THR CA C 50 62.645 62.645 62.278 0.367 18518
274 1 1 . 1 1 50 50 THR CB C 50 71.648 71.648 70.495 1.153 18518
275 1 1 . 1 1 50 50 THR H H 50 8.042 8.042 8.264 -0.222 18518
276 1 1 . 1 1 51 51 LYS N N 51 120.008 120.008 123.559 -3.551 18518
277 1 1 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.396 0.229 18518
278 1 1 . 1 1 51 51 LYS C C 51 175.082 175.082 175.416 -0.334 18518
279 1 1 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.418 -1.714 18518
280 1 1 . 1 1 51 51 LYS CB C 51 32.376 32.376 32.624 -0.248 18518
281 1 1 . 1 1 51 51 LYS H H 51 7.119 7.119 7.696 -0.577 18518
282 1 1 . 1 1 52 52 PHE N N 52 122.640 122.640 123.315 -0.675 18518
283 1 1 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.784 0.553 18518
284 1 1 . 1 1 52 52 PHE C C 52 174.213 174.213 174.837 -0.624 18518
285 1 1 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.425 0.186 18518
286 1 1 . 1 1 52 52 PHE CB C 52 43.140 43.140 42.753 0.387 18518
287 1 1 . 1 1 52 52 PHE H H 52 9.709 9.709 9.094 0.615 18518
288 1 1 . 1 1 53 53 LEU N N 53 122.157 122.157 123.127 -0.970 18518
289 1 1 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.899 0.048 18518
290 1 1 . 1 1 53 53 LEU C C 53 175.769 175.769 175.872 -0.103 18518
291 1 1 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.817 -0.860 18518
292 1 1 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.549 0.866 18518
293 1 1 . 1 1 53 53 LEU H H 53 8.959 8.959 8.472 0.487 18518
294 1 1 . 1 1 54 54 VAL N N 54 124.919 124.919 121.879 3.040 18518
295 1 1 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.808 -0.249 18518
296 1 1 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.149 0.981 18518
297 1 1 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.920 1.048 18518
298 1 1 . 1 1 54 54 VAL H H 54 8.922 8.922 8.458 0.464 18518
299 1 1 . 1 1 55 55 PRO HA H 55 4.441 4.441 5.020 -0.579 18518
300 1 1 . 1 1 55 55 PRO C C 55 176.594 176.594 178.291 -1.697 18518
301 1 1 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.144 2.171 18518
302 1 1 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.839 -0.174 18518
303 1 1 . 1 1 56 56 ASP N N 56 120.522 120.522 123.301 -2.779 18518
304 1 1 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.236 -0.374 18518
305 1 1 . 1 1 56 56 ASP C C 56 175.809 175.809 176.626 -0.817 18518
306 1 1 . 1 1 56 56 ASP CA C 56 56.749 56.749 57.417 -0.668 18518
307 1 1 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.346 0.164 18518
308 1 1 . 1 1 56 56 ASP H H 56 8.347 8.347 8.430 -0.083 18518
309 1 1 . 1 1 57 57 HIS N N 57 113.482 113.482 115.847 -2.365 18518
310 1 1 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.513 0.207 18518
311 1 1 . 1 1 57 57 HIS C C 57 176.507 176.507 174.780 1.727 18518
312 1 1 . 1 1 57 57 HIS CA C 57 55.589 55.589 55.657 -0.068 18518
313 1 1 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.078 1.565 18518
314 1 1 . 1 1 57 57 HIS H H 57 7.557 7.557 8.309 -0.752 18518
315 1 1 . 1 1 58 58 VAL N N 58 123.279 123.279 121.136 2.143 18518
316 1 1 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.086 -0.250 18518
317 1 1 . 1 1 58 58 VAL C C 58 175.019 175.019 174.251 0.768 18518
318 1 1 . 1 1 58 58 VAL CA C 58 62.823 62.823 60.346 2.477 18518
319 1 1 . 1 1 58 58 VAL CB C 58 32.310 32.310 34.644 -2.334 18518
320 1 1 . 1 1 58 58 VAL H H 58 7.345 7.345 7.821 -0.476 18518
321 1 1 . 1 1 59 59 ASN N N 59 123.781 123.781 119.749 4.032 18518
322 1 1 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.182 -0.056 18518
323 1 1 . 1 1 59 59 ASN C C 59 176.558 176.558 176.044 0.514 18518
324 1 1 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.314 0.171 18518
325 1 1 . 1 1 59 59 ASN CB C 59 40.107 40.107 41.277 -1.170 18518
326 1 1 . 1 1 59 59 ASN H H 59 8.735 8.735 8.146 0.589 18518
327 1 1 . 1 1 60 60 MET N N 60 117.453 117.453 118.457 -1.004 18518
328 1 1 . 1 1 60 60 MET HA H 60 4.395 4.395 4.194 0.201 18518
329 1 1 . 1 1 60 60 MET C C 60 178.144 178.144 178.377 -0.233 18518
330 1 1 . 1 1 60 60 MET CA C 60 57.097 57.097 57.015 0.082 18518
331 1 1 . 1 1 60 60 MET CB C 60 30.140 30.140 30.899 -0.759 18518
332 1 1 . 1 1 60 60 MET H H 60 8.227 8.227 8.183 0.044 18518
333 1 1 . 1 1 61 61 SER N N 61 114.216 114.216 115.540 -1.324 18518
334 1 1 . 1 1 61 61 SER HA H 61 4.111 4.111 4.127 -0.016 18518
335 1 1 . 1 1 61 61 SER C C 61 177.335 177.335 176.910 0.425 18518
336 1 1 . 1 1 61 61 SER CA C 61 61.590 61.590 62.298 -0.708 18518
337 1 1 . 1 1 61 61 SER CB C 61 62.402 62.402 62.598 -0.196 18518
338 1 1 . 1 1 61 61 SER H H 61 8.464 8.464 8.330 0.134 18518
339 1 1 . 1 1 62 62 GLU N N 62 123.004 123.004 120.938 2.066 18518
340 1 1 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.077 -0.030 18518
341 1 1 . 1 1 62 62 GLU C C 62 178.686 178.686 178.947 -0.261 18518
342 1 1 . 1 1 62 62 GLU CA C 62 58.625 58.625 59.111 -0.486 18518
343 1 1 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.546 0.108 18518
344 1 1 . 1 1 62 62 GLU H H 62 7.994 7.994 7.606 0.388 18518
345 1 1 . 1 1 63 63 LEU N N 63 120.818 120.818 122.107 -1.289 18518
346 1 1 . 1 1 63 63 LEU HA H 63 3.965 3.965 4.033 -0.068 18518
347 1 1 . 1 1 63 63 LEU C C 63 178.046 178.046 178.897 -0.851 18518
348 1 1 . 1 1 63 63 LEU CA C 63 57.920 57.920 57.866 0.054 18518
349 1 1 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.527 0.097 18518
350 1 1 . 1 1 63 63 LEU H H 63 8.130 8.130 7.841 0.289 18518
351 1 1 . 1 1 64 64 ILE N N 64 118.528 118.528 119.470 -0.942 18518
352 1 1 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.700 -0.331 18518
353 1 1 . 1 1 64 64 ILE C C 64 177.127 177.127 178.093 -0.966 18518
354 1 1 . 1 1 64 64 ILE CA C 64 66.678 66.678 64.852 1.826 18518
355 1 1 . 1 1 64 64 ILE CB C 64 38.444 38.444 36.518 1.926 18518
356 1 1 . 1 1 64 64 ILE H H 64 8.488 8.488 8.689 -0.201 18518
357 1 1 . 1 1 65 65 LYS N N 65 118.336 118.336 120.886 -2.550 18518
358 1 1 . 1 1 65 65 LYS HA H 65 3.701 3.701 4.033 -0.332 18518
359 1 1 . 1 1 65 65 LYS C C 65 179.291 179.291 179.340 -0.049 18518
360 1 1 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.477 0.963 18518
361 1 1 . 1 1 65 65 LYS CB C 65 32.371 32.371 31.945 0.426 18518
362 1 1 . 1 1 65 65 LYS H H 65 7.347 7.347 7.824 -0.477 18518
363 1 1 . 1 1 66 66 ILE N N 66 120.171 120.171 121.246 -1.075 18518
364 1 1 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.717 -0.139 18518
365 1 1 . 1 1 66 66 ILE C C 66 178.873 178.873 178.089 0.784 18518
366 1 1 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.656 -0.496 18518
367 1 1 . 1 1 66 66 ILE CB C 66 38.633 38.633 38.084 0.549 18518
368 1 1 . 1 1 66 66 ILE H H 66 7.901 7.901 8.114 -0.213 18518
369 1 1 . 1 1 67 67 ILE N N 67 121.185 121.185 120.367 0.818 18518
370 1 1 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.584 -0.138 18518
371 1 1 . 1 1 67 67 ILE C C 67 177.150 177.150 177.828 -0.678 18518
372 1 1 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.472 -1.666 18518
373 1 1 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.262 -2.267 18518
374 1 1 . 1 1 67 67 ILE H H 67 8.290 8.290 8.094 0.196 18518
375 1 1 . 1 1 68 68 ARG N N 68 119.173 119.173 119.030 0.143 18518
376 1 1 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.764 -0.833 18518
377 1 1 . 1 1 68 68 ARG C C 68 178.496 178.496 178.695 -0.199 18518
378 1 1 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.813 0.823 18518
379 1 1 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.823 0.617 18518
380 1 1 . 1 1 68 68 ARG H H 68 8.438 8.438 8.343 0.095 18518
381 1 1 . 1 1 69 69 ARG N N 69 116.511 116.511 119.800 -3.289 18518
382 1 1 . 1 1 69 69 ARG HA H 69 4.134 4.134 3.968 0.166 18518
383 1 1 . 1 1 69 69 ARG C C 69 180.262 180.262 179.088 1.174 18518
384 1 1 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.474 -0.767 18518
385 1 1 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.260 -0.307 18518
386 1 1 . 1 1 69 69 ARG H H 69 7.497 7.497 8.402 -0.905 18518
387 1 1 . 1 1 70 70 ARG N N 70 123.297 123.297 119.443 3.854 18518
388 1 1 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.136 -0.120 18518
389 1 1 . 1 1 70 70 ARG C C 70 178.700 178.700 178.206 0.494 18518
390 1 1 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.635 0.825 18518
391 1 1 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.876 0.436 18518
392 1 1 . 1 1 70 70 ARG H H 70 8.075 8.075 7.915 0.160 18518
393 1 1 . 1 1 71 71 LEU N N 71 116.829 116.829 119.830 -3.001 18518
394 1 1 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.273 -0.208 18518
395 1 1 . 1 1 71 71 LEU C C 71 174.956 174.956 175.934 -0.978 18518
396 1 1 . 1 1 71 71 LEU CA C 71 55.126 55.126 54.758 0.368 18518
397 1 1 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.585 0.661 18518
398 1 1 . 1 1 71 71 LEU H H 71 7.719 7.719 8.155 -0.436 18518
399 1 1 . 1 1 72 72 GLN N N 72 114.991 114.991 115.220 -0.229 18518
400 1 1 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.885 -0.049 18518
401 1 1 . 1 1 72 72 GLN C C 72 175.683 175.683 174.993 0.690 18518
402 1 1 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.041 0.284 18518
403 1 1 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.648 0.356 18518
404 1 1 . 1 1 72 72 GLN H H 72 7.744 7.744 7.485 0.259 18518
405 1 1 . 1 1 73 73 LEU N N 73 115.045 115.045 119.649 -4.604 18518
406 1 1 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.018 0.218 18518
407 1 1 . 1 1 73 73 LEU C C 73 178.762 178.762 177.197 1.565 18518
408 1 1 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.028 -0.642 18518
409 1 1 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.472 0.619 18518
410 1 1 . 1 1 73 73 LEU H H 73 7.500 7.500 7.522 -0.022 18518
411 1 1 . 1 1 74 74 ASN N N 74 121.700 121.700 123.846 -2.146 18518
412 1 1 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.610 0.080 18518
413 1 1 . 1 1 74 74 ASN C C 74 176.617 176.617 175.691 0.926 18518
414 1 1 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.462 -0.777 18518
415 1 1 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.488 0.110 18518
416 1 1 . 1 1 74 74 ASN H H 74 9.045 9.045 8.524 0.521 18518
417 1 1 . 1 1 75 75 ALA N N 75 123.952 123.952 123.021 0.931 18518
418 1 1 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.350 -0.386 18518
419 1 1 . 1 1 75 75 ALA C C 75 178.131 178.131 177.728 0.403 18518
420 1 1 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.401 1.467 18518
421 1 1 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.235 -0.517 18518
422 1 1 . 1 1 75 75 ALA H H 75 8.784 8.784 8.409 0.375 18518
423 1 1 . 1 1 76 76 ASN N N 76 112.295 112.295 117.283 -4.988 18518
424 1 1 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.613 -0.033 18518
425 1 1 . 1 1 76 76 ASN C C 76 175.448 175.448 175.355 0.093 18518
426 1 1 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.703 -0.489 18518
427 1 1 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.337 -0.016 18518
428 1 1 . 1 1 76 76 ASN H H 76 8.391 8.391 8.633 -0.242 18518
429 1 1 . 1 1 77 77 GLN N N 77 120.577 120.577 119.247 1.330 18518
430 1 1 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.679 -0.406 18518
431 1 1 . 1 1 77 77 GLN C C 77 175.045 175.045 173.585 1.460 18518
432 1 1 . 1 1 77 77 GLN CA C 77 55.805 55.805 55.180 0.625 18518
433 1 1 . 1 1 77 77 GLN CB C 77 30.157 30.157 31.197 -1.040 18518
434 1 1 . 1 1 77 77 GLN H H 77 7.552 7.552 7.537 0.015 18518
435 1 1 . 1 1 78 78 ALA N N 78 130.670 130.670 123.635 7.035 18518
436 1 1 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.677 -0.506 18518
437 1 1 . 1 1 78 78 ALA C C 78 176.512 176.512 175.332 1.180 18518
438 1 1 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.291 1.551 18518
439 1 1 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.550 -1.490 18518
440 1 1 . 1 1 78 78 ALA H H 78 8.799 8.799 8.628 0.171 18518
441 1 1 . 1 1 79 79 PHE N N 79 119.325 119.325 116.666 2.659 18518
442 1 1 . 1 1 79 79 PHE HA H 79 4.434 4.434 4.871 -0.437 18518
443 1 1 . 1 1 79 79 PHE C C 79 171.726 171.726 172.503 -0.777 18518
444 1 1 . 1 1 79 79 PHE CA C 79 59.145 59.145 56.602 2.543 18518
445 1 1 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.740 0.431 18518
446 1 1 . 1 1 79 79 PHE H H 79 7.664 7.664 8.163 -0.499 18518
447 1 1 . 1 1 80 80 PHE N N 80 126.314 126.314 117.373 8.941 18518
448 1 1 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.556 -0.164 18518
449 1 1 . 1 1 80 80 PHE C C 80 177.169 177.169 173.349 3.820 18518
450 1 1 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.217 0.437 18518
451 1 1 . 1 1 80 80 PHE CB C 80 41.933 41.933 43.267 -1.334 18518
452 1 1 . 1 1 80 80 PHE H H 80 8.508 8.508 8.686 -0.178 18518
453 1 1 . 1 1 81 81 LEU N N 81 121.426 121.426 121.722 -0.296 18518
454 1 1 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.067 -0.216 18518
455 1 1 . 1 1 81 81 LEU C C 81 174.488 174.488 174.942 -0.454 18518
456 1 1 . 1 1 81 81 LEU CA C 81 53.197 53.197 54.050 -0.854 18518
457 1 1 . 1 1 81 81 LEU CB C 81 45.100 45.100 44.825 0.275 18518
458 1 1 . 1 1 81 81 LEU H H 81 8.229 8.229 8.490 -0.261 18518
459 1 1 . 1 1 82 82 LEU N N 82 125.155 125.155 127.361 -2.206 18518
460 1 1 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.555 0.278 18518
461 1 1 . 1 1 82 82 LEU C C 82 177.166 177.166 175.417 1.749 18518
462 1 1 . 1 1 82 82 LEU CA C 82 54.197 54.197 54.061 0.136 18518
463 1 1 . 1 1 82 82 LEU CB C 82 43.442 43.442 43.300 0.142 18518
464 1 1 . 1 1 82 82 LEU H H 82 9.400 9.400 9.245 0.154 18518
465 1 1 . 1 1 83 83 VAL N N 83 123.886 123.886 123.986 -0.100 18518
466 1 1 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.293 0.086 18518
467 1 1 . 1 1 83 83 VAL C C 83 175.810 175.810 176.825 -1.015 18518
468 1 1 . 1 1 83 83 VAL CA C 83 61.677 61.677 62.343 -0.666 18518
469 1 1 . 1 1 83 83 VAL CB C 83 33.758 33.758 31.925 1.833 18518
470 1 1 . 1 1 83 83 VAL H H 83 8.721 8.721 8.654 0.067 18518
471 1 1 . 1 1 84 84 ASN N N 84 126.474 126.474 126.032 0.442 18518
472 1 1 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.529 -0.133 18518
473 1 1 . 1 1 84 84 ASN C C 84 175.164 175.164 175.115 0.049 18518
474 1 1 . 1 1 84 84 ASN CA C 84 54.738 54.738 55.218 -0.480 18518
475 1 1 . 1 1 84 84 ASN CB C 84 37.950 37.950 38.215 -0.265 18518
476 1 1 . 1 1 84 84 ASN H H 84 9.707 9.707 9.525 0.182 18518
477 1 1 . 1 1 85 85 GLY N N 85 101.296 101.296 104.198 -2.902 18518
478 1 1 . 1 1 85 85 GLY C C 85 173.680 173.680 173.148 0.532 18518
479 1 1 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.646 0.957 18518
480 1 1 . 1 1 85 85 GLY H H 85 8.644 8.644 8.194 0.450 18518
481 1 1 . 1 1 86 86 HIS N N 86 117.238 117.238 118.981 -1.743 18518
482 1 1 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.674 0.343 18518
483 1 1 . 1 1 86 86 HIS C C 86 173.841 173.841 173.933 -0.092 18518
484 1 1 . 1 1 86 86 HIS CA C 86 53.796 53.796 54.566 -0.770 18518
485 1 1 . 1 1 86 86 HIS CB C 86 31.280 31.280 32.195 -0.915 18518
486 1 1 . 1 1 86 86 HIS H H 86 7.918 7.918 8.370 -0.452 18518
487 1 1 . 1 1 87 87 SER N N 87 118.179 118.179 120.641 -2.462 18518
488 1 1 . 1 1 87 87 SER HA H 87 4.699 4.699 4.553 0.146 18518
489 1 1 . 1 1 87 87 SER C C 87 175.904 175.904 174.526 1.378 18518
490 1 1 . 1 1 87 87 SER CA C 87 58.271 58.271 58.182 0.089 18518
491 1 1 . 1 1 87 87 SER CB C 87 63.735 63.735 61.431 2.304 18518
492 1 1 . 1 1 87 87 SER H H 87 8.977 8.977 8.809 0.169 18518
493 1 1 . 1 1 88 88 MET N N 88 125.472 125.472 121.299 4.173 18518
494 1 1 . 1 1 88 88 MET HA H 88 4.830 4.830 4.651 0.179 18518
495 1 1 . 1 1 88 88 MET C C 88 176.419 176.419 175.385 1.034 18518
496 1 1 . 1 1 88 88 MET CA C 88 54.899 54.899 55.459 -0.560 18518
497 1 1 . 1 1 88 88 MET CB C 88 33.336 33.336 33.279 0.057 18518
498 1 1 . 1 1 88 88 MET H H 88 9.184 9.184 8.070 1.114 18518
499 1 1 . 1 1 89 89 VAL N N 89 120.747 120.747 121.403 -0.656 18518
500 1 1 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.224 0.008 18518
501 1 1 . 1 1 89 89 VAL C C 89 175.958 175.958 175.393 0.565 18518
502 1 1 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.667 1.487 18518
503 1 1 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.044 -1.166 18518
504 1 1 . 1 1 89 89 VAL H H 89 8.233 8.233 7.694 0.539 18518
505 1 1 . 1 1 90 90 SER N N 90 117.362 117.362 122.089 -4.727 18518
506 1 1 . 1 1 90 90 SER HA H 90 4.590 4.590 4.657 -0.067 18518
507 1 1 . 1 1 90 90 SER C C 90 175.741 175.741 176.079 -0.338 18518
508 1 1 . 1 1 90 90 SER CA C 90 57.717 57.717 57.282 0.435 18518
509 1 1 . 1 1 90 90 SER CB C 90 63.223 63.223 64.296 -1.073 18518
510 1 1 . 1 1 90 90 SER H H 90 8.482 8.482 8.418 0.064 18518
511 1 1 . 1 1 91 91 VAL N N 91 120.466 120.466 124.204 -3.738 18518
512 1 1 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.798 0.249 18518
513 1 1 . 1 1 91 91 VAL C C 91 176.329 176.329 176.208 0.121 18518
514 1 1 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.621 -1.129 18518
515 1 1 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.665 0.904 18518
516 1 1 . 1 1 91 91 VAL H H 91 8.188 8.188 8.826 -0.638 18518
517 1 1 . 1 1 92 92 SER N N 92 116.398 116.398 113.507 2.891 18518
518 1 1 . 1 1 92 92 SER HA H 92 4.636 4.636 4.612 0.024 18518
519 1 1 . 1 1 92 92 SER C C 92 174.159 174.159 174.082 0.077 18518
520 1 1 . 1 1 92 92 SER CA C 92 57.805 57.805 58.758 -0.953 18518
521 1 1 . 1 1 92 92 SER CB C 92 63.046 63.046 63.270 -0.224 18518
522 1 1 . 1 1 92 92 SER H H 92 8.370 8.370 8.213 0.157 18518
523 1 1 . 1 1 93 93 THR N N 93 119.211 119.211 120.471 -1.260 18518
524 1 1 . 1 1 93 93 THR HA H 93 4.484 4.484 4.700 -0.216 18518
525 1 1 . 1 1 93 93 THR CA C 93 60.884 60.884 60.742 0.142 18518
526 1 1 . 1 1 93 93 THR CB C 93 70.609 70.609 68.909 1.700 18518
527 1 1 . 1 1 93 93 THR H H 93 7.416 7.416 7.660 -0.244 18518
528 1 1 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.712 -0.272 18518
529 1 1 . 1 1 94 94 PRO C C 94 178.775 178.775 177.488 1.287 18518
530 1 1 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.398 0.545 18518
531 1 1 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.425 0.224 18518
532 1 1 . 1 1 95 95 ILE N N 95 124.174 124.174 124.182 -0.008 18518
533 1 1 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.872 0.077 18518
534 1 1 . 1 1 95 95 ILE C C 95 176.498 176.498 176.891 -0.393 18518
535 1 1 . 1 1 95 95 ILE CA C 95 63.904 63.904 61.916 1.988 18518
536 1 1 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.134 0.048 18518
537 1 1 . 1 1 95 95 ILE H H 95 9.305 9.305 8.534 0.771 18518
538 1 1 . 1 1 96 96 SER N N 96 116.920 116.920 116.244 0.676 18518
539 1 1 . 1 1 96 96 SER HA H 96 4.029 4.029 4.180 -0.151 18518
540 1 1 . 1 1 96 96 SER C C 96 176.574 176.574 176.653 -0.079 18518
541 1 1 . 1 1 96 96 SER CA C 96 61.356 61.356 62.112 -0.756 18518
542 1 1 . 1 1 96 96 SER CB C 96 61.723 61.723 62.380 -0.657 18518
543 1 1 . 1 1 96 96 SER H H 96 8.335 8.335 8.354 -0.019 18518
544 1 1 . 1 1 97 97 GLU N N 97 123.255 123.255 122.419 0.836 18518
545 1 1 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.193 0.085 18518
546 1 1 . 1 1 97 97 GLU C C 97 179.716 179.716 179.123 0.593 18518
547 1 1 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.868 -0.076 18518
548 1 1 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.163 0.399 18518
549 1 1 . 1 1 97 97 GLU H H 97 7.376 7.376 7.855 -0.479 18518
550 1 1 . 1 1 98 98 VAL N N 98 121.137 121.137 120.266 0.871 18518
551 1 1 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.697 0.105 18518
552 1 1 . 1 1 98 98 VAL C C 98 177.637 177.637 178.129 -0.492 18518
553 1 1 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.049 -0.225 18518
554 1 1 . 1 1 98 98 VAL CB C 98 32.154 32.154 30.848 1.306 18518
555 1 1 . 1 1 98 98 VAL H H 98 7.387 7.387 7.932 -0.545 18518
556 1 1 . 1 1 99 99 TYR N N 99 118.927 118.927 121.598 -2.671 18518
557 1 1 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.045 -0.055 18518
558 1 1 . 1 1 99 99 TYR C C 99 176.081 176.081 177.165 -1.084 18518
559 1 1 . 1 1 99 99 TYR CA C 99 62.223 62.223 61.529 0.694 18518
560 1 1 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.313 0.669 18518
561 1 1 . 1 1 99 99 TYR H H 99 9.048 9.048 8.445 0.603 18518
562 1 1 . 1 1 100 100 GLU N N 100 113.894 113.894 116.500 -2.606 18518
563 1 1 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.633 0.213 18518
564 1 1 . 1 1 100 100 GLU C C 100 177.989 177.989 178.137 -0.148 18518
565 1 1 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.106 0.981 18518
566 1 1 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.812 0.570 18518
567 1 1 . 1 1 100 100 GLU H H 100 7.422 7.422 7.944 -0.522 18518
568 1 1 . 1 1 101 101 SER N N 101 108.991 108.991 113.689 -4.698 18518
569 1 1 . 1 1 101 101 SER HA H 101 4.524 4.524 4.392 0.132 18518
570 1 1 . 1 1 101 101 SER C C 101 176.628 176.628 175.108 1.520 18518
571 1 1 . 1 1 101 101 SER CA C 101 60.349 60.349 60.237 0.112 18518
572 1 1 . 1 1 101 101 SER CB C 101 64.741 64.741 63.908 0.833 18518
573 1 1 . 1 1 101 101 SER H H 101 7.424 7.424 7.830 -0.406 18518
574 1 1 . 1 1 102 102 GLU N N 102 116.533 116.533 119.249 -2.716 18518
575 1 1 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.590 0.154 18518
576 1 1 . 1 1 102 102 GLU C C 102 176.774 176.774 175.434 1.340 18518
577 1 1 . 1 1 102 102 GLU CA C 102 55.581 55.581 55.666 -0.085 18518
578 1 1 . 1 1 102 102 GLU CB C 102 30.697 30.697 31.037 -0.340 18518
579 1 1 . 1 1 102 102 GLU H H 102 8.487 8.487 7.694 0.793 18518
580 1 1 . 1 1 103 103 LYS N N 103 118.370 118.370 119.893 -1.523 18518
581 1 1 . 1 1 103 103 LYS HA H 103 4.178 4.178 4.079 0.099 18518
582 1 1 . 1 1 103 103 LYS C C 103 175.018 175.018 176.678 -1.660 18518
583 1 1 . 1 1 103 103 LYS CA C 103 57.329 57.329 57.076 0.253 18518
584 1 1 . 1 1 103 103 LYS CB C 103 32.186 32.186 31.782 0.404 18518
585 1 1 . 1 1 103 103 LYS H H 103 7.831 7.831 7.625 0.206 18518
586 1 1 . 1 1 104 104 ASP N N 104 123.500 123.500 125.091 -1.591 18518
587 1 1 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.709 0.046 18518
588 1 1 . 1 1 104 104 ASP C C 104 177.383 177.383 177.616 -0.233 18518
589 1 1 . 1 1 104 104 ASP CA C 104 53.846 53.846 54.048 -0.202 18518
590 1 1 . 1 1 104 104 ASP CB C 104 43.411 43.411 42.614 0.797 18518
591 1 1 . 1 1 104 104 ASP H H 104 9.041 9.041 8.237 0.804 18518
592 1 1 . 1 1 105 105 GLU N N 105 125.448 125.448 119.790 5.658 18518
593 1 1 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.122 0.058 18518
594 1 1 . 1 1 105 105 GLU C C 105 177.519 177.519 176.521 0.998 18518
595 1 1 . 1 1 105 105 GLU CA C 105 59.529 59.529 59.073 0.456 18518
596 1 1 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.569 0.475 18518
597 1 1 . 1 1 105 105 GLU H H 105 8.906 8.906 8.851 0.055 18518
598 1 1 . 1 1 106 106 ASP N N 106 118.824 118.824 116.569 2.255 18518
599 1 1 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.611 -0.432 18518
600 1 1 . 1 1 106 106 ASP C C 106 176.223 176.223 176.969 -0.746 18518
601 1 1 . 1 1 106 106 ASP CA C 106 54.756 54.756 53.538 1.218 18518
602 1 1 . 1 1 106 106 ASP CB C 106 39.999 39.999 39.938 0.061 18518
603 1 1 . 1 1 106 106 ASP H H 106 10.036 10.036 8.132 1.904 18518
604 1 1 . 1 1 107 107 GLY N N 107 105.866 105.866 107.796 -1.930 18518
605 1 1 . 1 1 107 107 GLY C C 107 175.136 175.136 173.693 1.443 18518
606 1 1 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.415 -0.193 18518
607 1 1 . 1 1 107 107 GLY H H 107 8.001 8.001 7.873 0.128 18518
608 1 1 . 1 1 108 108 PHE N N 108 123.820 123.820 120.839 2.981 18518
609 1 1 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.804 -0.142 18518
610 1 1 . 1 1 108 108 PHE C C 108 174.899 174.899 174.101 0.798 18518
611 1 1 . 1 1 108 108 PHE CA C 108 60.238 60.238 58.017 2.221 18518
612 1 1 . 1 1 108 108 PHE CB C 108 40.365 40.365 41.390 -1.025 18518
613 1 1 . 1 1 108 108 PHE H H 108 9.912 9.912 8.063 1.849 18518
614 1 1 . 1 1 109 109 LEU N N 109 120.130 120.130 122.707 -2.577 18518
615 1 1 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.877 0.153 18518
616 1 1 . 1 1 109 109 LEU C C 109 173.916 173.916 174.879 -0.963 18518
617 1 1 . 1 1 109 109 LEU CA C 109 53.424 53.424 54.017 -0.593 18518
618 1 1 . 1 1 109 109 LEU CB C 109 45.203 45.203 44.718 0.485 18518
619 1 1 . 1 1 109 109 LEU H H 109 7.997 7.997 8.760 -0.763 18518
620 1 1 . 1 1 110 110 TYR N N 110 126.579 126.579 124.602 1.977 18518
621 1 1 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.753 0.250 18518
622 1 1 . 1 1 110 110 TYR C C 110 176.671 176.671 175.039 1.632 18518
623 1 1 . 1 1 110 110 TYR CA C 110 59.058 59.058 57.888 1.171 18518
624 1 1 . 1 1 110 110 TYR CB C 110 39.556 39.556 41.752 -2.196 18518
625 1 1 . 1 1 110 110 TYR H H 110 9.377 9.377 8.848 0.529 18518
626 1 1 . 1 1 111 111 MET N N 111 119.240 119.240 119.645 -0.405 18518
627 1 1 . 1 1 111 111 MET HA H 111 5.486 5.486 5.273 0.213 18518
628 1 1 . 1 1 111 111 MET C C 111 175.695 175.695 174.348 1.347 18518
629 1 1 . 1 1 111 111 MET CA C 111 54.124 54.124 54.862 -0.738 18518
630 1 1 . 1 1 111 111 MET CB C 111 36.960 36.960 37.488 -0.528 18518
631 1 1 . 1 1 111 111 MET H H 111 9.658 9.658 8.806 0.852 18518
632 1 1 . 1 1 112 112 VAL N N 112 119.865 119.865 117.971 1.894 18518
633 1 1 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.595 0.368 18518
634 1 1 . 1 1 112 112 VAL C C 112 175.058 175.058 174.441 0.617 18518
635 1 1 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.374 -0.463 18518
636 1 1 . 1 1 112 112 VAL CB C 112 36.051 36.051 34.815 1.236 18518
637 1 1 . 1 1 112 112 VAL H H 112 8.794 8.794 9.202 -0.408 18518
638 1 1 . 1 1 113 113 TYR N N 113 119.664 119.664 120.768 -1.104 18518
639 1 1 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.628 0.490 18518
640 1 1 . 1 1 113 113 TYR C C 113 173.375 173.375 173.421 -0.046 18518
641 1 1 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.007 -0.854 18518
642 1 1 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.916 1.396 18518
643 1 1 . 1 1 113 113 TYR H H 113 8.315 8.315 8.428 -0.113 18518
644 1 1 . 1 1 114 114 ALA N N 114 119.763 119.763 121.412 -1.649 18518
645 1 1 . 1 1 114 114 ALA HA H 114 4.800 4.800 5.030 -0.230 18518
646 1 1 . 1 1 114 114 ALA C C 114 176.216 176.216 175.191 1.025 18518
647 1 1 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.995 -0.863 18518
648 1 1 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.401 2.195 18518
649 1 1 . 1 1 114 114 ALA H H 114 8.465 8.465 8.807 -0.342 18518
650 1 1 . 1 1 115 115 SER N N 115 114.763 114.763 115.817 -1.054 18518
651 1 1 . 1 1 115 115 SER HA H 115 4.496 4.496 4.864 -0.368 18518
652 1 1 . 1 1 115 115 SER C C 115 172.671 172.671 173.528 -0.857 18518
653 1 1 . 1 1 115 115 SER CA C 115 58.651 58.651 57.369 1.282 18518
654 1 1 . 1 1 115 115 SER CB C 115 63.526 63.526 61.814 1.712 18518
655 1 1 . 1 1 115 115 SER H H 115 9.915 9.915 8.790 1.125 18518
656 1 1 . 1 1 116 116 GLN N N 116 116.611 116.611 122.606 -5.995 18518
657 1 1 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.680 -0.196 18518
658 1 1 . 1 1 116 116 GLN C C 116 172.733 172.733 173.652 -0.919 18518
659 1 1 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.552 -1.626 18518
660 1 1 . 1 1 116 116 GLN CB C 116 32.358 32.358 29.976 2.382 18518
661 1 1 . 1 1 116 116 GLN H H 116 7.219 7.219 7.937 -0.718 18518
662 1 1 . 1 1 117 117 GLU N N 117 117.623 117.623 120.473 -2.850 18518
663 1 1 . 1 1 117 117 GLU HA H 117 3.287 3.287 3.950 -0.663 18518
664 1 1 . 1 1 117 117 GLU C C 117 175.168 175.168 175.687 -0.519 18518
665 1 1 . 1 1 117 117 GLU CA C 117 56.882 56.882 56.743 0.139 18518
666 1 1 . 1 1 117 117 GLU CB C 117 30.522 30.522 30.103 0.419 18518
667 1 1 . 1 1 117 117 GLU H H 117 7.882 7.882 8.838 -0.956 18518
668 1 1 . 1 1 118 118 THR N N 118 109.820 109.820 112.292 -2.472 18518
669 1 1 . 1 1 118 118 THR HA H 118 4.066 4.066 4.479 -0.413 18518
670 1 1 . 1 1 118 118 THR C C 118 172.355 172.355 173.968 -1.613 18518
671 1 1 . 1 1 118 118 THR CA C 118 60.029 60.029 61.349 -1.320 18518
672 1 1 . 1 1 118 118 THR CB C 118 70.480 70.480 70.082 0.399 18518
673 1 1 . 1 1 118 118 THR H H 118 6.992 6.992 7.574 -0.582 18518
674 1 2 . 1 1 2 2 ALA HA H 2 4.336 4.336 4.376 -0.040 18518
675 1 2 . 1 1 2 2 ALA C C 2 177.974 177.974 177.026 0.948 18518
676 1 2 . 1 1 2 2 ALA CA C 2 52.785 52.785 52.524 0.261 18518
677 1 2 . 1 1 2 2 ALA CB C 2 19.444 19.444 18.997 0.447 18518
678 1 2 . 1 1 3 3 MET N N 3 119.311 119.311 125.035 -5.724 18518
679 1 2 . 1 1 3 3 MET HA H 3 4.451 4.451 4.608 -0.157 18518
680 1 2 . 1 1 3 3 MET C C 3 176.913 176.913 175.324 1.589 18518
681 1 2 . 1 1 3 3 MET CA C 3 55.679 55.679 54.906 0.773 18518
682 1 2 . 1 1 3 3 MET CB C 3 32.590 32.590 34.432 -1.842 18518
683 1 2 . 1 1 3 3 MET H H 3 8.638 8.638 8.221 0.417 18518
684 1 2 . 1 1 4 4 GLY N N 4 110.281 110.281 111.460 -1.179 18518
685 1 2 . 1 1 4 4 GLY C C 4 174.180 174.180 174.104 0.076 18518
686 1 2 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.927 0.568 18518
687 1 2 . 1 1 4 4 GLY H H 4 8.552 8.552 8.397 0.155 18518
688 1 2 . 1 1 5 5 LYS N N 5 120.818 120.818 126.195 -5.377 18518
689 1 2 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.459 0.050 18518
690 1 2 . 1 1 5 5 LYS C C 5 177.605 177.605 176.986 0.619 18518
691 1 2 . 1 1 5 5 LYS CA C 5 56.134 56.134 56.096 0.038 18518
692 1 2 . 1 1 5 5 LYS CB C 5 34.813 34.813 33.163 1.650 18518
693 1 2 . 1 1 5 5 LYS H H 5 8.133 8.133 8.189 -0.056 18518
694 1 2 . 1 1 6 6 THR N N 6 114.781 114.781 113.400 1.381 18518
695 1 2 . 1 1 6 6 THR HA H 6 4.421 4.421 4.263 0.158 18518
696 1 2 . 1 1 6 6 THR C C 6 175.524 175.524 175.809 -0.285 18518
697 1 2 . 1 1 6 6 THR CA C 6 61.127 61.127 60.926 0.201 18518
698 1 2 . 1 1 6 6 THR CB C 6 69.926 69.926 69.782 0.144 18518
699 1 2 . 1 1 6 6 THR H H 6 8.483 8.483 7.915 0.568 18518
700 1 2 . 1 1 7 7 PHE N N 7 125.552 125.552 120.424 5.128 18518
701 1 2 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.097 -0.092 18518
702 1 2 . 1 1 7 7 PHE C C 7 177.397 177.397 177.356 0.041 18518
703 1 2 . 1 1 7 7 PHE CA C 7 63.393 63.393 61.711 1.682 18518
704 1 2 . 1 1 7 7 PHE CB C 7 39.567 39.567 37.879 1.688 18518
705 1 2 . 1 1 7 7 PHE H H 7 10.245 10.245 8.799 1.446 18518
706 1 2 . 1 1 8 8 LYS N N 8 114.053 114.053 119.270 -5.217 18518
707 1 2 . 1 1 8 8 LYS HA H 8 3.835 3.835 4.178 -0.343 18518
708 1 2 . 1 1 8 8 LYS C C 8 175.520 175.520 178.266 -2.746 18518
709 1 2 . 1 1 8 8 LYS CA C 8 59.993 59.993 59.040 0.953 18518
710 1 2 . 1 1 8 8 LYS CB C 8 33.689 33.689 32.084 1.605 18518
711 1 2 . 1 1 8 8 LYS H H 8 8.775 8.775 7.424 1.351 18518
712 1 2 . 1 1 9 9 GLN N N 9 113.516 113.516 116.776 -3.260 18518
713 1 2 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.057 0.092 18518
714 1 2 . 1 1 9 9 GLN C C 9 177.615 177.615 177.994 -0.379 18518
715 1 2 . 1 1 9 9 GLN CA C 9 56.819 56.819 58.330 -1.511 18518
716 1 2 . 1 1 9 9 GLN CB C 9 30.019 30.019 29.008 1.012 18518
717 1 2 . 1 1 9 9 GLN H H 9 7.355 7.355 7.388 -0.033 18518
718 1 2 . 1 1 10 10 ARG N N 10 118.294 118.294 116.384 1.910 18518
719 1 2 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.216 0.086 18518
720 1 2 . 1 1 10 10 ARG C C 10 179.380 179.380 177.400 1.980 18518
721 1 2 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.351 -0.083 18518
722 1 2 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.977 0.665 18518
723 1 2 . 1 1 10 10 ARG H H 10 7.936 7.936 7.903 0.033 18518
724 1 2 . 1 1 11 11 ARG N N 11 121.137 121.137 119.738 1.399 18518
725 1 2 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.930 -0.250 18518
726 1 2 . 1 1 11 11 ARG CA C 11 53.453 53.453 55.049 -1.596 18518
727 1 2 . 1 1 11 11 ARG CB C 11 32.938 32.938 32.579 0.359 18518
728 1 2 . 1 1 11 11 ARG H H 11 7.390 7.390 7.783 -0.393 18518
729 1 2 . 1 1 12 12 THR N N 12 116.819 116.819 119.787 -2.968 18518
730 1 2 . 1 1 12 12 THR HA H 12 4.359 4.359 4.354 0.005 18518
731 1 2 . 1 1 12 12 THR C C 12 174.989 174.989 175.985 -0.996 18518
732 1 2 . 1 1 12 12 THR CA C 12 61.748 61.748 63.227 -1.480 18518
733 1 2 . 1 1 12 12 THR CB C 12 71.068 71.068 70.355 0.713 18518
734 1 2 . 1 1 12 12 THR H H 12 8.953 8.953 8.290 0.663 18518
735 1 2 . 1 1 13 13 PHE N N 13 123.200 123.200 123.628 -0.428 18518
736 1 2 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.249 -0.221 18518
737 1 2 . 1 1 13 13 PHE C C 13 176.029 176.029 177.113 -1.084 18518
738 1 2 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.414 0.450 18518
739 1 2 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.329 0.231 18518
740 1 2 . 1 1 13 13 PHE H H 13 9.284 9.284 8.948 0.336 18518
741 1 2 . 1 1 14 14 GLU N N 14 115.414 115.414 117.540 -2.126 18518
742 1 2 . 1 1 14 14 GLU HA H 14 3.794 3.794 3.893 -0.099 18518
743 1 2 . 1 1 14 14 GLU C C 14 180.081 180.081 179.162 0.919 18518
744 1 2 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.780 0.839 18518
745 1 2 . 1 1 14 14 GLU CB C 14 28.852 28.852 29.127 -0.275 18518
746 1 2 . 1 1 14 14 GLU H H 14 8.973 8.973 8.956 0.017 18518
747 1 2 . 1 1 15 15 GLN N N 15 119.276 119.276 117.916 1.360 18518
748 1 2 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.098 -0.098 18518
749 1 2 . 1 1 15 15 GLN C C 15 177.978 177.978 178.581 -0.603 18518
750 1 2 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.476 0.359 18518
751 1 2 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.552 0.818 18518
752 1 2 . 1 1 15 15 GLN H H 15 7.756 7.756 7.887 -0.131 18518
753 1 2 . 1 1 16 16 ARG N N 16 121.336 121.336 121.380 -0.044 18518
754 1 2 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.159 0.111 18518
755 1 2 . 1 1 16 16 ARG C C 16 177.416 177.416 178.718 -1.302 18518
756 1 2 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.837 1.538 18518
757 1 2 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.163 0.442 18518
758 1 2 . 1 1 16 16 ARG H H 16 8.645 8.645 8.180 0.465 18518
759 1 2 . 1 1 17 17 VAL N N 17 117.630 117.630 116.704 0.926 18518
760 1 2 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.795 0.062 18518
761 1 2 . 1 1 17 17 VAL C C 17 179.748 179.748 177.601 2.147 18518
762 1 2 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.520 0.206 18518
763 1 2 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.278 0.916 18518
764 1 2 . 1 1 17 17 VAL H H 17 8.373 8.373 8.125 0.248 18518
765 1 2 . 1 1 18 18 GLU N N 18 120.864 120.864 120.481 0.383 18518
766 1 2 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.924 0.378 18518
767 1 2 . 1 1 18 18 GLU C C 18 177.728 177.728 178.299 -0.571 18518
768 1 2 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.782 -1.296 18518
769 1 2 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.380 0.002 18518
770 1 2 . 1 1 18 18 GLU H H 18 7.368 7.368 7.887 -0.519 18518
771 1 2 . 1 1 19 19 ASP N N 19 121.425 121.425 120.124 1.301 18518
772 1 2 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.430 0.004 18518
773 1 2 . 1 1 19 19 ASP C C 19 179.978 179.978 178.617 1.361 18518
774 1 2 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.441 -0.019 18518
775 1 2 . 1 1 19 19 ASP CB C 19 41.287 41.287 41.173 0.114 18518
776 1 2 . 1 1 19 19 ASP H H 19 8.671 8.671 8.092 0.579 18518
777 1 2 . 1 1 20 20 VAL N N 20 119.730 119.730 120.159 -0.429 18518
778 1 2 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.315 -0.110 18518
779 1 2 . 1 1 20 20 VAL C C 20 176.284 176.284 177.674 -1.390 18518
780 1 2 . 1 1 20 20 VAL CA C 20 66.315 66.315 67.001 -0.686 18518
781 1 2 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.718 -0.611 18518
782 1 2 . 1 1 20 20 VAL H H 20 7.999 7.999 7.852 0.147 18518
783 1 2 . 1 1 21 21 ARG N N 21 121.455 121.455 119.565 1.890 18518
784 1 2 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.949 -0.135 18518
785 1 2 . 1 1 21 21 ARG C C 21 180.120 180.120 178.575 1.545 18518
786 1 2 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.858 0.972 18518
787 1 2 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.047 0.898 18518
788 1 2 . 1 1 21 21 ARG H H 21 8.098 8.098 8.214 -0.116 18518
789 1 2 . 1 1 22 22 LEU N N 22 117.826 117.826 120.911 -3.085 18518
790 1 2 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.069 -0.020 18518
791 1 2 . 1 1 22 22 LEU C C 22 180.115 180.115 178.540 1.575 18518
792 1 2 . 1 1 22 22 LEU CA C 22 57.790 57.790 57.906 -0.116 18518
793 1 2 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.403 0.739 18518
794 1 2 . 1 1 22 22 LEU H H 22 8.207 8.207 7.909 0.298 18518
795 1 2 . 1 1 23 23 ILE N N 23 121.450 121.450 119.436 2.014 18518
796 1 2 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.747 0.266 18518
797 1 2 . 1 1 23 23 ILE C C 23 178.149 178.149 177.696 0.453 18518
798 1 2 . 1 1 23 23 ILE CA C 23 62.171 62.171 63.346 -1.175 18518
799 1 2 . 1 1 23 23 ILE CB C 23 38.106 38.106 37.909 0.197 18518
800 1 2 . 1 1 23 23 ILE H H 23 8.105 8.105 7.945 0.160 18518
801 1 2 . 1 1 24 24 ARG N N 24 121.139 121.139 119.155 1.984 18518
802 1 2 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.185 -0.198 18518
803 1 2 . 1 1 24 24 ARG C C 24 178.702 178.702 178.811 -0.109 18518
804 1 2 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.991 -1.273 18518
805 1 2 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.641 -0.872 18518
806 1 2 . 1 1 24 24 ARG H H 24 8.601 8.601 8.486 0.115 18518
807 1 2 . 1 1 25 25 GLU N N 25 118.054 118.054 120.164 -2.110 18518
808 1 2 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.112 -0.086 18518
809 1 2 . 1 1 25 25 GLU C C 25 178.492 178.492 178.806 -0.314 18518
810 1 2 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.824 -0.044 18518
811 1 2 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.716 0.285 18518
812 1 2 . 1 1 25 25 GLU H H 25 7.423 7.423 7.761 -0.338 18518
813 1 2 . 1 1 26 26 GLN N N 26 116.350 116.350 116.256 0.094 18518
814 1 2 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.063 -0.127 18518
815 1 2 . 1 1 26 26 GLN C C 26 176.305 176.305 177.106 -0.801 18518
816 1 2 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.481 0.022 18518
817 1 2 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.765 0.442 18518
818 1 2 . 1 1 26 26 GLN H H 26 7.524 7.524 7.695 -0.171 18518
819 1 2 . 1 1 27 27 HIS N N 27 116.017 116.017 118.938 -2.921 18518
820 1 2 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.045 -0.115 18518
821 1 2 . 1 1 27 27 HIS CA C 27 53.054 53.054 53.392 -0.338 18518
822 1 2 . 1 1 27 27 HIS CB C 27 30.747 30.747 30.261 0.486 18518
823 1 2 . 1 1 27 27 HIS H H 27 8.284 8.284 8.172 0.112 18518
824 1 2 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.576 0.005 18518
825 1 2 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.576 0.343 18518
826 1 2 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.319 0.136 18518
827 1 2 . 1 1 29 29 THR N N 29 107.011 107.011 106.651 0.360 18518
828 1 2 . 1 1 29 29 THR HA H 29 4.599 4.599 4.333 0.266 18518
829 1 2 . 1 1 29 29 THR C C 29 172.884 172.884 173.892 -1.008 18518
830 1 2 . 1 1 29 29 THR CA C 29 60.810 60.810 61.512 -0.702 18518
831 1 2 . 1 1 29 29 THR CB C 29 68.531 68.531 68.449 0.082 18518
832 1 2 . 1 1 29 29 THR H H 29 7.890 7.890 8.277 -0.387 18518
833 1 2 . 1 1 30 30 LYS N N 30 117.679 117.679 122.195 -4.516 18518
834 1 2 . 1 1 30 30 LYS HA H 30 4.858 4.858 5.022 -0.164 18518
835 1 2 . 1 1 30 30 LYS C C 30 174.310 174.310 174.972 -0.662 18518
836 1 2 . 1 1 30 30 LYS CA C 30 53.751 53.751 54.081 -0.330 18518
837 1 2 . 1 1 30 30 LYS CB C 30 35.804 35.804 34.950 0.854 18518
838 1 2 . 1 1 30 30 LYS H H 30 7.441 7.441 7.694 -0.253 18518
839 1 2 . 1 1 31 31 ILE N N 31 122.849 122.849 123.688 -0.839 18518
840 1 2 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.416 -0.311 18518
841 1 2 . 1 1 31 31 ILE CA C 31 54.801 54.801 55.989 -1.188 18518
842 1 2 . 1 1 31 31 ILE CB C 31 38.265 38.265 37.883 0.382 18518
843 1 2 . 1 1 31 31 ILE H H 31 9.304 9.304 8.988 0.316 18518
844 1 2 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.842 0.317 18518
845 1 2 . 1 1 32 32 PRO C C 32 174.164 174.164 176.352 -2.188 18518
846 1 2 . 1 1 32 32 PRO CA C 32 61.503 61.503 61.970 -0.467 18518
847 1 2 . 1 1 32 32 PRO CB C 32 31.145 31.145 30.138 1.007 18518
848 1 2 . 1 1 33 33 VAL N N 33 125.606 125.606 119.655 5.951 18518
849 1 2 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.193 0.020 18518
850 1 2 . 1 1 33 33 VAL C C 33 173.654 173.654 174.189 -0.535 18518
851 1 2 . 1 1 33 33 VAL CA C 33 60.044 60.044 58.688 1.356 18518
852 1 2 . 1 1 33 33 VAL CB C 33 35.604 35.604 35.681 -0.077 18518
853 1 2 . 1 1 33 33 VAL H H 33 9.424 9.424 8.679 0.745 18518
854 1 2 . 1 1 34 34 ILE N N 34 128.241 128.241 123.177 5.064 18518
855 1 2 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.851 -0.018 18518
856 1 2 . 1 1 34 34 ILE C C 34 175.605 175.605 175.024 0.581 18518
857 1 2 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.125 -1.360 18518
858 1 2 . 1 1 34 34 ILE CB C 34 36.799 36.799 38.321 -1.522 18518
859 1 2 . 1 1 34 34 ILE H H 34 8.721 8.721 8.924 -0.203 18518
860 1 2 . 1 1 35 35 ILE N N 35 125.650 125.650 127.861 -2.211 18518
861 1 2 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.646 0.190 18518
862 1 2 . 1 1 35 35 ILE C C 35 174.887 174.887 174.563 0.324 18518
863 1 2 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.299 0.646 18518
864 1 2 . 1 1 35 35 ILE CB C 35 39.210 39.210 38.812 0.398 18518
865 1 2 . 1 1 35 35 ILE H H 35 9.034 9.034 9.022 0.012 18518
866 1 2 . 1 1 36 36 GLU N N 36 122.657 122.657 126.175 -3.518 18518
867 1 2 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.806 0.056 18518
868 1 2 . 1 1 36 36 GLU C C 36 173.848 173.848 174.541 -0.693 18518
869 1 2 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.002 -0.070 18518
870 1 2 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.298 0.984 18518
871 1 2 . 1 1 36 36 GLU H H 36 8.303 8.303 8.313 -0.010 18518
872 1 2 . 1 1 37 37 ARG N N 37 123.228 123.228 123.527 -0.299 18518
873 1 2 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.465 -0.739 18518
874 1 2 . 1 1 37 37 ARG C C 37 176.359 176.359 175.807 0.552 18518
875 1 2 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.167 0.192 18518
876 1 2 . 1 1 37 37 ARG CB C 37 31.341 31.341 31.084 0.257 18518
877 1 2 . 1 1 37 37 ARG H H 37 8.856 8.856 8.623 0.233 18518
878 1 2 . 1 1 38 38 TYR N N 38 128.981 128.981 125.718 3.263 18518
879 1 2 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.453 -0.101 18518
880 1 2 . 1 1 38 38 TYR C C 38 177.316 177.316 177.010 0.306 18518
881 1 2 . 1 1 38 38 TYR CA C 38 57.712 57.712 57.944 -0.232 18518
882 1 2 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.584 -1.112 18518
883 1 2 . 1 1 38 38 TYR H H 38 8.628 8.628 8.195 0.433 18518
884 1 2 . 1 1 39 39 LYS N N 39 130.635 130.635 126.205 4.430 18518
885 1 2 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.813 0.009 18518
886 1 2 . 1 1 39 39 LYS CA C 39 58.887 58.887 57.886 1.001 18518
887 1 2 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.627 0.145 18518
888 1 2 . 1 1 39 39 LYS H H 39 8.594 8.594 7.751 0.843 18518
889 1 2 . 1 1 40 40 GLY C C 40 173.447 173.447 173.764 -0.317 18518
890 1 2 . 1 1 40 40 GLY CA C 40 44.663 44.663 44.080 0.583 18518
891 1 2 . 1 1 40 40 GLY H H 40 5.188 5.188 6.696 -1.508 18518
892 1 2 . 1 1 41 41 GLU N N 41 122.836 122.836 121.415 1.421 18518
893 1 2 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.305 -0.048 18518
894 1 2 . 1 1 41 41 GLU C C 41 176.524 176.524 176.096 0.428 18518
895 1 2 . 1 1 41 41 GLU CA C 41 56.525 56.525 55.810 0.715 18518
896 1 2 . 1 1 41 41 GLU CB C 41 30.985 30.985 29.127 1.859 18518
897 1 2 . 1 1 41 41 GLU H H 41 7.380 7.380 7.474 -0.094 18518
898 1 2 . 1 1 42 42 LYS N N 42 124.040 124.040 127.429 -3.389 18518
899 1 2 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.533 0.142 18518
900 1 2 . 1 1 42 42 LYS C C 42 177.538 177.538 176.802 0.736 18518
901 1 2 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.528 -0.688 18518
902 1 2 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.376 1.603 18518
903 1 2 . 1 1 42 42 LYS H H 42 9.034 9.034 8.718 0.316 18518
904 1 2 . 1 1 43 43 GLN N N 43 119.259 119.259 117.890 1.369 18518
905 1 2 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.414 0.128 18518
906 1 2 . 1 1 43 43 GLN C C 43 177.336 177.336 176.357 0.979 18518
907 1 2 . 1 1 43 43 GLN CA C 43 57.673 57.673 56.448 1.225 18518
908 1 2 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.293 0.489 18518
909 1 2 . 1 1 43 43 GLN H H 43 8.435 8.435 9.104 -0.669 18518
910 1 2 . 1 1 44 44 LEU N N 44 120.760 120.760 124.398 -3.638 18518
911 1 2 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.683 0.012 18518
912 1 2 . 1 1 44 44 LEU CA C 44 53.245 53.245 53.122 0.123 18518
913 1 2 . 1 1 44 44 LEU CB C 44 43.596 43.596 41.320 2.276 18518
914 1 2 . 1 1 44 44 LEU H H 44 9.126 9.126 8.561 0.565 18518
915 1 2 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.561 0.156 18518
916 1 2 . 1 1 45 45 PRO C C 45 175.797 175.797 176.409 -0.612 18518
917 1 2 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.235 -0.124 18518
918 1 2 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.493 0.099 18518
919 1 2 . 1 1 46 46 VAL N N 46 119.052 119.052 119.870 -0.818 18518
920 1 2 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.534 -0.667 18518
921 1 2 . 1 1 46 46 VAL C C 46 175.640 175.640 176.362 -0.722 18518
922 1 2 . 1 1 46 46 VAL CA C 46 62.944 62.944 61.147 1.797 18518
923 1 2 . 1 1 46 46 VAL CB C 46 32.799 32.799 33.416 -0.617 18518
924 1 2 . 1 1 46 46 VAL H H 46 8.543 8.543 8.242 0.301 18518
925 1 2 . 1 1 47 47 LEU N N 47 130.203 130.203 123.953 6.250 18518
926 1 2 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.510 -0.201 18518
927 1 2 . 1 1 47 47 LEU C C 47 176.198 176.198 177.520 -1.322 18518
928 1 2 . 1 1 47 47 LEU CA C 47 55.006 55.006 54.372 0.634 18518
929 1 2 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.886 0.946 18518
930 1 2 . 1 1 47 47 LEU H H 47 7.799 7.799 8.634 -0.835 18518
931 1 2 . 1 1 48 48 ASP N N 48 122.403 122.403 122.899 -0.496 18518
932 1 2 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.459 -0.196 18518
933 1 2 . 1 1 48 48 ASP C C 48 175.294 175.294 176.112 -0.818 18518
934 1 2 . 1 1 48 48 ASP CA C 48 55.832 55.832 56.435 -0.603 18518
935 1 2 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.063 -0.879 18518
936 1 2 . 1 1 48 48 ASP H H 48 8.780 8.780 8.633 0.147 18518
937 1 2 . 1 1 49 49 LYS N N 49 119.569 119.569 116.974 2.595 18518
938 1 2 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.527 0.058 18518
939 1 2 . 1 1 49 49 LYS C C 49 174.678 174.678 175.497 -0.819 18518
940 1 2 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.249 -1.597 18518
941 1 2 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.612 1.333 18518
942 1 2 . 1 1 49 49 LYS H H 49 7.280 7.280 7.457 -0.177 18518
943 1 2 . 1 1 50 50 THR N N 50 110.862 110.862 113.838 -2.976 18518
944 1 2 . 1 1 50 50 THR HA H 50 4.811 4.811 4.810 0.001 18518
945 1 2 . 1 1 50 50 THR C C 50 172.425 172.425 174.316 -1.891 18518
946 1 2 . 1 1 50 50 THR CA C 50 62.645 62.645 62.492 0.153 18518
947 1 2 . 1 1 50 50 THR CB C 50 71.648 71.648 70.317 1.331 18518
948 1 2 . 1 1 50 50 THR H H 50 8.042 8.042 8.349 -0.307 18518
949 1 2 . 1 1 51 51 LYS N N 51 120.008 120.008 122.335 -2.327 18518
950 1 2 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.598 0.027 18518
951 1 2 . 1 1 51 51 LYS C C 51 175.082 175.082 175.943 -0.861 18518
952 1 2 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.851 -2.147 18518
953 1 2 . 1 1 51 51 LYS CB C 51 32.376 32.376 32.991 -0.615 18518
954 1 2 . 1 1 51 51 LYS H H 51 7.119 7.119 7.668 -0.549 18518
955 1 2 . 1 1 52 52 PHE N N 52 122.640 122.640 123.996 -1.356 18518
956 1 2 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.764 0.573 18518
957 1 2 . 1 1 52 52 PHE C C 52 174.213 174.213 174.028 0.185 18518
958 1 2 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.846 -0.235 18518
959 1 2 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.338 -0.198 18518
960 1 2 . 1 1 52 52 PHE H H 52 9.709 9.709 9.292 0.417 18518
961 1 2 . 1 1 53 53 LEU N N 53 122.157 122.157 123.470 -1.313 18518
962 1 2 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.932 0.015 18518
963 1 2 . 1 1 53 53 LEU C C 53 175.769 175.769 175.651 0.118 18518
964 1 2 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.871 -0.914 18518
965 1 2 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.946 0.470 18518
966 1 2 . 1 1 53 53 LEU H H 53 8.959 8.959 8.407 0.552 18518
967 1 2 . 1 1 54 54 VAL N N 54 124.919 124.919 121.069 3.850 18518
968 1 2 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.718 -0.159 18518
969 1 2 . 1 1 54 54 VAL CA C 54 59.130 59.130 57.657 1.474 18518
970 1 2 . 1 1 54 54 VAL CB C 54 34.968 34.968 32.801 2.167 18518
971 1 2 . 1 1 54 54 VAL H H 54 8.922 8.922 8.508 0.414 18518
972 1 2 . 1 1 55 55 PRO HA H 55 4.441 4.441 5.056 -0.615 18518
973 1 2 . 1 1 55 55 PRO C C 55 176.594 176.594 178.397 -1.803 18518
974 1 2 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.062 2.253 18518
975 1 2 . 1 1 55 55 PRO CB C 55 32.665 32.665 33.317 -0.652 18518
976 1 2 . 1 1 56 56 ASP N N 56 120.522 120.522 121.811 -1.289 18518
977 1 2 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.245 -0.383 18518
978 1 2 . 1 1 56 56 ASP C C 56 175.809 175.809 176.663 -0.854 18518
979 1 2 . 1 1 56 56 ASP CA C 56 56.749 56.749 57.066 -0.317 18518
980 1 2 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.557 -0.047 18518
981 1 2 . 1 1 56 56 ASP H H 56 8.347 8.347 8.702 -0.355 18518
982 1 2 . 1 1 57 57 HIS N N 57 113.482 113.482 116.502 -3.020 18518
983 1 2 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.526 0.194 18518
984 1 2 . 1 1 57 57 HIS C C 57 176.507 176.507 175.203 1.304 18518
985 1 2 . 1 1 57 57 HIS CA C 57 55.589 55.589 56.520 -0.931 18518
986 1 2 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.640 1.003 18518
987 1 2 . 1 1 57 57 HIS H H 57 7.557 7.557 8.190 -0.633 18518
988 1 2 . 1 1 58 58 VAL N N 58 123.279 123.279 121.095 2.184 18518
989 1 2 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.193 -0.357 18518
990 1 2 . 1 1 58 58 VAL C C 58 175.019 175.019 174.801 0.218 18518
991 1 2 . 1 1 58 58 VAL CA C 58 62.823 62.823 61.505 1.318 18518
992 1 2 . 1 1 58 58 VAL CB C 58 32.310 32.310 33.206 -0.896 18518
993 1 2 . 1 1 58 58 VAL H H 58 7.345 7.345 7.339 0.006 18518
994 1 2 . 1 1 59 59 ASN N N 59 123.781 123.781 122.435 1.346 18518
995 1 2 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.255 -0.129 18518
996 1 2 . 1 1 59 59 ASN C C 59 176.558 176.558 176.389 0.169 18518
997 1 2 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.551 -0.066 18518
998 1 2 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.724 -0.617 18518
999 1 2 . 1 1 59 59 ASN H H 59 8.735 8.735 8.299 0.436 18518
1000 1 2 . 1 1 60 60 MET N N 60 117.453 117.453 119.088 -1.635 18518
1001 1 2 . 1 1 60 60 MET HA H 60 4.395 4.395 3.990 0.405 18518
1002 1 2 . 1 1 60 60 MET C C 60 178.144 178.144 178.389 -0.245 18518
1003 1 2 . 1 1 60 60 MET CA C 60 57.097 57.097 58.860 -1.763 18518
1004 1 2 . 1 1 60 60 MET CB C 60 30.140 30.140 31.816 -1.676 18518
1005 1 2 . 1 1 60 60 MET H H 60 8.227 8.227 8.766 -0.539 18518
1006 1 2 . 1 1 61 61 SER N N 61 114.216 114.216 114.517 -0.301 18518
1007 1 2 . 1 1 61 61 SER HA H 61 4.111 4.111 4.057 0.054 18518
1008 1 2 . 1 1 61 61 SER C C 61 177.335 177.335 176.897 0.438 18518
1009 1 2 . 1 1 61 61 SER CA C 61 61.590 61.590 62.542 -0.952 18518
1010 1 2 . 1 1 61 61 SER CB C 61 62.402 62.402 62.864 -0.462 18518
1011 1 2 . 1 1 61 61 SER H H 61 8.464 8.464 8.589 -0.125 18518
1012 1 2 . 1 1 62 62 GLU N N 62 123.004 123.004 121.430 1.574 18518
1013 1 2 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.097 -0.050 18518
1014 1 2 . 1 1 62 62 GLU C C 62 178.686 178.686 178.518 0.168 18518
1015 1 2 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.723 -0.098 18518
1016 1 2 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.255 0.399 18518
1017 1 2 . 1 1 62 62 GLU H H 62 7.994 7.994 7.715 0.279 18518
1018 1 2 . 1 1 63 63 LEU N N 63 120.818 120.818 122.483 -1.665 18518
1019 1 2 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.960 0.005 18518
1020 1 2 . 1 1 63 63 LEU C C 63 178.046 178.046 178.708 -0.662 18518
1021 1 2 . 1 1 63 63 LEU CA C 63 57.920 57.920 58.032 -0.112 18518
1022 1 2 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.551 0.073 18518
1023 1 2 . 1 1 63 63 LEU H H 63 8.130 8.130 7.915 0.215 18518
1024 1 2 . 1 1 64 64 ILE N N 64 118.528 118.528 119.737 -1.209 18518
1025 1 2 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.579 -0.210 18518
1026 1 2 . 1 1 64 64 ILE C C 64 177.127 177.127 177.761 -0.634 18518
1027 1 2 . 1 1 64 64 ILE CA C 64 66.678 66.678 65.872 0.806 18518
1028 1 2 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.673 0.771 18518
1029 1 2 . 1 1 64 64 ILE H H 64 8.488 8.488 8.600 -0.112 18518
1030 1 2 . 1 1 65 65 LYS N N 65 118.336 118.336 120.525 -2.189 18518
1031 1 2 . 1 1 65 65 LYS HA H 65 3.701 3.701 3.942 -0.240 18518
1032 1 2 . 1 1 65 65 LYS C C 65 179.291 179.291 179.123 0.168 18518
1033 1 2 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.974 0.466 18518
1034 1 2 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.353 0.018 18518
1035 1 2 . 1 1 65 65 LYS H H 65 7.347 7.347 7.647 -0.300 18518
1036 1 2 . 1 1 66 66 ILE N N 66 120.171 120.171 120.068 0.103 18518
1037 1 2 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.632 -0.054 18518
1038 1 2 . 1 1 66 66 ILE C C 66 178.873 178.873 178.293 0.580 18518
1039 1 2 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.261 -0.101 18518
1040 1 2 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.896 0.737 18518
1041 1 2 . 1 1 66 66 ILE H H 66 7.901 7.901 8.347 -0.446 18518
1042 1 2 . 1 1 67 67 ILE N N 67 121.185 121.185 120.251 0.934 18518
1043 1 2 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.616 -0.170 18518
1044 1 2 . 1 1 67 67 ILE C C 67 177.150 177.150 177.691 -0.541 18518
1045 1 2 . 1 1 67 67 ILE CA C 67 62.806 62.806 63.836 -1.030 18518
1046 1 2 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.171 -2.176 18518
1047 1 2 . 1 1 67 67 ILE H H 67 8.290 8.290 8.142 0.148 18518
1048 1 2 . 1 1 68 68 ARG N N 68 119.173 119.173 118.607 0.566 18518
1049 1 2 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.653 -0.722 18518
1050 1 2 . 1 1 68 68 ARG C C 68 178.496 178.496 178.762 -0.266 18518
1051 1 2 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.522 1.114 18518
1052 1 2 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.595 0.845 18518
1053 1 2 . 1 1 68 68 ARG H H 68 8.438 8.438 8.349 0.089 18518
1054 1 2 . 1 1 69 69 ARG N N 69 116.511 116.511 119.794 -3.283 18518
1055 1 2 . 1 1 69 69 ARG HA H 69 4.134 4.134 3.976 0.158 18518
1056 1 2 . 1 1 69 69 ARG C C 69 180.262 180.262 178.392 1.870 18518
1057 1 2 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.334 -0.627 18518
1058 1 2 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.301 -0.348 18518
1059 1 2 . 1 1 69 69 ARG H H 69 7.497 7.497 8.280 -0.783 18518
1060 1 2 . 1 1 70 70 ARG N N 70 123.297 123.297 117.902 5.395 18518
1061 1 2 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.092 -0.076 18518
1062 1 2 . 1 1 70 70 ARG C C 70 178.700 178.700 178.437 0.263 18518
1063 1 2 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.512 0.948 18518
1064 1 2 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.817 0.495 18518
1065 1 2 . 1 1 70 70 ARG H H 70 8.075 8.075 7.799 0.276 18518
1066 1 2 . 1 1 71 71 LEU N N 71 116.829 116.829 119.600 -2.771 18518
1067 1 2 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.150 -0.085 18518
1068 1 2 . 1 1 71 71 LEU C C 71 174.956 174.956 176.386 -1.430 18518
1069 1 2 . 1 1 71 71 LEU CA C 71 55.126 55.126 56.095 -0.969 18518
1070 1 2 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.188 1.058 18518
1071 1 2 . 1 1 71 71 LEU H H 71 7.719 7.719 7.957 -0.238 18518
1072 1 2 . 1 1 72 72 GLN N N 72 114.991 114.991 115.165 -0.174 18518
1073 1 2 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.927 -0.091 18518
1074 1 2 . 1 1 72 72 GLN C C 72 175.683 175.683 175.128 0.555 18518
1075 1 2 . 1 1 72 72 GLN CA C 72 56.325 56.325 55.965 0.360 18518
1076 1 2 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.798 0.206 18518
1077 1 2 . 1 1 72 72 GLN H H 72 7.744 7.744 7.696 0.048 18518
1078 1 2 . 1 1 73 73 LEU N N 73 115.045 115.045 119.941 -4.896 18518
1079 1 2 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.047 0.189 18518
1080 1 2 . 1 1 73 73 LEU C C 73 178.762 178.762 176.775 1.987 18518
1081 1 2 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.354 -0.968 18518
1082 1 2 . 1 1 73 73 LEU CB C 73 42.091 42.091 42.233 -0.142 18518
1083 1 2 . 1 1 73 73 LEU H H 73 7.500 7.500 7.617 -0.117 18518
1084 1 2 . 1 1 74 74 ASN N N 74 121.700 121.700 119.435 2.265 18518
1085 1 2 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.628 0.062 18518
1086 1 2 . 1 1 74 74 ASN C C 74 176.617 176.617 175.458 1.159 18518
1087 1 2 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.442 -0.757 18518
1088 1 2 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.042 0.556 18518
1089 1 2 . 1 1 74 74 ASN H H 74 9.045 9.045 8.290 0.755 18518
1090 1 2 . 1 1 75 75 ALA N N 75 123.952 123.952 121.884 2.068 18518
1091 1 2 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.467 -0.503 18518
1092 1 2 . 1 1 75 75 ALA C C 75 178.131 178.131 176.930 1.201 18518
1093 1 2 . 1 1 75 75 ALA CA C 75 54.868 54.868 52.708 2.160 18518
1094 1 2 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.278 -0.560 18518
1095 1 2 . 1 1 75 75 ALA H H 75 8.784 8.784 8.411 0.373 18518
1096 1 2 . 1 1 76 76 ASN N N 76 112.295 112.295 116.499 -4.204 18518
1097 1 2 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.735 -0.155 18518
1098 1 2 . 1 1 76 76 ASN C C 76 175.448 175.448 175.013 0.435 18518
1099 1 2 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.231 -0.017 18518
1100 1 2 . 1 1 76 76 ASN CB C 76 38.320 38.320 39.335 -1.015 18518
1101 1 2 . 1 1 76 76 ASN H H 76 8.391 8.391 8.469 -0.078 18518
1102 1 2 . 1 1 77 77 GLN N N 77 120.577 120.577 119.523 1.054 18518
1103 1 2 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.741 -0.468 18518
1104 1 2 . 1 1 77 77 GLN C C 77 175.045 175.045 173.614 1.431 18518
1105 1 2 . 1 1 77 77 GLN CA C 77 55.805 55.805 55.278 0.527 18518
1106 1 2 . 1 1 77 77 GLN CB C 77 30.157 30.157 31.640 -1.483 18518
1107 1 2 . 1 1 77 77 GLN H H 77 7.552 7.552 7.606 -0.054 18518
1108 1 2 . 1 1 78 78 ALA N N 78 130.670 130.670 123.237 7.433 18518
1109 1 2 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.642 -0.471 18518
1110 1 2 . 1 1 78 78 ALA C C 78 176.512 176.512 175.316 1.196 18518
1111 1 2 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.104 1.738 18518
1112 1 2 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.417 -1.357 18518
1113 1 2 . 1 1 78 78 ALA H H 78 8.799 8.799 8.643 0.156 18518
1114 1 2 . 1 1 79 79 PHE N N 79 119.325 119.325 116.396 2.929 18518
1115 1 2 . 1 1 79 79 PHE HA H 79 4.434 4.434 5.493 -1.059 18518
1116 1 2 . 1 1 79 79 PHE C C 79 171.726 171.726 173.034 -1.308 18518
1117 1 2 . 1 1 79 79 PHE CA C 79 59.145 59.145 55.005 4.140 18518
1118 1 2 . 1 1 79 79 PHE CB C 79 42.171 42.171 42.096 0.075 18518
1119 1 2 . 1 1 79 79 PHE H H 79 7.664 7.664 8.194 -0.530 18518
1120 1 2 . 1 1 80 80 PHE N N 80 126.314 126.314 119.813 6.501 18518
1121 1 2 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.426 -0.034 18518
1122 1 2 . 1 1 80 80 PHE C C 80 177.169 177.169 173.284 3.885 18518
1123 1 2 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.303 0.350 18518
1124 1 2 . 1 1 80 80 PHE CB C 80 41.933 41.933 43.209 -1.276 18518
1125 1 2 . 1 1 80 80 PHE H H 80 8.508 8.508 9.165 -0.657 18518
1126 1 2 . 1 1 81 81 LEU N N 81 121.426 121.426 122.956 -1.530 18518
1127 1 2 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.030 -0.179 18518
1128 1 2 . 1 1 81 81 LEU C C 81 174.488 174.488 174.983 -0.495 18518
1129 1 2 . 1 1 81 81 LEU CA C 81 53.197 53.197 54.007 -0.810 18518
1130 1 2 . 1 1 81 81 LEU CB C 81 45.100 45.100 43.933 1.167 18518
1131 1 2 . 1 1 81 81 LEU H H 81 8.229 8.229 8.309 -0.080 18518
1132 1 2 . 1 1 82 82 LEU N N 82 125.155 125.155 128.384 -3.229 18518
1133 1 2 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.421 0.412 18518
1134 1 2 . 1 1 82 82 LEU C C 82 177.166 177.166 175.563 1.603 18518
1135 1 2 . 1 1 82 82 LEU CA C 82 54.197 54.197 53.843 0.353 18518
1136 1 2 . 1 1 82 82 LEU CB C 82 43.442 43.442 43.061 0.381 18518
1137 1 2 . 1 1 82 82 LEU H H 82 9.400 9.400 9.251 0.149 18518
1138 1 2 . 1 1 83 83 VAL N N 83 123.886 123.886 123.442 0.444 18518
1139 1 2 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.190 0.189 18518
1140 1 2 . 1 1 83 83 VAL C C 83 175.810 175.810 176.542 -0.732 18518
1141 1 2 . 1 1 83 83 VAL CA C 83 61.677 61.677 62.394 -0.717 18518
1142 1 2 . 1 1 83 83 VAL CB C 83 33.758 33.758 31.591 2.167 18518
1143 1 2 . 1 1 83 83 VAL H H 83 8.721 8.721 8.104 0.617 18518
1144 1 2 . 1 1 84 84 ASN N N 84 126.474 126.474 126.672 -0.198 18518
1145 1 2 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.517 -0.121 18518
1146 1 2 . 1 1 84 84 ASN C C 84 175.164 175.164 175.041 0.123 18518
1147 1 2 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.834 -0.096 18518
1148 1 2 . 1 1 84 84 ASN CB C 84 37.950 37.950 37.798 0.152 18518
1149 1 2 . 1 1 84 84 ASN H H 84 9.707 9.707 9.407 0.300 18518
1150 1 2 . 1 1 85 85 GLY N N 85 101.296 101.296 103.633 -2.337 18518
1151 1 2 . 1 1 85 85 GLY C C 85 173.680 173.680 173.362 0.318 18518
1152 1 2 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.754 0.849 18518
1153 1 2 . 1 1 85 85 GLY H H 85 8.644 8.644 8.254 0.390 18518
1154 1 2 . 1 1 86 86 HIS N N 86 117.238 117.238 119.585 -2.347 18518
1155 1 2 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.733 0.284 18518
1156 1 2 . 1 1 86 86 HIS C C 86 173.841 173.841 174.180 -0.339 18518
1157 1 2 . 1 1 86 86 HIS CA C 86 53.796 53.796 54.142 -0.346 18518
1158 1 2 . 1 1 86 86 HIS CB C 86 31.280 31.280 30.961 0.319 18518
1159 1 2 . 1 1 86 86 HIS H H 86 7.918 7.918 8.129 -0.211 18518
1160 1 2 . 1 1 87 87 SER N N 87 118.179 118.179 120.106 -1.927 18518
1161 1 2 . 1 1 87 87 SER HA H 87 4.699 4.699 4.537 0.162 18518
1162 1 2 . 1 1 87 87 SER C C 87 175.904 175.904 174.778 1.126 18518
1163 1 2 . 1 1 87 87 SER CA C 87 58.271 58.271 57.890 0.381 18518
1164 1 2 . 1 1 87 87 SER CB C 87 63.735 63.735 62.104 1.631 18518
1165 1 2 . 1 1 87 87 SER H H 87 8.977 8.977 8.744 0.233 18518
1166 1 2 . 1 1 88 88 MET N N 88 125.472 125.472 120.949 4.523 18518
1167 1 2 . 1 1 88 88 MET HA H 88 4.830 4.830 4.712 0.118 18518
1168 1 2 . 1 1 88 88 MET C C 88 176.419 176.419 175.383 1.036 18518
1169 1 2 . 1 1 88 88 MET CA C 88 54.899 54.899 55.678 -0.779 18518
1170 1 2 . 1 1 88 88 MET CB C 88 33.336 33.336 33.457 -0.121 18518
1171 1 2 . 1 1 88 88 MET H H 88 9.184 9.184 8.075 1.109 18518
1172 1 2 . 1 1 89 89 VAL N N 89 120.747 120.747 119.690 1.057 18518
1173 1 2 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.559 -0.327 18518
1174 1 2 . 1 1 89 89 VAL C C 89 175.958 175.958 175.216 0.742 18518
1175 1 2 . 1 1 89 89 VAL CA C 89 63.154 63.154 60.391 2.763 18518
1176 1 2 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.889 -2.011 18518
1177 1 2 . 1 1 89 89 VAL H H 89 8.233 8.233 7.432 0.801 18518
1178 1 2 . 1 1 90 90 SER N N 90 117.362 117.362 120.511 -3.149 18518
1179 1 2 . 1 1 90 90 SER HA H 90 4.590 4.590 4.676 -0.086 18518
1180 1 2 . 1 1 90 90 SER C C 90 175.741 175.741 174.064 1.677 18518
1181 1 2 . 1 1 90 90 SER CA C 90 57.717 57.717 57.773 -0.056 18518
1182 1 2 . 1 1 90 90 SER CB C 90 63.223 63.223 64.163 -0.940 18518
1183 1 2 . 1 1 90 90 SER H H 90 8.482 8.482 8.179 0.303 18518
1184 1 2 . 1 1 91 91 VAL N N 91 120.466 120.466 117.026 3.440 18518
1185 1 2 . 1 1 91 91 VAL HA H 91 4.047 4.047 4.266 -0.219 18518
1186 1 2 . 1 1 91 91 VAL C C 91 176.329 176.329 174.886 1.443 18518
1187 1 2 . 1 1 91 91 VAL CA C 91 63.492 63.492 63.222 0.270 18518
1188 1 2 . 1 1 91 91 VAL CB C 91 32.568 32.568 32.343 0.225 18518
1189 1 2 . 1 1 91 91 VAL H H 91 8.188 8.188 8.374 -0.186 18518
1190 1 2 . 1 1 92 92 SER N N 92 116.398 116.398 113.255 3.143 18518
1191 1 2 . 1 1 92 92 SER HA H 92 4.636 4.636 4.623 0.013 18518
1192 1 2 . 1 1 92 92 SER C C 92 174.159 174.159 175.082 -0.923 18518
1193 1 2 . 1 1 92 92 SER CA C 92 57.805 57.805 57.509 0.296 18518
1194 1 2 . 1 1 92 92 SER CB C 92 63.046 63.046 63.508 -0.462 18518
1195 1 2 . 1 1 92 92 SER H H 92 8.370 8.370 7.678 0.692 18518
1196 1 2 . 1 1 93 93 THR N N 93 119.211 119.211 117.681 1.530 18518
1197 1 2 . 1 1 93 93 THR HA H 93 4.484 4.484 4.545 -0.060 18518
1198 1 2 . 1 1 93 93 THR CA C 93 60.884 60.884 60.438 0.445 18518
1199 1 2 . 1 1 93 93 THR CB C 93 70.609 70.609 68.868 1.740 18518
1200 1 2 . 1 1 93 93 THR H H 93 7.416 7.416 7.607 -0.191 18518
1201 1 2 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.623 -0.183 18518
1202 1 2 . 1 1 94 94 PRO C C 94 178.775 178.775 177.070 1.705 18518
1203 1 2 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.199 0.744 18518
1204 1 2 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.777 -0.128 18518
1205 1 2 . 1 1 95 95 ILE N N 95 124.174 124.174 123.085 1.089 18518
1206 1 2 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.815 0.134 18518
1207 1 2 . 1 1 95 95 ILE C C 95 176.498 176.498 176.783 -0.285 18518
1208 1 2 . 1 1 95 95 ILE CA C 95 63.904 63.904 62.366 1.538 18518
1209 1 2 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.079 0.103 18518
1210 1 2 . 1 1 95 95 ILE H H 95 9.305 9.305 7.863 1.442 18518
1211 1 2 . 1 1 96 96 SER N N 96 116.920 116.920 115.746 1.174 18518
1212 1 2 . 1 1 96 96 SER HA H 96 4.029 4.029 4.146 -0.117 18518
1213 1 2 . 1 1 96 96 SER C C 96 176.574 176.574 176.382 0.192 18518
1214 1 2 . 1 1 96 96 SER CA C 96 61.356 61.356 62.437 -1.081 18518
1215 1 2 . 1 1 96 96 SER CB C 96 61.723 61.723 62.438 -0.715 18518
1216 1 2 . 1 1 96 96 SER H H 96 8.335 8.335 8.715 -0.380 18518
1217 1 2 . 1 1 97 97 GLU N N 97 123.255 123.255 123.041 0.214 18518
1218 1 2 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.348 -0.070 18518
1219 1 2 . 1 1 97 97 GLU C C 97 179.716 179.716 178.850 0.866 18518
1220 1 2 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.499 0.293 18518
1221 1 2 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.334 0.228 18518
1222 1 2 . 1 1 97 97 GLU H H 97 7.376 7.376 7.803 -0.427 18518
1223 1 2 . 1 1 98 98 VAL N N 98 121.137 121.137 120.596 0.541 18518
1224 1 2 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.693 0.109 18518
1225 1 2 . 1 1 98 98 VAL C C 98 177.637 177.637 178.124 -0.487 18518
1226 1 2 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.407 -0.583 18518
1227 1 2 . 1 1 98 98 VAL CB C 98 32.154 32.154 30.915 1.239 18518
1228 1 2 . 1 1 98 98 VAL H H 98 7.387 7.387 7.876 -0.489 18518
1229 1 2 . 1 1 99 99 TYR N N 99 118.927 118.927 121.726 -2.799 18518
1230 1 2 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.111 -0.121 18518
1231 1 2 . 1 1 99 99 TYR C C 99 176.081 176.081 176.953 -0.872 18518
1232 1 2 . 1 1 99 99 TYR CA C 99 62.223 62.223 60.327 1.896 18518
1233 1 2 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.184 0.798 18518
1234 1 2 . 1 1 99 99 TYR H H 99 9.048 9.048 8.582 0.466 18518
1235 1 2 . 1 1 100 100 GLU N N 100 113.894 113.894 116.394 -2.500 18518
1236 1 2 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.736 0.110 18518
1237 1 2 . 1 1 100 100 GLU C C 100 177.989 177.989 178.409 -0.420 18518
1238 1 2 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.443 0.644 18518
1239 1 2 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.815 0.567 18518
1240 1 2 . 1 1 100 100 GLU H H 100 7.422 7.422 7.985 -0.563 18518
1241 1 2 . 1 1 101 101 SER N N 101 108.991 108.991 114.148 -5.157 18518
1242 1 2 . 1 1 101 101 SER HA H 101 4.524 4.524 4.423 0.101 18518
1243 1 2 . 1 1 101 101 SER C C 101 176.628 176.628 175.162 1.466 18518
1244 1 2 . 1 1 101 101 SER CA C 101 60.349 60.349 60.552 -0.203 18518
1245 1 2 . 1 1 101 101 SER CB C 101 64.741 64.741 64.150 0.591 18518
1246 1 2 . 1 1 101 101 SER H H 101 7.424 7.424 7.841 -0.417 18518
1247 1 2 . 1 1 102 102 GLU N N 102 116.533 116.533 119.085 -2.552 18518
1248 1 2 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.633 0.111 18518
1249 1 2 . 1 1 102 102 GLU C C 102 176.774 176.774 175.432 1.342 18518
1250 1 2 . 1 1 102 102 GLU CA C 102 55.581 55.581 55.635 -0.054 18518
1251 1 2 . 1 1 102 102 GLU CB C 102 30.697 30.697 31.093 -0.396 18518
1252 1 2 . 1 1 102 102 GLU H H 102 8.487 8.487 7.811 0.676 18518
1253 1 2 . 1 1 103 103 LYS N N 103 118.370 118.370 120.394 -2.024 18518
1254 1 2 . 1 1 103 103 LYS HA H 103 4.178 4.178 4.226 -0.048 18518
1255 1 2 . 1 1 103 103 LYS C C 103 175.018 175.018 176.695 -1.677 18518
1256 1 2 . 1 1 103 103 LYS CA C 103 57.329 57.329 57.083 0.246 18518
1257 1 2 . 1 1 103 103 LYS CB C 103 32.186 32.186 31.587 0.599 18518
1258 1 2 . 1 1 103 103 LYS H H 103 7.831 7.831 7.724 0.107 18518
1259 1 2 . 1 1 104 104 ASP N N 104 123.500 123.500 125.490 -1.990 18518
1260 1 2 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.555 0.200 18518
1261 1 2 . 1 1 104 104 ASP C C 104 177.383 177.383 178.214 -0.831 18518
1262 1 2 . 1 1 104 104 ASP CA C 104 53.846 53.846 55.067 -1.221 18518
1263 1 2 . 1 1 104 104 ASP CB C 104 43.411 43.411 42.335 1.076 18518
1264 1 2 . 1 1 104 104 ASP H H 104 9.041 9.041 8.127 0.914 18518
1265 1 2 . 1 1 105 105 GLU N N 105 125.448 125.448 121.254 4.194 18518
1266 1 2 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.127 0.053 18518
1267 1 2 . 1 1 105 105 GLU C C 105 177.519 177.519 176.617 0.902 18518
1268 1 2 . 1 1 105 105 GLU CA C 105 59.529 59.529 59.090 0.438 18518
1269 1 2 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.592 0.452 18518
1270 1 2 . 1 1 105 105 GLU H H 105 8.906 8.906 8.983 -0.077 18518
1271 1 2 . 1 1 106 106 ASP N N 106 118.824 118.824 118.581 0.243 18518
1272 1 2 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.693 -0.514 18518
1273 1 2 . 1 1 106 106 ASP C C 106 176.223 176.223 176.521 -0.298 18518
1274 1 2 . 1 1 106 106 ASP CA C 106 54.756 54.756 54.770 -0.014 18518
1275 1 2 . 1 1 106 106 ASP CB C 106 39.999 39.999 40.847 -0.848 18518
1276 1 2 . 1 1 106 106 ASP H H 106 10.036 10.036 8.133 1.903 18518
1277 1 2 . 1 1 107 107 GLY N N 107 105.866 105.866 106.665 -0.799 18518
1278 1 2 . 1 1 107 107 GLY C C 107 175.136 175.136 174.239 0.897 18518
1279 1 2 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.715 -0.493 18518
1280 1 2 . 1 1 107 107 GLY H H 107 8.001 8.001 8.065 -0.064 18518
1281 1 2 . 1 1 108 108 PHE N N 108 123.820 123.820 120.755 3.065 18518
1282 1 2 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.970 -0.308 18518
1283 1 2 . 1 1 108 108 PHE C C 108 174.899 174.899 174.447 0.452 18518
1284 1 2 . 1 1 108 108 PHE CA C 108 60.238 60.238 57.517 2.721 18518
1285 1 2 . 1 1 108 108 PHE CB C 108 40.365 40.365 41.384 -1.019 18518
1286 1 2 . 1 1 108 108 PHE H H 108 9.912 9.912 7.882 2.030 18518
1287 1 2 . 1 1 109 109 LEU N N 109 120.130 120.130 124.105 -3.975 18518
1288 1 2 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.907 0.123 18518
1289 1 2 . 1 1 109 109 LEU C C 109 173.916 173.916 174.807 -0.891 18518
1290 1 2 . 1 1 109 109 LEU CA C 109 53.424 53.424 54.195 -0.771 18518
1291 1 2 . 1 1 109 109 LEU CB C 109 45.203 45.203 43.628 1.575 18518
1292 1 2 . 1 1 109 109 LEU H H 109 7.997 7.997 8.743 -0.746 18518
1293 1 2 . 1 1 110 110 TYR N N 110 126.579 126.579 126.442 0.137 18518
1294 1 2 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.646 0.357 18518
1295 1 2 . 1 1 110 110 TYR C C 110 176.671 176.671 175.197 1.474 18518
1296 1 2 . 1 1 110 110 TYR CA C 110 59.058 59.058 58.427 0.631 18518
1297 1 2 . 1 1 110 110 TYR CB C 110 39.556 39.556 40.022 -0.466 18518
1298 1 2 . 1 1 110 110 TYR H H 110 9.377 9.377 8.452 0.925 18518
1299 1 2 . 1 1 111 111 MET N N 111 119.240 119.240 119.754 -0.514 18518
1300 1 2 . 1 1 111 111 MET HA H 111 5.486 5.486 5.245 0.241 18518
1301 1 2 . 1 1 111 111 MET C C 111 175.695 175.695 174.353 1.342 18518
1302 1 2 . 1 1 111 111 MET CA C 111 54.124 54.124 54.831 -0.707 18518
1303 1 2 . 1 1 111 111 MET CB C 111 36.960 36.960 37.958 -0.998 18518
1304 1 2 . 1 1 111 111 MET H H 111 9.658 9.658 8.729 0.929 18518
1305 1 2 . 1 1 112 112 VAL N N 112 119.865 119.865 115.361 4.504 18518
1306 1 2 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.542 0.421 18518
1307 1 2 . 1 1 112 112 VAL C C 112 175.058 175.058 174.044 1.014 18518
1308 1 2 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.332 -0.421 18518
1309 1 2 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.388 0.663 18518
1310 1 2 . 1 1 112 112 VAL H H 112 8.794 8.794 8.970 -0.176 18518
1311 1 2 . 1 1 113 113 TYR N N 113 119.664 119.664 120.388 -0.724 18518
1312 1 2 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.800 0.318 18518
1313 1 2 . 1 1 113 113 TYR C C 113 173.375 173.375 173.449 -0.074 18518
1314 1 2 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.204 -1.051 18518
1315 1 2 . 1 1 113 113 TYR CB C 113 43.312 43.312 42.133 1.179 18518
1316 1 2 . 1 1 113 113 TYR H H 113 8.315 8.315 8.315 -0.000 18518
1317 1 2 . 1 1 114 114 ALA N N 114 119.763 119.763 122.001 -2.238 18518
1318 1 2 . 1 1 114 114 ALA HA H 114 4.800 4.800 4.837 -0.037 18518
1319 1 2 . 1 1 114 114 ALA C C 114 176.216 176.216 174.821 1.395 18518
1320 1 2 . 1 1 114 114 ALA CA C 114 51.132 51.132 52.296 -1.164 18518
1321 1 2 . 1 1 114 114 ALA CB C 114 24.596 24.596 21.996 2.600 18518
1322 1 2 . 1 1 114 114 ALA H H 114 8.465 8.465 8.850 -0.385 18518
1323 1 2 . 1 1 115 115 SER N N 115 114.763 114.763 115.873 -1.110 18518
1324 1 2 . 1 1 115 115 SER HA H 115 4.496 4.496 4.902 -0.406 18518
1325 1 2 . 1 1 115 115 SER C C 115 172.671 172.671 173.769 -1.098 18518
1326 1 2 . 1 1 115 115 SER CA C 115 58.651 58.651 57.774 0.877 18518
1327 1 2 . 1 1 115 115 SER CB C 115 63.526 63.526 62.191 1.335 18518
1328 1 2 . 1 1 115 115 SER H H 115 9.915 9.915 9.185 0.730 18518
1329 1 2 . 1 1 116 116 GLN N N 116 116.611 116.611 124.097 -7.486 18518
1330 1 2 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.622 -0.138 18518
1331 1 2 . 1 1 116 116 GLN C C 116 172.733 172.733 174.029 -1.296 18518
1332 1 2 . 1 1 116 116 GLN CA C 116 53.926 53.926 56.046 -2.120 18518
1333 1 2 . 1 1 116 116 GLN CB C 116 32.358 32.358 30.797 1.561 18518
1334 1 2 . 1 1 116 116 GLN H H 116 7.219 7.219 8.115 -0.896 18518
1335 1 2 . 1 1 117 117 GLU N N 117 117.623 117.623 123.065 -5.442 18518
1336 1 2 . 1 1 117 117 GLU HA H 117 3.287 3.287 2.667 0.620 18518
1337 1 2 . 1 1 117 117 GLU C C 117 175.168 175.168 175.671 -0.503 18518
1338 1 2 . 1 1 117 117 GLU CA C 117 56.882 56.882 57.489 -0.607 18518
1339 1 2 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.689 0.833 18518
1340 1 2 . 1 1 117 117 GLU H H 117 7.882 7.882 8.539 -0.657 18518
1341 1 2 . 1 1 118 118 THR N N 118 109.820 109.820 109.086 0.734 18518
1342 1 2 . 1 1 118 118 THR HA H 118 4.066 4.066 4.470 -0.404 18518
1343 1 2 . 1 1 118 118 THR C C 118 172.355 172.355 174.202 -1.847 18518
1344 1 2 . 1 1 118 118 THR CA C 118 60.029 60.029 59.916 0.113 18518
1345 1 2 . 1 1 118 118 THR CB C 118 70.480 70.480 69.851 0.629 18518
1346 1 2 . 1 1 118 118 THR H H 118 6.992 6.992 7.560 -0.568 18518
1347 1 3 . 1 1 2 2 ALA HA H 2 4.336 4.336 5.258 -0.922 18518
1348 1 3 . 1 1 2 2 ALA C C 2 177.974 177.974 176.104 1.870 18518
1349 1 3 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.590 1.196 18518
1350 1 3 . 1 1 2 2 ALA CB C 2 19.444 19.444 21.121 -1.677 18518
1351 1 3 . 1 1 3 3 MET N N 3 119.311 119.311 120.273 -0.962 18518
1352 1 3 . 1 1 3 3 MET HA H 3 4.451 4.451 4.774 -0.323 18518
1353 1 3 . 1 1 3 3 MET C C 3 176.913 176.913 175.118 1.795 18518
1354 1 3 . 1 1 3 3 MET CA C 3 55.679 55.679 55.065 0.614 18518
1355 1 3 . 1 1 3 3 MET CB C 3 32.590 32.590 35.470 -2.880 18518
1356 1 3 . 1 1 3 3 MET H H 3 8.638 8.638 8.688 -0.050 18518
1357 1 3 . 1 1 4 4 GLY N N 4 110.281 110.281 110.455 -0.174 18518
1358 1 3 . 1 1 4 4 GLY C C 4 174.180 174.180 173.720 0.460 18518
1359 1 3 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.750 0.745 18518
1360 1 3 . 1 1 4 4 GLY H H 4 8.552 8.552 8.640 -0.088 18518
1361 1 3 . 1 1 5 5 LYS N N 5 120.818 120.818 126.828 -6.010 18518
1362 1 3 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.532 -0.023 18518
1363 1 3 . 1 1 5 5 LYS C C 5 177.605 177.605 176.103 1.502 18518
1364 1 3 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.859 0.275 18518
1365 1 3 . 1 1 5 5 LYS CB C 5 34.813 34.813 32.950 1.863 18518
1366 1 3 . 1 1 5 5 LYS H H 5 8.133 8.133 8.121 0.012 18518
1367 1 3 . 1 1 6 6 THR N N 6 114.781 114.781 115.217 -0.436 18518
1368 1 3 . 1 1 6 6 THR HA H 6 4.421 4.421 4.329 0.092 18518
1369 1 3 . 1 1 6 6 THR C C 6 175.524 175.524 175.983 -0.459 18518
1370 1 3 . 1 1 6 6 THR CA C 6 61.127 61.127 61.093 0.034 18518
1371 1 3 . 1 1 6 6 THR CB C 6 69.926 69.926 69.899 0.027 18518
1372 1 3 . 1 1 6 6 THR H H 6 8.483 8.483 8.111 0.372 18518
1373 1 3 . 1 1 7 7 PHE N N 7 125.552 125.552 121.101 4.451 18518
1374 1 3 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.059 -0.054 18518
1375 1 3 . 1 1 7 7 PHE C C 7 177.397 177.397 176.971 0.426 18518
1376 1 3 . 1 1 7 7 PHE CA C 7 63.393 63.393 61.700 1.693 18518
1377 1 3 . 1 1 7 7 PHE CB C 7 39.567 39.567 37.981 1.586 18518
1378 1 3 . 1 1 7 7 PHE H H 7 10.245 10.245 8.986 1.259 18518
1379 1 3 . 1 1 8 8 LYS N N 8 114.053 114.053 117.009 -2.956 18518
1380 1 3 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.825 0.010 18518
1381 1 3 . 1 1 8 8 LYS C C 8 175.520 175.520 178.581 -3.061 18518
1382 1 3 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.346 1.647 18518
1383 1 3 . 1 1 8 8 LYS CB C 8 33.689 33.689 30.908 2.781 18518
1384 1 3 . 1 1 8 8 LYS H H 8 8.775 8.775 7.085 1.690 18518
1385 1 3 . 1 1 9 9 GLN N N 9 113.516 113.516 118.737 -5.221 18518
1386 1 3 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.131 0.018 18518
1387 1 3 . 1 1 9 9 GLN C C 9 177.615 177.615 177.505 0.110 18518
1388 1 3 . 1 1 9 9 GLN CA C 9 56.819 56.819 58.104 -1.285 18518
1389 1 3 . 1 1 9 9 GLN CB C 9 30.019 30.019 29.085 0.934 18518
1390 1 3 . 1 1 9 9 GLN H H 9 7.355 7.355 7.817 -0.462 18518
1391 1 3 . 1 1 10 10 ARG N N 10 118.294 118.294 115.753 2.541 18518
1392 1 3 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.230 0.072 18518
1393 1 3 . 1 1 10 10 ARG C C 10 179.380 179.380 176.960 2.420 18518
1394 1 3 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.056 0.212 18518
1395 1 3 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.704 0.938 18518
1396 1 3 . 1 1 10 10 ARG H H 10 7.936 7.936 7.776 0.160 18518
1397 1 3 . 1 1 11 11 ARG N N 11 121.137 121.137 119.817 1.320 18518
1398 1 3 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.666 0.014 18518
1399 1 3 . 1 1 11 11 ARG CA C 11 53.453 53.453 54.706 -1.253 18518
1400 1 3 . 1 1 11 11 ARG CB C 11 32.938 32.938 32.658 0.280 18518
1401 1 3 . 1 1 11 11 ARG H H 11 7.390 7.390 7.677 -0.287 18518
1402 1 3 . 1 1 12 12 THR N N 12 116.819 116.819 119.151 -2.332 18518
1403 1 3 . 1 1 12 12 THR HA H 12 4.359 4.359 4.260 0.099 18518
1404 1 3 . 1 1 12 12 THR C C 12 174.989 174.989 176.441 -1.452 18518
1405 1 3 . 1 1 12 12 THR CA C 12 61.748 61.748 62.205 -0.457 18518
1406 1 3 . 1 1 12 12 THR CB C 12 71.068 71.068 70.012 1.056 18518
1407 1 3 . 1 1 12 12 THR H H 12 8.953 8.953 8.235 0.718 18518
1408 1 3 . 1 1 13 13 PHE N N 13 123.200 123.200 122.916 0.284 18518
1409 1 3 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.198 -0.170 18518
1410 1 3 . 1 1 13 13 PHE C C 13 176.029 176.029 176.905 -0.876 18518
1411 1 3 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.607 0.257 18518
1412 1 3 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.406 0.154 18518
1413 1 3 . 1 1 13 13 PHE H H 13 9.284 9.284 8.964 0.320 18518
1414 1 3 . 1 1 14 14 GLU N N 14 115.414 115.414 118.140 -2.726 18518
1415 1 3 . 1 1 14 14 GLU HA H 14 3.794 3.794 3.933 -0.139 18518
1416 1 3 . 1 1 14 14 GLU C C 14 180.081 180.081 178.947 1.134 18518
1417 1 3 . 1 1 14 14 GLU CA C 14 60.619 60.619 60.127 0.492 18518
1418 1 3 . 1 1 14 14 GLU CB C 14 28.852 28.852 28.581 0.271 18518
1419 1 3 . 1 1 14 14 GLU H H 14 8.973 8.973 8.738 0.235 18518
1420 1 3 . 1 1 15 15 GLN N N 15 119.276 119.276 118.293 0.983 18518
1421 1 3 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.131 -0.131 18518
1422 1 3 . 1 1 15 15 GLN C C 15 177.978 177.978 179.112 -1.134 18518
1423 1 3 . 1 1 15 15 GLN CA C 15 58.835 58.835 59.159 -0.324 18518
1424 1 3 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.199 1.171 18518
1425 1 3 . 1 1 15 15 GLN H H 15 7.756 7.756 8.611 -0.855 18518
1426 1 3 . 1 1 16 16 ARG N N 16 121.336 121.336 120.865 0.471 18518
1427 1 3 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.222 0.048 18518
1428 1 3 . 1 1 16 16 ARG C C 16 177.416 177.416 178.754 -1.338 18518
1429 1 3 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.719 1.656 18518
1430 1 3 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.356 0.249 18518
1431 1 3 . 1 1 16 16 ARG H H 16 8.645 8.645 7.995 0.650 18518
1432 1 3 . 1 1 17 17 VAL N N 17 117.630 117.630 120.785 -3.155 18518
1433 1 3 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.567 0.290 18518
1434 1 3 . 1 1 17 17 VAL C C 17 179.748 179.748 177.012 2.736 18518
1435 1 3 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.557 0.169 18518
1436 1 3 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.811 0.383 18518
1437 1 3 . 1 1 17 17 VAL H H 17 8.373 8.373 8.190 0.183 18518
1438 1 3 . 1 1 18 18 GLU N N 18 120.864 120.864 119.809 1.055 18518
1439 1 3 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.867 0.435 18518
1440 1 3 . 1 1 18 18 GLU C C 18 177.728 177.728 178.175 -0.447 18518
1441 1 3 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.932 -1.446 18518
1442 1 3 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.444 -0.062 18518
1443 1 3 . 1 1 18 18 GLU H H 18 7.368 7.368 8.633 -1.265 18518
1444 1 3 . 1 1 19 19 ASP N N 19 121.425 121.425 120.259 1.166 18518
1445 1 3 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.439 -0.005 18518
1446 1 3 . 1 1 19 19 ASP C C 19 179.978 179.978 178.896 1.082 18518
1447 1 3 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.257 0.165 18518
1448 1 3 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.555 0.732 18518
1449 1 3 . 1 1 19 19 ASP H H 19 8.671 8.671 7.982 0.689 18518
1450 1 3 . 1 1 20 20 VAL N N 20 119.730 119.730 120.075 -0.345 18518
1451 1 3 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.229 -0.024 18518
1452 1 3 . 1 1 20 20 VAL C C 20 176.284 176.284 177.536 -1.252 18518
1453 1 3 . 1 1 20 20 VAL CA C 20 66.315 66.315 67.024 -0.709 18518
1454 1 3 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.395 -0.288 18518
1455 1 3 . 1 1 20 20 VAL H H 20 7.999 7.999 7.650 0.349 18518
1456 1 3 . 1 1 21 21 ARG N N 21 121.455 121.455 119.593 1.862 18518
1457 1 3 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.908 -0.094 18518
1458 1 3 . 1 1 21 21 ARG C C 21 180.120 180.120 178.456 1.664 18518
1459 1 3 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.686 1.144 18518
1460 1 3 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.089 0.857 18518
1461 1 3 . 1 1 21 21 ARG H H 21 8.098 8.098 7.830 0.268 18518
1462 1 3 . 1 1 22 22 LEU N N 22 117.826 117.826 121.562 -3.736 18518
1463 1 3 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.065 -0.016 18518
1464 1 3 . 1 1 22 22 LEU C C 22 180.115 180.115 178.622 1.493 18518
1465 1 3 . 1 1 22 22 LEU CA C 22 57.790 57.790 57.968 -0.178 18518
1466 1 3 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.781 0.361 18518
1467 1 3 . 1 1 22 22 LEU H H 22 8.207 8.207 8.301 -0.094 18518
1468 1 3 . 1 1 23 23 ILE N N 23 121.450 121.450 119.201 2.249 18518
1469 1 3 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.625 0.388 18518
1470 1 3 . 1 1 23 23 ILE C C 23 178.149 178.149 177.892 0.257 18518
1471 1 3 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.704 -2.533 18518
1472 1 3 . 1 1 23 23 ILE CB C 23 38.106 38.106 37.625 0.481 18518
1473 1 3 . 1 1 23 23 ILE H H 23 8.105 8.105 7.938 0.167 18518
1474 1 3 . 1 1 24 24 ARG N N 24 121.139 121.139 119.381 1.758 18518
1475 1 3 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.015 -0.028 18518
1476 1 3 . 1 1 24 24 ARG C C 24 178.702 178.702 179.031 -0.329 18518
1477 1 3 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.898 -1.180 18518
1478 1 3 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.689 -0.920 18518
1479 1 3 . 1 1 24 24 ARG H H 24 8.601 8.601 8.231 0.370 18518
1480 1 3 . 1 1 25 25 GLU N N 25 118.054 118.054 118.520 -0.466 18518
1481 1 3 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.071 -0.045 18518
1482 1 3 . 1 1 25 25 GLU C C 25 178.492 178.492 178.167 0.325 18518
1483 1 3 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.554 0.225 18518
1484 1 3 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.723 0.278 18518
1485 1 3 . 1 1 25 25 GLU H H 25 7.423 7.423 8.044 -0.621 18518
1486 1 3 . 1 1 26 26 GLN N N 26 116.350 116.350 116.757 -0.407 18518
1487 1 3 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.052 -0.116 18518
1488 1 3 . 1 1 26 26 GLN C C 26 176.305 176.305 176.933 -0.628 18518
1489 1 3 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.258 0.245 18518
1490 1 3 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.479 0.728 18518
1491 1 3 . 1 1 26 26 GLN H H 26 7.524 7.524 7.598 -0.074 18518
1492 1 3 . 1 1 27 27 HIS N N 27 116.017 116.017 118.357 -2.340 18518
1493 1 3 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.056 -0.126 18518
1494 1 3 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.684 0.369 18518
1495 1 3 . 1 1 27 27 HIS CB C 27 30.747 30.747 29.697 1.050 18518
1496 1 3 . 1 1 27 27 HIS H H 27 8.284 8.284 8.149 0.135 18518
1497 1 3 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.498 0.083 18518
1498 1 3 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.535 0.384 18518
1499 1 3 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.280 0.175 18518
1500 1 3 . 1 1 29 29 THR N N 29 107.011 107.011 107.304 -0.293 18518
1501 1 3 . 1 1 29 29 THR HA H 29 4.599 4.599 4.340 0.259 18518
1502 1 3 . 1 1 29 29 THR C C 29 172.884 172.884 174.258 -1.374 18518
1503 1 3 . 1 1 29 29 THR CA C 29 60.810 60.810 61.692 -0.882 18518
1504 1 3 . 1 1 29 29 THR CB C 29 68.531 68.531 68.660 -0.129 18518
1505 1 3 . 1 1 29 29 THR H H 29 7.890 7.890 8.267 -0.377 18518
1506 1 3 . 1 1 30 30 LYS N N 30 117.679 117.679 121.019 -3.340 18518
1507 1 3 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.895 -0.037 18518
1508 1 3 . 1 1 30 30 LYS C C 30 174.310 174.310 174.727 -0.417 18518
1509 1 3 . 1 1 30 30 LYS CA C 30 53.751 53.751 53.962 -0.211 18518
1510 1 3 . 1 1 30 30 LYS CB C 30 35.804 35.804 35.584 0.220 18518
1511 1 3 . 1 1 30 30 LYS H H 30 7.441 7.441 7.512 -0.071 18518
1512 1 3 . 1 1 31 31 ILE N N 31 122.849 122.849 121.023 1.826 18518
1513 1 3 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.508 -0.403 18518
1514 1 3 . 1 1 31 31 ILE CA C 31 54.801 54.801 56.403 -1.602 18518
1515 1 3 . 1 1 31 31 ILE CB C 31 38.265 38.265 39.329 -1.064 18518
1516 1 3 . 1 1 31 31 ILE H H 31 9.304 9.304 8.966 0.338 18518
1517 1 3 . 1 1 32 32 PRO HA H 32 5.159 5.159 5.119 0.040 18518
1518 1 3 . 1 1 32 32 PRO C C 32 174.164 174.164 175.865 -1.701 18518
1519 1 3 . 1 1 32 32 PRO CA C 32 61.503 61.503 61.736 -0.233 18518
1520 1 3 . 1 1 32 32 PRO CB C 32 31.145 31.145 31.754 -0.609 18518
1521 1 3 . 1 1 33 33 VAL N N 33 125.606 125.606 124.399 1.207 18518
1522 1 3 . 1 1 33 33 VAL HA H 33 5.213 5.213 4.918 0.294 18518
1523 1 3 . 1 1 33 33 VAL C C 33 173.654 173.654 173.714 -0.060 18518
1524 1 3 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.179 0.865 18518
1525 1 3 . 1 1 33 33 VAL CB C 33 35.604 35.604 35.879 -0.275 18518
1526 1 3 . 1 1 33 33 VAL H H 33 9.424 9.424 8.676 0.748 18518
1527 1 3 . 1 1 34 34 ILE N N 34 128.241 128.241 126.372 1.869 18518
1528 1 3 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.725 0.108 18518
1529 1 3 . 1 1 34 34 ILE C C 34 175.605 175.605 174.733 0.872 18518
1530 1 3 . 1 1 34 34 ILE CA C 34 56.765 56.765 57.930 -1.165 18518
1531 1 3 . 1 1 34 34 ILE CB C 34 36.799 36.799 38.017 -1.218 18518
1532 1 3 . 1 1 34 34 ILE H H 34 8.721 8.721 9.044 -0.323 18518
1533 1 3 . 1 1 35 35 ILE N N 35 125.650 125.650 128.857 -3.207 18518
1534 1 3 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.613 0.223 18518
1535 1 3 . 1 1 35 35 ILE C C 35 174.887 174.887 174.399 0.488 18518
1536 1 3 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.452 0.493 18518
1537 1 3 . 1 1 35 35 ILE CB C 35 39.210 39.210 39.317 -0.107 18518
1538 1 3 . 1 1 35 35 ILE H H 35 9.034 9.034 9.019 0.015 18518
1539 1 3 . 1 1 36 36 GLU N N 36 122.657 122.657 127.749 -5.092 18518
1540 1 3 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.761 0.100 18518
1541 1 3 . 1 1 36 36 GLU C C 36 173.848 173.848 174.333 -0.485 18518
1542 1 3 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.049 -0.117 18518
1543 1 3 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.070 1.212 18518
1544 1 3 . 1 1 36 36 GLU H H 36 8.303 8.303 8.744 -0.441 18518
1545 1 3 . 1 1 37 37 ARG N N 37 123.228 123.228 124.008 -0.780 18518
1546 1 3 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.223 -0.497 18518
1547 1 3 . 1 1 37 37 ARG C C 37 176.359 176.359 175.761 0.598 18518
1548 1 3 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.081 0.278 18518
1549 1 3 . 1 1 37 37 ARG CB C 37 31.341 31.341 31.064 0.277 18518
1550 1 3 . 1 1 37 37 ARG H H 37 8.856 8.856 8.469 0.387 18518
1551 1 3 . 1 1 38 38 TYR N N 38 128.981 128.981 127.335 1.646 18518
1552 1 3 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.319 0.033 18518
1553 1 3 . 1 1 38 38 TYR C C 38 177.316 177.316 177.038 0.278 18518
1554 1 3 . 1 1 38 38 TYR CA C 38 57.712 57.712 58.506 -0.794 18518
1555 1 3 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.116 -0.644 18518
1556 1 3 . 1 1 38 38 TYR H H 38 8.628 8.628 8.488 0.140 18518
1557 1 3 . 1 1 39 39 LYS N N 39 130.635 130.635 125.577 5.058 18518
1558 1 3 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.757 0.065 18518
1559 1 3 . 1 1 39 39 LYS CA C 39 58.887 58.887 58.090 0.797 18518
1560 1 3 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.570 0.201 18518
1561 1 3 . 1 1 39 39 LYS H H 39 8.594 8.594 7.756 0.838 18518
1562 1 3 . 1 1 40 40 GLY C C 40 173.447 173.447 174.089 -0.642 18518
1563 1 3 . 1 1 40 40 GLY CA C 40 44.663 44.663 44.043 0.620 18518
1564 1 3 . 1 1 40 40 GLY H H 40 5.188 5.188 6.412 -1.224 18518
1565 1 3 . 1 1 41 41 GLU N N 41 122.836 122.836 120.413 2.423 18518
1566 1 3 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.334 -0.077 18518
1567 1 3 . 1 1 41 41 GLU C C 41 176.524 176.524 175.938 0.586 18518
1568 1 3 . 1 1 41 41 GLU CA C 41 56.525 56.525 57.292 -0.767 18518
1569 1 3 . 1 1 41 41 GLU CB C 41 30.985 30.985 30.054 0.931 18518
1570 1 3 . 1 1 41 41 GLU H H 41 7.380 7.380 7.315 0.065 18518
1571 1 3 . 1 1 42 42 LYS N N 42 124.040 124.040 123.562 0.478 18518
1572 1 3 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.521 0.154 18518
1573 1 3 . 1 1 42 42 LYS C C 42 177.538 177.538 177.491 0.047 18518
1574 1 3 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.861 -1.020 18518
1575 1 3 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.719 1.260 18518
1576 1 3 . 1 1 42 42 LYS H H 42 9.034 9.034 8.637 0.397 18518
1577 1 3 . 1 1 43 43 GLN N N 43 119.259 119.259 119.510 -0.251 18518
1578 1 3 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.271 0.271 18518
1579 1 3 . 1 1 43 43 GLN C C 43 177.336 177.336 176.206 1.130 18518
1580 1 3 . 1 1 43 43 GLN CA C 43 57.673 57.673 57.501 0.172 18518
1581 1 3 . 1 1 43 43 GLN CB C 43 30.782 30.782 29.063 1.719 18518
1582 1 3 . 1 1 43 43 GLN H H 43 8.435 8.435 8.389 0.046 18518
1583 1 3 . 1 1 44 44 LEU N N 44 120.760 120.760 121.878 -1.118 18518
1584 1 3 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.675 0.020 18518
1585 1 3 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.097 1.148 18518
1586 1 3 . 1 1 44 44 LEU CB C 44 43.596 43.596 42.543 1.053 18518
1587 1 3 . 1 1 44 44 LEU H H 44 9.126 9.126 7.735 1.391 18518
1588 1 3 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.617 0.100 18518
1589 1 3 . 1 1 45 45 PRO C C 45 175.797 175.797 176.574 -0.777 18518
1590 1 3 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.432 -0.321 18518
1591 1 3 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.586 0.007 18518
1592 1 3 . 1 1 46 46 VAL N N 46 119.052 119.052 121.555 -2.503 18518
1593 1 3 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.269 -0.402 18518
1594 1 3 . 1 1 46 46 VAL C C 46 175.640 175.640 176.189 -0.549 18518
1595 1 3 . 1 1 46 46 VAL CA C 46 62.944 62.944 62.018 0.926 18518
1596 1 3 . 1 1 46 46 VAL CB C 46 32.799 32.799 33.190 -0.391 18518
1597 1 3 . 1 1 46 46 VAL H H 46 8.543 8.543 8.213 0.330 18518
1598 1 3 . 1 1 47 47 LEU N N 47 130.203 130.203 127.264 2.939 18518
1599 1 3 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.481 -0.172 18518
1600 1 3 . 1 1 47 47 LEU C C 47 176.198 176.198 177.363 -1.165 18518
1601 1 3 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.340 -0.334 18518
1602 1 3 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.265 1.567 18518
1603 1 3 . 1 1 47 47 LEU H H 47 7.799 7.799 8.473 -0.674 18518
1604 1 3 . 1 1 48 48 ASP N N 48 122.403 122.403 121.598 0.805 18518
1605 1 3 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.542 -0.279 18518
1606 1 3 . 1 1 48 48 ASP C C 48 175.294 175.294 175.637 -0.343 18518
1607 1 3 . 1 1 48 48 ASP CA C 48 55.832 55.832 56.100 -0.268 18518
1608 1 3 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.385 -1.201 18518
1609 1 3 . 1 1 48 48 ASP H H 48 8.780 8.780 8.568 0.212 18518
1610 1 3 . 1 1 49 49 LYS N N 49 119.569 119.569 117.254 2.315 18518
1611 1 3 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.508 0.077 18518
1612 1 3 . 1 1 49 49 LYS C C 49 174.678 174.678 175.455 -0.777 18518
1613 1 3 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.564 -1.912 18518
1614 1 3 . 1 1 49 49 LYS CB C 49 35.945 35.945 35.229 0.716 18518
1615 1 3 . 1 1 49 49 LYS H H 49 7.280 7.280 8.030 -0.750 18518
1616 1 3 . 1 1 50 50 THR N N 50 110.862 110.862 109.393 1.469 18518
1617 1 3 . 1 1 50 50 THR HA H 50 4.811 4.811 4.765 0.046 18518
1618 1 3 . 1 1 50 50 THR C C 50 172.425 172.425 174.548 -2.123 18518
1619 1 3 . 1 1 50 50 THR CA C 50 62.645 62.645 61.928 0.717 18518
1620 1 3 . 1 1 50 50 THR CB C 50 71.648 71.648 69.890 1.758 18518
1621 1 3 . 1 1 50 50 THR H H 50 8.042 8.042 8.294 -0.252 18518
1622 1 3 . 1 1 51 51 LYS N N 51 120.008 120.008 122.791 -2.783 18518
1623 1 3 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.558 0.067 18518
1624 1 3 . 1 1 51 51 LYS C C 51 175.082 175.082 175.919 -0.837 18518
1625 1 3 . 1 1 51 51 LYS CA C 51 54.704 54.704 57.047 -2.343 18518
1626 1 3 . 1 1 51 51 LYS CB C 51 32.376 32.376 32.896 -0.520 18518
1627 1 3 . 1 1 51 51 LYS H H 51 7.119 7.119 7.751 -0.632 18518
1628 1 3 . 1 1 52 52 PHE N N 52 122.640 122.640 124.188 -1.548 18518
1629 1 3 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.737 0.600 18518
1630 1 3 . 1 1 52 52 PHE C C 52 174.213 174.213 174.038 0.175 18518
1631 1 3 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.998 -0.387 18518
1632 1 3 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.404 -0.264 18518
1633 1 3 . 1 1 52 52 PHE H H 52 9.709 9.709 9.217 0.492 18518
1634 1 3 . 1 1 53 53 LEU N N 53 122.157 122.157 122.717 -0.560 18518
1635 1 3 . 1 1 53 53 LEU HA H 53 4.947 4.947 5.246 -0.299 18518
1636 1 3 . 1 1 53 53 LEU C C 53 175.769 175.769 175.498 0.271 18518
1637 1 3 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.684 -0.727 18518
1638 1 3 . 1 1 53 53 LEU CB C 53 44.415 44.415 44.284 0.131 18518
1639 1 3 . 1 1 53 53 LEU H H 53 8.959 8.959 8.391 0.568 18518
1640 1 3 . 1 1 54 54 VAL N N 54 124.919 124.919 122.746 2.173 18518
1641 1 3 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.531 0.028 18518
1642 1 3 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.250 0.880 18518
1643 1 3 . 1 1 54 54 VAL CB C 54 34.968 34.968 34.744 0.224 18518
1644 1 3 . 1 1 54 54 VAL H H 54 8.922 8.922 8.777 0.145 18518
1645 1 3 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.897 -0.456 18518
1646 1 3 . 1 1 55 55 PRO C C 55 176.594 176.594 177.690 -1.096 18518
1647 1 3 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.044 2.271 18518
1648 1 3 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.372 0.293 18518
1649 1 3 . 1 1 56 56 ASP N N 56 120.522 120.522 121.038 -0.516 18518
1650 1 3 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.277 -0.415 18518
1651 1 3 . 1 1 56 56 ASP C C 56 175.809 175.809 176.123 -0.314 18518
1652 1 3 . 1 1 56 56 ASP CA C 56 56.749 56.749 56.519 0.230 18518
1653 1 3 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.496 0.014 18518
1654 1 3 . 1 1 56 56 ASP H H 56 8.347 8.347 8.236 0.112 18518
1655 1 3 . 1 1 57 57 HIS N N 57 113.482 113.482 114.266 -0.784 18518
1656 1 3 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.676 0.044 18518
1657 1 3 . 1 1 57 57 HIS C C 57 176.507 176.507 175.175 1.332 18518
1658 1 3 . 1 1 57 57 HIS CA C 57 55.589 55.589 55.300 0.289 18518
1659 1 3 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.113 1.530 18518
1660 1 3 . 1 1 57 57 HIS H H 57 7.557 7.557 7.806 -0.249 18518
1661 1 3 . 1 1 58 58 VAL N N 58 123.279 123.279 121.408 1.871 18518
1662 1 3 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.177 -0.341 18518
1663 1 3 . 1 1 58 58 VAL C C 58 175.019 175.019 174.560 0.459 18518
1664 1 3 . 1 1 58 58 VAL CA C 58 62.823 62.823 60.876 1.947 18518
1665 1 3 . 1 1 58 58 VAL CB C 58 32.310 32.310 34.147 -1.837 18518
1666 1 3 . 1 1 58 58 VAL H H 58 7.345 7.345 7.499 -0.154 18518
1667 1 3 . 1 1 59 59 ASN N N 59 123.781 123.781 122.150 1.631 18518
1668 1 3 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.160 -0.034 18518
1669 1 3 . 1 1 59 59 ASN C C 59 176.558 176.558 176.495 0.063 18518
1670 1 3 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.881 -0.396 18518
1671 1 3 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.536 -0.429 18518
1672 1 3 . 1 1 59 59 ASN H H 59 8.735 8.735 8.453 0.282 18518
1673 1 3 . 1 1 60 60 MET N N 60 117.453 117.453 119.571 -2.118 18518
1674 1 3 . 1 1 60 60 MET HA H 60 4.395 4.395 4.097 0.298 18518
1675 1 3 . 1 1 60 60 MET C C 60 178.144 178.144 178.131 0.013 18518
1676 1 3 . 1 1 60 60 MET CA C 60 57.097 57.097 57.342 -0.244 18518
1677 1 3 . 1 1 60 60 MET CB C 60 30.140 30.140 30.755 -0.615 18518
1678 1 3 . 1 1 60 60 MET H H 60 8.227 8.227 8.868 -0.641 18518
1679 1 3 . 1 1 61 61 SER N N 61 114.216 114.216 115.372 -1.156 18518
1680 1 3 . 1 1 61 61 SER HA H 61 4.111 4.111 4.049 0.062 18518
1681 1 3 . 1 1 61 61 SER C C 61 177.335 177.335 176.388 0.947 18518
1682 1 3 . 1 1 61 61 SER CA C 61 61.590 61.590 62.527 -0.937 18518
1683 1 3 . 1 1 61 61 SER CB C 61 62.402 62.402 62.886 -0.485 18518
1684 1 3 . 1 1 61 61 SER H H 61 8.464 8.464 8.507 -0.043 18518
1685 1 3 . 1 1 62 62 GLU N N 62 123.004 123.004 121.483 1.521 18518
1686 1 3 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.102 -0.055 18518
1687 1 3 . 1 1 62 62 GLU C C 62 178.686 178.686 178.663 0.023 18518
1688 1 3 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.847 -0.222 18518
1689 1 3 . 1 1 62 62 GLU CB C 62 29.654 29.654 28.916 0.738 18518
1690 1 3 . 1 1 62 62 GLU H H 62 7.994 7.994 7.781 0.213 18518
1691 1 3 . 1 1 63 63 LEU N N 63 120.818 120.818 121.900 -1.082 18518
1692 1 3 . 1 1 63 63 LEU HA H 63 3.965 3.965 4.001 -0.036 18518
1693 1 3 . 1 1 63 63 LEU C C 63 178.046 178.046 178.520 -0.474 18518
1694 1 3 . 1 1 63 63 LEU CA C 63 57.920 57.920 57.920 -0.000 18518
1695 1 3 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.396 0.228 18518
1696 1 3 . 1 1 63 63 LEU H H 63 8.130 8.130 7.834 0.296 18518
1697 1 3 . 1 1 64 64 ILE N N 64 118.528 118.528 120.409 -1.881 18518
1698 1 3 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.520 -0.151 18518
1699 1 3 . 1 1 64 64 ILE C C 64 177.127 177.127 177.580 -0.453 18518
1700 1 3 . 1 1 64 64 ILE CA C 64 66.678 66.678 66.337 0.341 18518
1701 1 3 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.731 0.713 18518
1702 1 3 . 1 1 64 64 ILE H H 64 8.488 8.488 8.625 -0.137 18518
1703 1 3 . 1 1 65 65 LYS N N 65 118.336 118.336 120.522 -2.186 18518
1704 1 3 . 1 1 65 65 LYS HA H 65 3.701 3.701 3.871 -0.170 18518
1705 1 3 . 1 1 65 65 LYS C C 65 179.291 179.291 179.090 0.201 18518
1706 1 3 . 1 1 65 65 LYS CA C 65 60.440 60.440 60.016 0.424 18518
1707 1 3 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.298 0.073 18518
1708 1 3 . 1 1 65 65 LYS H H 65 7.347 7.347 7.631 -0.284 18518
1709 1 3 . 1 1 66 66 ILE N N 66 120.171 120.171 119.999 0.172 18518
1710 1 3 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.632 -0.054 18518
1711 1 3 . 1 1 66 66 ILE C C 66 178.873 178.873 178.124 0.749 18518
1712 1 3 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.395 -0.235 18518
1713 1 3 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.994 0.639 18518
1714 1 3 . 1 1 66 66 ILE H H 66 7.901 7.901 8.179 -0.278 18518
1715 1 3 . 1 1 67 67 ILE N N 67 121.185 121.185 120.379 0.806 18518
1716 1 3 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.531 -0.085 18518
1717 1 3 . 1 1 67 67 ILE C C 67 177.150 177.150 177.657 -0.507 18518
1718 1 3 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.741 -1.935 18518
1719 1 3 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.499 -2.505 18518
1720 1 3 . 1 1 67 67 ILE H H 67 8.290 8.290 8.015 0.275 18518
1721 1 3 . 1 1 68 68 ARG N N 68 119.173 119.173 118.505 0.668 18518
1722 1 3 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.655 -0.724 18518
1723 1 3 . 1 1 68 68 ARG C C 68 178.496 178.496 178.472 0.024 18518
1724 1 3 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.600 1.036 18518
1725 1 3 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.589 0.851 18518
1726 1 3 . 1 1 68 68 ARG H H 68 8.438 8.438 8.345 0.093 18518
1727 1 3 . 1 1 69 69 ARG N N 69 116.511 116.511 120.180 -3.669 18518
1728 1 3 . 1 1 69 69 ARG HA H 69 4.134 4.134 3.950 0.184 18518
1729 1 3 . 1 1 69 69 ARG C C 69 180.262 180.262 179.083 1.179 18518
1730 1 3 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.716 -1.009 18518
1731 1 3 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.211 -0.258 18518
1732 1 3 . 1 1 69 69 ARG H H 69 7.497 7.497 8.396 -0.899 18518
1733 1 3 . 1 1 70 70 ARG N N 70 123.297 123.297 119.819 3.478 18518
1734 1 3 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.101 -0.085 18518
1735 1 3 . 1 1 70 70 ARG C C 70 178.700 178.700 178.274 0.426 18518
1736 1 3 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.758 0.702 18518
1737 1 3 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.609 0.703 18518
1738 1 3 . 1 1 70 70 ARG H H 70 8.075 8.075 7.969 0.106 18518
1739 1 3 . 1 1 71 71 LEU N N 71 116.829 116.829 117.703 -0.874 18518
1740 1 3 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.260 -0.195 18518
1741 1 3 . 1 1 71 71 LEU C C 71 174.956 174.956 176.056 -1.100 18518
1742 1 3 . 1 1 71 71 LEU CA C 71 55.126 55.126 55.011 0.115 18518
1743 1 3 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.037 1.209 18518
1744 1 3 . 1 1 71 71 LEU H H 71 7.719 7.719 7.643 0.076 18518
1745 1 3 . 1 1 72 72 GLN N N 72 114.991 114.991 113.122 1.869 18518
1746 1 3 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.868 -0.032 18518
1747 1 3 . 1 1 72 72 GLN C C 72 175.683 175.683 175.402 0.281 18518
1748 1 3 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.266 0.059 18518
1749 1 3 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.576 0.428 18518
1750 1 3 . 1 1 72 72 GLN H H 72 7.744 7.744 7.666 0.078 18518
1751 1 3 . 1 1 73 73 LEU N N 73 115.045 115.045 119.384 -4.339 18518
1752 1 3 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.009 0.227 18518
1753 1 3 . 1 1 73 73 LEU C C 73 178.762 178.762 176.823 1.939 18518
1754 1 3 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.492 -1.106 18518
1755 1 3 . 1 1 73 73 LEU CB C 73 42.091 42.091 42.073 0.018 18518
1756 1 3 . 1 1 73 73 LEU H H 73 7.500 7.500 7.876 -0.376 18518
1757 1 3 . 1 1 74 74 ASN N N 74 121.700 121.700 124.041 -2.341 18518
1758 1 3 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.482 0.208 18518
1759 1 3 . 1 1 74 74 ASN C C 74 176.617 176.617 175.910 0.707 18518
1760 1 3 . 1 1 74 74 ASN CA C 74 52.685 52.685 54.184 -1.498 18518
1761 1 3 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.713 -0.115 18518
1762 1 3 . 1 1 74 74 ASN H H 74 9.045 9.045 8.373 0.672 18518
1763 1 3 . 1 1 75 75 ALA N N 75 123.952 123.952 123.953 -0.001 18518
1764 1 3 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.323 -0.359 18518
1765 1 3 . 1 1 75 75 ALA C C 75 178.131 178.131 176.892 1.239 18518
1766 1 3 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.008 1.860 18518
1767 1 3 . 1 1 75 75 ALA CB C 75 18.718 18.718 18.820 -0.102 18518
1768 1 3 . 1 1 75 75 ALA H H 75 8.784 8.784 8.617 0.167 18518
1769 1 3 . 1 1 76 76 ASN N N 76 112.295 112.295 114.633 -2.338 18518
1770 1 3 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.732 -0.152 18518
1771 1 3 . 1 1 76 76 ASN C C 76 175.448 175.448 174.717 0.731 18518
1772 1 3 . 1 1 76 76 ASN CA C 76 53.214 53.214 52.957 0.257 18518
1773 1 3 . 1 1 76 76 ASN CB C 76 38.320 38.320 39.874 -1.554 18518
1774 1 3 . 1 1 76 76 ASN H H 76 8.391 8.391 8.313 0.078 18518
1775 1 3 . 1 1 77 77 GLN N N 77 120.577 120.577 119.638 0.939 18518
1776 1 3 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.688 -0.415 18518
1777 1 3 . 1 1 77 77 GLN C C 77 175.045 175.045 173.863 1.182 18518
1778 1 3 . 1 1 77 77 GLN CA C 77 55.805 55.805 55.011 0.794 18518
1779 1 3 . 1 1 77 77 GLN CB C 77 30.157 30.157 30.766 -0.609 18518
1780 1 3 . 1 1 77 77 GLN H H 77 7.552 7.552 7.503 0.049 18518
1781 1 3 . 1 1 78 78 ALA N N 78 130.670 130.670 123.751 6.919 18518
1782 1 3 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.584 -0.413 18518
1783 1 3 . 1 1 78 78 ALA C C 78 176.512 176.512 175.400 1.112 18518
1784 1 3 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.320 1.522 18518
1785 1 3 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.469 -1.409 18518
1786 1 3 . 1 1 78 78 ALA H H 78 8.799 8.799 8.706 0.093 18518
1787 1 3 . 1 1 79 79 PHE N N 79 119.325 119.325 117.468 1.857 18518
1788 1 3 . 1 1 79 79 PHE HA H 79 4.434 4.434 5.266 -0.832 18518
1789 1 3 . 1 1 79 79 PHE C C 79 171.726 171.726 172.586 -0.860 18518
1790 1 3 . 1 1 79 79 PHE CA C 79 59.145 59.145 55.337 3.808 18518
1791 1 3 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.916 0.255 18518
1792 1 3 . 1 1 79 79 PHE H H 79 7.664 7.664 8.283 -0.619 18518
1793 1 3 . 1 1 80 80 PHE N N 80 126.314 126.314 116.698 9.616 18518
1794 1 3 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.579 -0.187 18518
1795 1 3 . 1 1 80 80 PHE C C 80 177.169 177.169 173.341 3.828 18518
1796 1 3 . 1 1 80 80 PHE CA C 80 56.653 56.653 55.636 1.017 18518
1797 1 3 . 1 1 80 80 PHE CB C 80 41.933 41.933 42.756 -0.823 18518
1798 1 3 . 1 1 80 80 PHE H H 80 8.508 8.508 8.671 -0.163 18518
1799 1 3 . 1 1 81 81 LEU N N 81 121.426 121.426 122.822 -1.396 18518
1800 1 3 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.085 -0.234 18518
1801 1 3 . 1 1 81 81 LEU C C 81 174.488 174.488 174.948 -0.460 18518
1802 1 3 . 1 1 81 81 LEU CA C 81 53.197 53.197 54.026 -0.829 18518
1803 1 3 . 1 1 81 81 LEU CB C 81 45.100 45.100 44.118 0.982 18518
1804 1 3 . 1 1 81 81 LEU H H 81 8.229 8.229 8.349 -0.120 18518
1805 1 3 . 1 1 82 82 LEU N N 82 125.155 125.155 127.148 -1.993 18518
1806 1 3 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.542 0.291 18518
1807 1 3 . 1 1 82 82 LEU C C 82 177.166 177.166 175.407 1.759 18518
1808 1 3 . 1 1 82 82 LEU CA C 82 54.197 54.197 54.131 0.066 18518
1809 1 3 . 1 1 82 82 LEU CB C 82 43.442 43.442 43.530 -0.088 18518
1810 1 3 . 1 1 82 82 LEU H H 82 9.400 9.400 8.897 0.503 18518
1811 1 3 . 1 1 83 83 VAL N N 83 123.886 123.886 120.006 3.880 18518
1812 1 3 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.436 -0.057 18518
1813 1 3 . 1 1 83 83 VAL C C 83 175.810 175.810 176.550 -0.740 18518
1814 1 3 . 1 1 83 83 VAL CA C 83 61.677 61.677 61.417 0.260 18518
1815 1 3 . 1 1 83 83 VAL CB C 83 33.758 33.758 33.119 0.639 18518
1816 1 3 . 1 1 83 83 VAL H H 83 8.721 8.721 8.309 0.412 18518
1817 1 3 . 1 1 84 84 ASN N N 84 126.474 126.474 126.502 -0.028 18518
1818 1 3 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.433 -0.037 18518
1819 1 3 . 1 1 84 84 ASN C C 84 175.164 175.164 175.174 -0.010 18518
1820 1 3 . 1 1 84 84 ASN CA C 84 54.738 54.738 55.248 -0.510 18518
1821 1 3 . 1 1 84 84 ASN CB C 84 37.950 37.950 38.486 -0.536 18518
1822 1 3 . 1 1 84 84 ASN H H 84 9.707 9.707 9.535 0.172 18518
1823 1 3 . 1 1 85 85 GLY N N 85 101.296 101.296 105.226 -3.930 18518
1824 1 3 . 1 1 85 85 GLY C C 85 173.680 173.680 173.340 0.340 18518
1825 1 3 . 1 1 85 85 GLY CA C 85 45.603 45.603 45.037 0.566 18518
1826 1 3 . 1 1 85 85 GLY H H 85 8.644 8.644 8.395 0.249 18518
1827 1 3 . 1 1 86 86 HIS N N 86 117.238 117.238 116.928 0.310 18518
1828 1 3 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.956 0.061 18518
1829 1 3 . 1 1 86 86 HIS C C 86 173.841 173.841 174.134 -0.293 18518
1830 1 3 . 1 1 86 86 HIS CA C 86 53.796 53.796 53.349 0.447 18518
1831 1 3 . 1 1 86 86 HIS CB C 86 31.280 31.280 31.837 -0.557 18518
1832 1 3 . 1 1 86 86 HIS H H 86 7.918 7.918 8.249 -0.331 18518
1833 1 3 . 1 1 87 87 SER N N 87 118.179 118.179 120.164 -1.985 18518
1834 1 3 . 1 1 87 87 SER HA H 87 4.699 4.699 4.513 0.186 18518
1835 1 3 . 1 1 87 87 SER C C 87 175.904 175.904 174.510 1.394 18518
1836 1 3 . 1 1 87 87 SER CA C 87 58.271 58.271 57.900 0.371 18518
1837 1 3 . 1 1 87 87 SER CB C 87 63.735 63.735 62.355 1.379 18518
1838 1 3 . 1 1 87 87 SER H H 87 8.977 8.977 8.852 0.125 18518
1839 1 3 . 1 1 88 88 MET N N 88 125.472 125.472 121.750 3.722 18518
1840 1 3 . 1 1 88 88 MET HA H 88 4.830 4.830 4.613 0.217 18518
1841 1 3 . 1 1 88 88 MET C C 88 176.419 176.419 174.878 1.541 18518
1842 1 3 . 1 1 88 88 MET CA C 88 54.899 54.899 55.676 -0.777 18518
1843 1 3 . 1 1 88 88 MET CB C 88 33.336 33.336 33.924 -0.588 18518
1844 1 3 . 1 1 88 88 MET H H 88 9.184 9.184 8.281 0.903 18518
1845 1 3 . 1 1 89 89 VAL N N 89 120.747 120.747 120.114 0.633 18518
1846 1 3 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.289 -0.057 18518
1847 1 3 . 1 1 89 89 VAL C C 89 175.958 175.958 175.662 0.296 18518
1848 1 3 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.263 1.891 18518
1849 1 3 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.683 -1.805 18518
1850 1 3 . 1 1 89 89 VAL H H 89 8.233 8.233 7.502 0.731 18518
1851 1 3 . 1 1 90 90 SER N N 90 117.362 117.362 119.120 -1.758 18518
1852 1 3 . 1 1 90 90 SER HA H 90 4.590 4.590 4.541 0.049 18518
1853 1 3 . 1 1 90 90 SER C C 90 175.741 175.741 175.624 0.117 18518
1854 1 3 . 1 1 90 90 SER CA C 90 57.717 57.717 58.110 -0.393 18518
1855 1 3 . 1 1 90 90 SER CB C 90 63.223 63.223 64.056 -0.833 18518
1856 1 3 . 1 1 90 90 SER H H 90 8.482 8.482 8.454 0.028 18518
1857 1 3 . 1 1 91 91 VAL N N 91 120.466 120.466 118.745 1.721 18518
1858 1 3 . 1 1 91 91 VAL HA H 91 4.047 4.047 4.134 -0.087 18518
1859 1 3 . 1 1 91 91 VAL C C 91 176.329 176.329 176.213 0.116 18518
1860 1 3 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.279 -0.787 18518
1861 1 3 . 1 1 91 91 VAL CB C 91 32.568 32.568 32.114 0.454 18518
1862 1 3 . 1 1 91 91 VAL H H 91 8.188 8.188 8.594 -0.406 18518
1863 1 3 . 1 1 92 92 SER N N 92 116.398 116.398 117.165 -0.767 18518
1864 1 3 . 1 1 92 92 SER HA H 92 4.636 4.636 4.412 0.224 18518
1865 1 3 . 1 1 92 92 SER C C 92 174.159 174.159 174.596 -0.437 18518
1866 1 3 . 1 1 92 92 SER CA C 92 57.805 57.805 59.437 -1.632 18518
1867 1 3 . 1 1 92 92 SER CB C 92 63.046 63.046 62.810 0.236 18518
1868 1 3 . 1 1 92 92 SER H H 92 8.370 8.370 8.487 -0.117 18518
1869 1 3 . 1 1 93 93 THR N N 93 119.211 119.211 116.878 2.333 18518
1870 1 3 . 1 1 93 93 THR HA H 93 4.484 4.484 4.520 -0.036 18518
1871 1 3 . 1 1 93 93 THR CA C 93 60.884 60.884 60.722 0.162 18518
1872 1 3 . 1 1 93 93 THR CB C 93 70.609 70.609 68.570 2.038 18518
1873 1 3 . 1 1 93 93 THR H H 93 7.416 7.416 7.402 0.014 18518
1874 1 3 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.906 -0.466 18518
1875 1 3 . 1 1 94 94 PRO C C 94 178.775 178.775 177.336 1.439 18518
1876 1 3 . 1 1 94 94 PRO CA C 94 62.943 62.943 61.741 1.202 18518
1877 1 3 . 1 1 94 94 PRO CB C 94 32.649 32.649 33.568 -0.919 18518
1878 1 3 . 1 1 95 95 ILE N N 95 124.174 124.174 122.159 2.015 18518
1879 1 3 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.874 0.075 18518
1880 1 3 . 1 1 95 95 ILE C C 95 176.498 176.498 176.867 -0.369 18518
1881 1 3 . 1 1 95 95 ILE CA C 95 63.904 63.904 63.415 0.489 18518
1882 1 3 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.273 -0.091 18518
1883 1 3 . 1 1 95 95 ILE H H 95 9.305 9.305 8.407 0.898 18518
1884 1 3 . 1 1 96 96 SER N N 96 116.920 116.920 117.082 -0.162 18518
1885 1 3 . 1 1 96 96 SER HA H 96 4.029 4.029 4.119 -0.090 18518
1886 1 3 . 1 1 96 96 SER C C 96 176.574 176.574 176.291 0.283 18518
1887 1 3 . 1 1 96 96 SER CA C 96 61.356 61.356 61.979 -0.623 18518
1888 1 3 . 1 1 96 96 SER CB C 96 61.723 61.723 62.366 -0.643 18518
1889 1 3 . 1 1 96 96 SER H H 96 8.335 8.335 8.372 -0.037 18518
1890 1 3 . 1 1 97 97 GLU N N 97 123.255 123.255 122.917 0.338 18518
1891 1 3 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.355 -0.077 18518
1892 1 3 . 1 1 97 97 GLU C C 97 179.716 179.716 179.165 0.551 18518
1893 1 3 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.715 0.077 18518
1894 1 3 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.198 0.364 18518
1895 1 3 . 1 1 97 97 GLU H H 97 7.376 7.376 7.963 -0.587 18518
1896 1 3 . 1 1 98 98 VAL N N 98 121.137 121.137 120.880 0.257 18518
1897 1 3 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.658 0.144 18518
1898 1 3 . 1 1 98 98 VAL C C 98 177.637 177.637 178.026 -0.389 18518
1899 1 3 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.219 -0.395 18518
1900 1 3 . 1 1 98 98 VAL CB C 98 32.154 32.154 30.716 1.438 18518
1901 1 3 . 1 1 98 98 VAL H H 98 7.387 7.387 7.890 -0.503 18518
1902 1 3 . 1 1 99 99 TYR N N 99 118.927 118.927 121.702 -2.775 18518
1903 1 3 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.075 -0.085 18518
1904 1 3 . 1 1 99 99 TYR C C 99 176.081 176.081 176.799 -0.718 18518
1905 1 3 . 1 1 99 99 TYR CA C 99 62.223 62.223 61.553 0.670 18518
1906 1 3 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.369 0.613 18518
1907 1 3 . 1 1 99 99 TYR H H 99 9.048 9.048 8.478 0.570 18518
1908 1 3 . 1 1 100 100 GLU N N 100 113.894 113.894 116.476 -2.582 18518
1909 1 3 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.456 0.390 18518
1910 1 3 . 1 1 100 100 GLU C C 100 177.989 177.989 178.174 -0.185 18518
1911 1 3 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.477 0.610 18518
1912 1 3 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.767 0.615 18518
1913 1 3 . 1 1 100 100 GLU H H 100 7.422 7.422 8.114 -0.692 18518
1914 1 3 . 1 1 101 101 SER N N 101 108.991 108.991 114.083 -5.092 18518
1915 1 3 . 1 1 101 101 SER HA H 101 4.524 4.524 4.431 0.093 18518
1916 1 3 . 1 1 101 101 SER C C 101 176.628 176.628 175.456 1.172 18518
1917 1 3 . 1 1 101 101 SER CA C 101 60.349 60.349 60.329 0.020 18518
1918 1 3 . 1 1 101 101 SER CB C 101 64.741 64.741 63.946 0.795 18518
1919 1 3 . 1 1 101 101 SER H H 101 7.424 7.424 7.735 -0.311 18518
1920 1 3 . 1 1 102 102 GLU N N 102 116.533 116.533 118.917 -2.384 18518
1921 1 3 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.587 0.157 18518
1922 1 3 . 1 1 102 102 GLU C C 102 176.774 176.774 175.605 1.169 18518
1923 1 3 . 1 1 102 102 GLU CA C 102 55.581 55.581 55.822 -0.241 18518
1924 1 3 . 1 1 102 102 GLU CB C 102 30.697 30.697 30.956 -0.259 18518
1925 1 3 . 1 1 102 102 GLU H H 102 8.487 8.487 7.782 0.705 18518
1926 1 3 . 1 1 103 103 LYS N N 103 118.370 118.370 120.089 -1.719 18518
1927 1 3 . 1 1 103 103 LYS HA H 103 4.178 4.178 4.070 0.108 18518
1928 1 3 . 1 1 103 103 LYS C C 103 175.018 175.018 176.484 -1.466 18518
1929 1 3 . 1 1 103 103 LYS CA C 103 57.329 57.329 56.868 0.461 18518
1930 1 3 . 1 1 103 103 LYS CB C 103 32.186 32.186 31.922 0.264 18518
1931 1 3 . 1 1 103 103 LYS H H 103 7.831 7.831 7.684 0.147 18518
1932 1 3 . 1 1 104 104 ASP N N 104 123.500 123.500 124.320 -0.820 18518
1933 1 3 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.641 0.114 18518
1934 1 3 . 1 1 104 104 ASP C C 104 177.383 177.383 177.561 -0.178 18518
1935 1 3 . 1 1 104 104 ASP CA C 104 53.846 53.846 53.735 0.111 18518
1936 1 3 . 1 1 104 104 ASP CB C 104 43.411 43.411 43.458 -0.047 18518
1937 1 3 . 1 1 104 104 ASP H H 104 9.041 9.041 8.235 0.806 18518
1938 1 3 . 1 1 105 105 GLU N N 105 125.448 125.448 120.035 5.413 18518
1939 1 3 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.181 -0.001 18518
1940 1 3 . 1 1 105 105 GLU C C 105 177.519 177.519 177.020 0.499 18518
1941 1 3 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.475 1.054 18518
1942 1 3 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.421 0.623 18518
1943 1 3 . 1 1 105 105 GLU H H 105 8.906 8.906 8.844 0.062 18518
1944 1 3 . 1 1 106 106 ASP N N 106 118.824 118.824 117.676 1.148 18518
1945 1 3 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.653 -0.474 18518
1946 1 3 . 1 1 106 106 ASP C C 106 176.223 176.223 177.434 -1.211 18518
1947 1 3 . 1 1 106 106 ASP CA C 106 54.756 54.756 53.733 1.024 18518
1948 1 3 . 1 1 106 106 ASP CB C 106 39.999 39.999 41.212 -1.213 18518
1949 1 3 . 1 1 106 106 ASP H H 106 10.036 10.036 8.538 1.498 18518
1950 1 3 . 1 1 107 107 GLY N N 107 105.866 105.866 106.735 -0.869 18518
1951 1 3 . 1 1 107 107 GLY C C 107 175.136 175.136 174.505 0.631 18518
1952 1 3 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.297 -0.076 18518
1953 1 3 . 1 1 107 107 GLY H H 107 8.001 8.001 8.175 -0.174 18518
1954 1 3 . 1 1 108 108 PHE N N 108 123.820 123.820 121.226 2.594 18518
1955 1 3 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.419 0.243 18518
1956 1 3 . 1 1 108 108 PHE C C 108 174.899 174.899 175.711 -0.812 18518
1957 1 3 . 1 1 108 108 PHE CA C 108 60.238 60.238 59.588 0.650 18518
1958 1 3 . 1 1 108 108 PHE CB C 108 40.365 40.365 39.807 0.558 18518
1959 1 3 . 1 1 108 108 PHE H H 108 9.912 9.912 8.857 1.055 18518
1960 1 3 . 1 1 109 109 LEU N N 109 120.130 120.130 125.367 -5.237 18518
1961 1 3 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.833 0.197 18518
1962 1 3 . 1 1 109 109 LEU C C 109 173.916 173.916 175.240 -1.324 18518
1963 1 3 . 1 1 109 109 LEU CA C 109 53.424 53.424 54.169 -0.745 18518
1964 1 3 . 1 1 109 109 LEU CB C 109 45.203 45.203 43.509 1.694 18518
1965 1 3 . 1 1 109 109 LEU H H 109 7.997 7.997 8.573 -0.576 18518
1966 1 3 . 1 1 110 110 TYR N N 110 126.579 126.579 126.167 0.412 18518
1967 1 3 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.631 0.372 18518
1968 1 3 . 1 1 110 110 TYR C C 110 176.671 176.671 175.298 1.373 18518
1969 1 3 . 1 1 110 110 TYR CA C 110 59.058 59.058 58.805 0.253 18518
1970 1 3 . 1 1 110 110 TYR CB C 110 39.556 39.556 38.756 0.800 18518
1971 1 3 . 1 1 110 110 TYR H H 110 9.377 9.377 9.013 0.364 18518
1972 1 3 . 1 1 111 111 MET N N 111 119.240 119.240 121.525 -2.285 18518
1973 1 3 . 1 1 111 111 MET HA H 111 5.486 5.486 5.337 0.149 18518
1974 1 3 . 1 1 111 111 MET C C 111 175.695 175.695 174.664 1.031 18518
1975 1 3 . 1 1 111 111 MET CA C 111 54.124 54.124 54.562 -0.438 18518
1976 1 3 . 1 1 111 111 MET CB C 111 36.960 36.960 37.419 -0.459 18518
1977 1 3 . 1 1 111 111 MET H H 111 9.658 9.658 9.219 0.439 18518
1978 1 3 . 1 1 112 112 VAL N N 112 119.865 119.865 116.189 3.676 18518
1979 1 3 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.562 0.401 18518
1980 1 3 . 1 1 112 112 VAL C C 112 175.058 175.058 174.351 0.707 18518
1981 1 3 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.320 -0.409 18518
1982 1 3 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.284 0.767 18518
1983 1 3 . 1 1 112 112 VAL H H 112 8.794 8.794 9.118 -0.324 18518
1984 1 3 . 1 1 113 113 TYR N N 113 119.664 119.664 118.447 1.217 18518
1985 1 3 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.504 0.614 18518
1986 1 3 . 1 1 113 113 TYR C C 113 173.375 173.375 173.262 0.113 18518
1987 1 3 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.283 -1.130 18518
1988 1 3 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.765 1.547 18518
1989 1 3 . 1 1 113 113 TYR H H 113 8.315 8.315 8.353 -0.038 18518
1990 1 3 . 1 1 114 114 ALA N N 114 119.763 119.763 122.097 -2.334 18518
1991 1 3 . 1 1 114 114 ALA HA H 114 4.800 4.800 5.326 -0.526 18518
1992 1 3 . 1 1 114 114 ALA C C 114 176.216 176.216 175.168 1.048 18518
1993 1 3 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.991 -0.859 18518
1994 1 3 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.349 2.247 18518
1995 1 3 . 1 1 114 114 ALA H H 114 8.465 8.465 8.624 -0.159 18518
1996 1 3 . 1 1 115 115 SER N N 115 114.763 114.763 115.456 -0.693 18518
1997 1 3 . 1 1 115 115 SER HA H 115 4.496 4.496 4.912 -0.416 18518
1998 1 3 . 1 1 115 115 SER C C 115 172.671 172.671 173.688 -1.017 18518
1999 1 3 . 1 1 115 115 SER CA C 115 58.651 58.651 57.524 1.127 18518
2000 1 3 . 1 1 115 115 SER CB C 115 63.526 63.526 62.301 1.225 18518
2001 1 3 . 1 1 115 115 SER H H 115 9.915 9.915 8.698 1.217 18518
2002 1 3 . 1 1 116 116 GLN N N 116 116.611 116.611 123.053 -6.442 18518
2003 1 3 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.484 0.000 18518
2004 1 3 . 1 1 116 116 GLN C C 116 172.733 172.733 173.659 -0.926 18518
2005 1 3 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.601 -1.675 18518
2006 1 3 . 1 1 116 116 GLN CB C 116 32.358 32.358 31.396 0.962 18518
2007 1 3 . 1 1 116 116 GLN H H 116 7.219 7.219 7.985 -0.766 18518
2008 1 3 . 1 1 117 117 GLU N N 117 117.623 117.623 120.776 -3.153 18518
2009 1 3 . 1 1 117 117 GLU HA H 117 3.287 3.287 2.539 0.748 18518
2010 1 3 . 1 1 117 117 GLU C C 117 175.168 175.168 175.291 -0.123 18518
2011 1 3 . 1 1 117 117 GLU CA C 117 56.882 56.882 57.094 -0.212 18518
2012 1 3 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.758 0.764 18518
2013 1 3 . 1 1 117 117 GLU H H 117 7.882 7.882 8.547 -0.665 18518
2014 1 3 . 1 1 118 118 THR N N 118 109.820 109.820 109.065 0.755 18518
2015 1 3 . 1 1 118 118 THR HA H 118 4.066 4.066 4.177 -0.111 18518
2016 1 3 . 1 1 118 118 THR C C 118 172.355 172.355 173.220 -0.865 18518
2017 1 3 . 1 1 118 118 THR CA C 118 60.029 60.029 60.575 -0.546 18518
2018 1 3 . 1 1 118 118 THR CB C 118 70.480 70.480 70.260 0.220 18518
2019 1 3 . 1 1 118 118 THR H H 118 6.992 6.992 7.163 -0.171 18518
2020 1 4 . 1 1 2 2 ALA HA H 2 4.336 4.336 5.140 -0.804 18518
2021 1 4 . 1 1 2 2 ALA C C 2 177.974 177.974 176.669 1.305 18518
2022 1 4 . 1 1 2 2 ALA CA C 2 52.785 52.785 52.158 0.627 18518
2023 1 4 . 1 1 2 2 ALA CB C 2 19.444 19.444 20.225 -0.781 18518
2024 1 4 . 1 1 3 3 MET N N 3 119.311 119.311 121.355 -2.044 18518
2025 1 4 . 1 1 3 3 MET HA H 3 4.451 4.451 4.610 -0.159 18518
2026 1 4 . 1 1 3 3 MET C C 3 176.913 176.913 174.904 2.009 18518
2027 1 4 . 1 1 3 3 MET CA C 3 55.679 55.679 55.275 0.404 18518
2028 1 4 . 1 1 3 3 MET CB C 3 32.590 32.590 33.777 -1.187 18518
2029 1 4 . 1 1 3 3 MET H H 3 8.638 8.638 8.591 0.047 18518
2030 1 4 . 1 1 4 4 GLY N N 4 110.281 110.281 111.119 -0.838 18518
2031 1 4 . 1 1 4 4 GLY C C 4 174.180 174.180 174.091 0.089 18518
2032 1 4 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.814 0.681 18518
2033 1 4 . 1 1 4 4 GLY H H 4 8.552 8.552 8.603 -0.051 18518
2034 1 4 . 1 1 5 5 LYS N N 5 120.818 120.818 126.076 -5.258 18518
2035 1 4 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.599 -0.090 18518
2036 1 4 . 1 1 5 5 LYS C C 5 177.605 177.605 176.584 1.021 18518
2037 1 4 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.436 0.698 18518
2038 1 4 . 1 1 5 5 LYS CB C 5 34.813 34.813 34.217 0.596 18518
2039 1 4 . 1 1 5 5 LYS H H 5 8.133 8.133 8.068 0.065 18518
2040 1 4 . 1 1 6 6 THR N N 6 114.781 114.781 115.293 -0.512 18518
2041 1 4 . 1 1 6 6 THR HA H 6 4.421 4.421 4.572 -0.151 18518
2042 1 4 . 1 1 6 6 THR C C 6 175.524 175.524 176.073 -0.549 18518
2043 1 4 . 1 1 6 6 THR CA C 6 61.127 61.127 62.099 -0.972 18518
2044 1 4 . 1 1 6 6 THR CB C 6 69.926 69.926 70.102 -0.176 18518
2045 1 4 . 1 1 6 6 THR H H 6 8.483 8.483 8.331 0.152 18518
2046 1 4 . 1 1 7 7 PHE N N 7 125.552 125.552 123.396 2.156 18518
2047 1 4 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.057 -0.052 18518
2048 1 4 . 1 1 7 7 PHE C C 7 177.397 177.397 176.684 0.713 18518
2049 1 4 . 1 1 7 7 PHE CA C 7 63.393 63.393 61.487 1.906 18518
2050 1 4 . 1 1 7 7 PHE CB C 7 39.567 39.567 37.959 1.608 18518
2051 1 4 . 1 1 7 7 PHE H H 7 10.245 10.245 9.197 1.048 18518
2052 1 4 . 1 1 8 8 LYS N N 8 114.053 114.053 116.523 -2.470 18518
2053 1 4 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.604 0.231 18518
2054 1 4 . 1 1 8 8 LYS C C 8 175.520 175.520 178.008 -2.488 18518
2055 1 4 . 1 1 8 8 LYS CA C 8 59.993 59.993 57.688 2.305 18518
2056 1 4 . 1 1 8 8 LYS CB C 8 33.689 33.689 30.865 2.824 18518
2057 1 4 . 1 1 8 8 LYS H H 8 8.775 8.775 6.606 2.168 18518
2058 1 4 . 1 1 9 9 GLN N N 9 113.516 113.516 118.554 -5.038 18518
2059 1 4 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.065 0.084 18518
2060 1 4 . 1 1 9 9 GLN C C 9 177.615 177.615 177.628 -0.013 18518
2061 1 4 . 1 1 9 9 GLN CA C 9 56.819 56.819 58.146 -1.327 18518
2062 1 4 . 1 1 9 9 GLN CB C 9 30.019 30.019 29.061 0.958 18518
2063 1 4 . 1 1 9 9 GLN H H 9 7.355 7.355 7.526 -0.171 18518
2064 1 4 . 1 1 10 10 ARG N N 10 118.294 118.294 116.523 1.771 18518
2065 1 4 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.208 0.094 18518
2066 1 4 . 1 1 10 10 ARG C C 10 179.380 179.380 177.228 2.152 18518
2067 1 4 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.166 0.102 18518
2068 1 4 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.655 0.987 18518
2069 1 4 . 1 1 10 10 ARG H H 10 7.936 7.936 7.716 0.220 18518
2070 1 4 . 1 1 11 11 ARG N N 11 121.137 121.137 119.497 1.640 18518
2071 1 4 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.777 -0.097 18518
2072 1 4 . 1 1 11 11 ARG CA C 11 53.453 53.453 53.890 -0.437 18518
2073 1 4 . 1 1 11 11 ARG CB C 11 32.938 32.938 31.631 1.307 18518
2074 1 4 . 1 1 11 11 ARG H H 11 7.390 7.390 7.511 -0.121 18518
2075 1 4 . 1 1 12 12 THR N N 12 116.819 116.819 118.927 -2.108 18518
2076 1 4 . 1 1 12 12 THR HA H 12 4.359 4.359 4.223 0.136 18518
2077 1 4 . 1 1 12 12 THR C C 12 174.989 174.989 176.159 -1.170 18518
2078 1 4 . 1 1 12 12 THR CA C 12 61.748 61.748 62.800 -1.052 18518
2079 1 4 . 1 1 12 12 THR CB C 12 71.068 71.068 69.947 1.121 18518
2080 1 4 . 1 1 12 12 THR H H 12 8.953 8.953 8.700 0.254 18518
2081 1 4 . 1 1 13 13 PHE N N 13 123.200 123.200 123.043 0.157 18518
2082 1 4 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.213 -0.185 18518
2083 1 4 . 1 1 13 13 PHE C C 13 176.029 176.029 177.146 -1.117 18518
2084 1 4 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.260 0.604 18518
2085 1 4 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.350 0.210 18518
2086 1 4 . 1 1 13 13 PHE H H 13 9.284 9.284 8.939 0.345 18518
2087 1 4 . 1 1 14 14 GLU N N 14 115.414 115.414 118.455 -3.041 18518
2088 1 4 . 1 1 14 14 GLU HA H 14 3.794 3.794 4.010 -0.216 18518
2089 1 4 . 1 1 14 14 GLU C C 14 180.081 180.081 179.040 1.041 18518
2090 1 4 . 1 1 14 14 GLU CA C 14 60.619 60.619 60.360 0.259 18518
2091 1 4 . 1 1 14 14 GLU CB C 14 28.852 28.852 29.066 -0.214 18518
2092 1 4 . 1 1 14 14 GLU H H 14 8.973 8.973 8.771 0.202 18518
2093 1 4 . 1 1 15 15 GLN N N 15 119.276 119.276 118.783 0.493 18518
2094 1 4 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.091 -0.091 18518
2095 1 4 . 1 1 15 15 GLN C C 15 177.978 177.978 178.780 -0.802 18518
2096 1 4 . 1 1 15 15 GLN CA C 15 58.835 58.835 59.022 -0.187 18518
2097 1 4 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.474 0.896 18518
2098 1 4 . 1 1 15 15 GLN H H 15 7.756 7.756 8.580 -0.824 18518
2099 1 4 . 1 1 16 16 ARG N N 16 121.336 121.336 119.759 1.577 18518
2100 1 4 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.211 0.059 18518
2101 1 4 . 1 1 16 16 ARG C C 16 177.416 177.416 178.829 -1.413 18518
2102 1 4 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.702 1.673 18518
2103 1 4 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.454 0.151 18518
2104 1 4 . 1 1 16 16 ARG H H 16 8.645 8.645 8.044 0.601 18518
2105 1 4 . 1 1 17 17 VAL N N 17 117.630 117.630 120.836 -3.206 18518
2106 1 4 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.589 0.268 18518
2107 1 4 . 1 1 17 17 VAL C C 17 179.748 179.748 177.810 1.938 18518
2108 1 4 . 1 1 17 17 VAL CA C 17 65.726 65.726 66.609 -0.883 18518
2109 1 4 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.863 0.331 18518
2110 1 4 . 1 1 17 17 VAL H H 17 8.373 8.373 8.368 0.005 18518
2111 1 4 . 1 1 18 18 GLU N N 18 120.864 120.864 119.906 0.958 18518
2112 1 4 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.936 0.366 18518
2113 1 4 . 1 1 18 18 GLU C C 18 177.728 177.728 178.566 -0.838 18518
2114 1 4 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.885 -1.399 18518
2115 1 4 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.462 -0.080 18518
2116 1 4 . 1 1 18 18 GLU H H 18 7.368 7.368 8.027 -0.659 18518
2117 1 4 . 1 1 19 19 ASP N N 19 121.425 121.425 120.083 1.342 18518
2118 1 4 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.458 -0.024 18518
2119 1 4 . 1 1 19 19 ASP C C 19 179.978 179.978 178.495 1.483 18518
2120 1 4 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.076 0.346 18518
2121 1 4 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.647 0.640 18518
2122 1 4 . 1 1 19 19 ASP H H 19 8.671 8.671 8.113 0.558 18518
2123 1 4 . 1 1 20 20 VAL N N 20 119.730 119.730 120.382 -0.652 18518
2124 1 4 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.262 -0.057 18518
2125 1 4 . 1 1 20 20 VAL C C 20 176.284 176.284 177.639 -1.355 18518
2126 1 4 . 1 1 20 20 VAL CA C 20 66.315 66.315 66.955 -0.640 18518
2127 1 4 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.365 -0.258 18518
2128 1 4 . 1 1 20 20 VAL H H 20 7.999 7.999 8.060 -0.061 18518
2129 1 4 . 1 1 21 21 ARG N N 21 121.455 121.455 120.096 1.359 18518
2130 1 4 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.955 -0.141 18518
2131 1 4 . 1 1 21 21 ARG C C 21 180.120 180.120 178.738 1.382 18518
2132 1 4 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.734 1.096 18518
2133 1 4 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.195 0.751 18518
2134 1 4 . 1 1 21 21 ARG H H 21 8.098 8.098 8.107 -0.009 18518
2135 1 4 . 1 1 22 22 LEU N N 22 117.826 117.826 121.278 -3.452 18518
2136 1 4 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.082 -0.033 18518
2137 1 4 . 1 1 22 22 LEU C C 22 180.115 180.115 178.312 1.803 18518
2138 1 4 . 1 1 22 22 LEU CA C 22 57.790 57.790 57.990 -0.200 18518
2139 1 4 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.936 0.206 18518
2140 1 4 . 1 1 22 22 LEU H H 22 8.207 8.207 8.008 0.199 18518
2141 1 4 . 1 1 23 23 ILE N N 23 121.450 121.450 119.651 1.799 18518
2142 1 4 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.675 0.338 18518
2143 1 4 . 1 1 23 23 ILE C C 23 178.149 178.149 177.642 0.507 18518
2144 1 4 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.303 -2.132 18518
2145 1 4 . 1 1 23 23 ILE CB C 23 38.106 38.106 37.923 0.183 18518
2146 1 4 . 1 1 23 23 ILE H H 23 8.105 8.105 8.358 -0.253 18518
2147 1 4 . 1 1 24 24 ARG N N 24 121.139 121.139 118.705 2.434 18518
2148 1 4 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.174 -0.187 18518
2149 1 4 . 1 1 24 24 ARG C C 24 178.702 178.702 178.738 -0.036 18518
2150 1 4 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.813 -1.095 18518
2151 1 4 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.625 -0.856 18518
2152 1 4 . 1 1 24 24 ARG H H 24 8.601 8.601 8.409 0.192 18518
2153 1 4 . 1 1 25 25 GLU N N 25 118.054 118.054 120.497 -2.443 18518
2154 1 4 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.113 -0.087 18518
2155 1 4 . 1 1 25 25 GLU C C 25 178.492 178.492 178.757 -0.265 18518
2156 1 4 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.833 -0.053 18518
2157 1 4 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.645 0.356 18518
2158 1 4 . 1 1 25 25 GLU H H 25 7.423 7.423 7.766 -0.343 18518
2159 1 4 . 1 1 26 26 GLN N N 26 116.350 116.350 116.727 -0.377 18518
2160 1 4 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.076 -0.140 18518
2161 1 4 . 1 1 26 26 GLN C C 26 176.305 176.305 176.987 -0.682 18518
2162 1 4 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.451 0.052 18518
2163 1 4 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.756 0.451 18518
2164 1 4 . 1 1 26 26 GLN H H 26 7.524 7.524 7.895 -0.371 18518
2165 1 4 . 1 1 27 27 HIS N N 27 116.017 116.017 118.434 -2.417 18518
2166 1 4 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.112 -0.182 18518
2167 1 4 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.967 0.087 18518
2168 1 4 . 1 1 27 27 HIS CB C 27 30.747 30.747 30.999 -0.252 18518
2169 1 4 . 1 1 27 27 HIS H H 27 8.284 8.284 8.226 0.058 18518
2170 1 4 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.577 0.004 18518
2171 1 4 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.202 0.717 18518
2172 1 4 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.103 0.352 18518
2173 1 4 . 1 1 29 29 THR N N 29 107.011 107.011 105.137 1.874 18518
2174 1 4 . 1 1 29 29 THR HA H 29 4.599 4.599 4.424 0.175 18518
2175 1 4 . 1 1 29 29 THR C C 29 172.884 172.884 173.731 -0.847 18518
2176 1 4 . 1 1 29 29 THR CA C 29 60.810 60.810 61.324 -0.514 18518
2177 1 4 . 1 1 29 29 THR CB C 29 68.531 68.531 69.076 -0.545 18518
2178 1 4 . 1 1 29 29 THR H H 29 7.890 7.890 8.108 -0.218 18518
2179 1 4 . 1 1 30 30 LYS N N 30 117.679 117.679 121.255 -3.576 18518
2180 1 4 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.941 -0.083 18518
2181 1 4 . 1 1 30 30 LYS C C 30 174.310 174.310 175.050 -0.740 18518
2182 1 4 . 1 1 30 30 LYS CA C 30 53.751 53.751 54.125 -0.374 18518
2183 1 4 . 1 1 30 30 LYS CB C 30 35.804 35.804 36.101 -0.297 18518
2184 1 4 . 1 1 30 30 LYS H H 30 7.441 7.441 7.670 -0.229 18518
2185 1 4 . 1 1 31 31 ILE N N 31 122.849 122.849 123.798 -0.949 18518
2186 1 4 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.351 -0.246 18518
2187 1 4 . 1 1 31 31 ILE CA C 31 54.801 54.801 58.066 -3.265 18518
2188 1 4 . 1 1 31 31 ILE CB C 31 38.265 38.265 39.417 -1.153 18518
2189 1 4 . 1 1 31 31 ILE H H 31 9.304 9.304 9.017 0.287 18518
2190 1 4 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.998 0.161 18518
2191 1 4 . 1 1 32 32 PRO C C 32 174.164 174.164 175.924 -1.760 18518
2192 1 4 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.188 -0.685 18518
2193 1 4 . 1 1 32 32 PRO CB C 32 31.145 31.145 30.948 0.197 18518
2194 1 4 . 1 1 33 33 VAL N N 33 125.606 125.606 126.093 -0.487 18518
2195 1 4 . 1 1 33 33 VAL HA H 33 5.213 5.213 4.807 0.406 18518
2196 1 4 . 1 1 33 33 VAL C C 33 173.654 173.654 174.047 -0.393 18518
2197 1 4 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.659 0.385 18518
2198 1 4 . 1 1 33 33 VAL CB C 33 35.604 35.604 35.950 -0.346 18518
2199 1 4 . 1 1 33 33 VAL H H 33 9.424 9.424 8.498 0.926 18518
2200 1 4 . 1 1 34 34 ILE N N 34 128.241 128.241 127.101 1.140 18518
2201 1 4 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.785 0.048 18518
2202 1 4 . 1 1 34 34 ILE C C 34 175.605 175.605 174.943 0.662 18518
2203 1 4 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.243 -1.478 18518
2204 1 4 . 1 1 34 34 ILE CB C 34 36.799 36.799 38.262 -1.463 18518
2205 1 4 . 1 1 34 34 ILE H H 34 8.721 8.721 8.894 -0.173 18518
2206 1 4 . 1 1 35 35 ILE N N 35 125.650 125.650 127.532 -1.882 18518
2207 1 4 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.739 0.097 18518
2208 1 4 . 1 1 35 35 ILE C C 35 174.887 174.887 174.554 0.333 18518
2209 1 4 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.191 0.754 18518
2210 1 4 . 1 1 35 35 ILE CB C 35 39.210 39.210 38.955 0.256 18518
2211 1 4 . 1 1 35 35 ILE H H 35 9.034 9.034 8.837 0.197 18518
2212 1 4 . 1 1 36 36 GLU N N 36 122.657 122.657 127.274 -4.617 18518
2213 1 4 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.834 0.027 18518
2214 1 4 . 1 1 36 36 GLU C C 36 173.848 173.848 174.734 -0.886 18518
2215 1 4 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.009 -0.077 18518
2216 1 4 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.369 0.913 18518
2217 1 4 . 1 1 36 36 GLU H H 36 8.303 8.303 8.513 -0.210 18518
2218 1 4 . 1 1 37 37 ARG N N 37 123.228 123.228 126.187 -2.959 18518
2219 1 4 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.260 -0.534 18518
2220 1 4 . 1 1 37 37 ARG C C 37 176.359 176.359 175.870 0.489 18518
2221 1 4 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.175 0.184 18518
2222 1 4 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.703 0.637 18518
2223 1 4 . 1 1 37 37 ARG H H 37 8.856 8.856 8.690 0.166 18518
2224 1 4 . 1 1 38 38 TYR N N 38 128.981 128.981 128.343 0.638 18518
2225 1 4 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.371 -0.019 18518
2226 1 4 . 1 1 38 38 TYR C C 38 177.316 177.316 176.889 0.427 18518
2227 1 4 . 1 1 38 38 TYR CA C 38 57.712 57.712 57.714 -0.002 18518
2228 1 4 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.167 -0.695 18518
2229 1 4 . 1 1 38 38 TYR H H 38 8.628 8.628 8.210 0.418 18518
2230 1 4 . 1 1 39 39 LYS N N 39 130.635 130.635 127.452 3.183 18518
2231 1 4 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.805 0.017 18518
2232 1 4 . 1 1 39 39 LYS CA C 39 58.887 58.887 57.843 1.044 18518
2233 1 4 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.764 0.007 18518
2234 1 4 . 1 1 39 39 LYS H H 39 8.594 8.594 8.283 0.311 18518
2235 1 4 . 1 1 40 40 GLY C C 40 173.447 173.447 173.551 -0.104 18518
2236 1 4 . 1 1 40 40 GLY CA C 40 44.663 44.663 43.843 0.820 18518
2237 1 4 . 1 1 40 40 GLY H H 40 5.188 5.188 6.051 -0.863 18518
2238 1 4 . 1 1 41 41 GLU N N 41 122.836 122.836 120.672 2.164 18518
2239 1 4 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.563 -0.306 18518
2240 1 4 . 1 1 41 41 GLU C C 41 176.524 176.524 175.731 0.793 18518
2241 1 4 . 1 1 41 41 GLU CA C 41 56.525 56.525 55.085 1.440 18518
2242 1 4 . 1 1 41 41 GLU CB C 41 30.985 30.985 30.005 0.980 18518
2243 1 4 . 1 1 41 41 GLU H H 41 7.380 7.380 7.597 -0.217 18518
2244 1 4 . 1 1 42 42 LYS N N 42 124.040 124.040 126.567 -2.527 18518
2245 1 4 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.405 0.270 18518
2246 1 4 . 1 1 42 42 LYS C C 42 177.538 177.538 177.591 -0.053 18518
2247 1 4 . 1 1 42 42 LYS CA C 42 55.840 55.840 57.035 -1.195 18518
2248 1 4 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.258 1.721 18518
2249 1 4 . 1 1 42 42 LYS H H 42 9.034 9.034 8.919 0.115 18518
2250 1 4 . 1 1 43 43 GLN N N 43 119.259 119.259 118.846 0.413 18518
2251 1 4 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.405 0.137 18518
2252 1 4 . 1 1 43 43 GLN C C 43 177.336 177.336 176.440 0.896 18518
2253 1 4 . 1 1 43 43 GLN CA C 43 57.673 57.673 56.736 0.937 18518
2254 1 4 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.315 0.467 18518
2255 1 4 . 1 1 43 43 GLN H H 43 8.435 8.435 8.823 -0.388 18518
2256 1 4 . 1 1 44 44 LEU N N 44 120.760 120.760 123.454 -2.694 18518
2257 1 4 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.656 0.039 18518
2258 1 4 . 1 1 44 44 LEU CA C 44 53.245 53.245 53.079 0.166 18518
2259 1 4 . 1 1 44 44 LEU CB C 44 43.596 43.596 42.093 1.503 18518
2260 1 4 . 1 1 44 44 LEU H H 44 9.126 9.126 8.304 0.822 18518
2261 1 4 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.562 0.155 18518
2262 1 4 . 1 1 45 45 PRO C C 45 175.797 175.797 176.738 -0.941 18518
2263 1 4 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.191 -0.080 18518
2264 1 4 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.276 0.316 18518
2265 1 4 . 1 1 46 46 VAL N N 46 119.052 119.052 120.469 -1.417 18518
2266 1 4 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.087 -0.220 18518
2267 1 4 . 1 1 46 46 VAL C C 46 175.640 175.640 176.449 -0.809 18518
2268 1 4 . 1 1 46 46 VAL CA C 46 62.944 62.944 62.849 0.095 18518
2269 1 4 . 1 1 46 46 VAL CB C 46 32.799 32.799 32.381 0.418 18518
2270 1 4 . 1 1 46 46 VAL H H 46 8.543 8.543 8.365 0.178 18518
2271 1 4 . 1 1 47 47 LEU N N 47 130.203 130.203 127.312 2.891 18518
2272 1 4 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.378 -0.069 18518
2273 1 4 . 1 1 47 47 LEU C C 47 176.198 176.198 177.177 -0.979 18518
2274 1 4 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.148 -0.142 18518
2275 1 4 . 1 1 47 47 LEU CB C 47 43.832 43.832 43.100 0.732 18518
2276 1 4 . 1 1 47 47 LEU H H 47 7.799 7.799 8.549 -0.750 18518
2277 1 4 . 1 1 48 48 ASP N N 48 122.403 122.403 121.506 0.897 18518
2278 1 4 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.505 -0.242 18518
2279 1 4 . 1 1 48 48 ASP C C 48 175.294 175.294 175.727 -0.433 18518
2280 1 4 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.717 0.116 18518
2281 1 4 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.229 -1.045 18518
2282 1 4 . 1 1 48 48 ASP H H 48 8.780 8.780 8.780 -0.000 18518
2283 1 4 . 1 1 49 49 LYS N N 49 119.569 119.569 114.925 4.644 18518
2284 1 4 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.497 0.088 18518
2285 1 4 . 1 1 49 49 LYS C C 49 174.678 174.678 174.325 0.353 18518
2286 1 4 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.429 -1.778 18518
2287 1 4 . 1 1 49 49 LYS CB C 49 35.945 35.945 33.890 2.055 18518
2288 1 4 . 1 1 49 49 LYS H H 49 7.280 7.280 7.685 -0.405 18518
2289 1 4 . 1 1 50 50 THR N N 50 110.862 110.862 112.823 -1.961 18518
2290 1 4 . 1 1 50 50 THR HA H 50 4.811 4.811 4.911 -0.100 18518
2291 1 4 . 1 1 50 50 THR C C 50 172.425 172.425 174.005 -1.580 18518
2292 1 4 . 1 1 50 50 THR CA C 50 62.645 62.645 62.169 0.476 18518
2293 1 4 . 1 1 50 50 THR CB C 50 71.648 71.648 70.343 1.305 18518
2294 1 4 . 1 1 50 50 THR H H 50 8.042 8.042 8.226 -0.183 18518
2295 1 4 . 1 1 51 51 LYS N N 51 120.008 120.008 122.306 -2.298 18518
2296 1 4 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.521 0.104 18518
2297 1 4 . 1 1 51 51 LYS C C 51 175.082 175.082 175.665 -0.583 18518
2298 1 4 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.338 -1.634 18518
2299 1 4 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.396 -1.020 18518
2300 1 4 . 1 1 51 51 LYS H H 51 7.119 7.119 7.546 -0.427 18518
2301 1 4 . 1 1 52 52 PHE N N 52 122.640 122.640 122.509 0.131 18518
2302 1 4 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.760 0.577 18518
2303 1 4 . 1 1 52 52 PHE C C 52 174.213 174.213 173.874 0.339 18518
2304 1 4 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.646 -0.035 18518
2305 1 4 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.379 -0.239 18518
2306 1 4 . 1 1 52 52 PHE H H 52 9.709 9.709 9.048 0.661 18518
2307 1 4 . 1 1 53 53 LEU N N 53 122.157 122.157 122.298 -0.141 18518
2308 1 4 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.965 -0.018 18518
2309 1 4 . 1 1 53 53 LEU C C 53 175.769 175.769 175.660 0.109 18518
2310 1 4 . 1 1 53 53 LEU CA C 53 52.957 52.957 54.046 -1.089 18518
2311 1 4 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.898 0.517 18518
2312 1 4 . 1 1 53 53 LEU H H 53 8.959 8.959 8.485 0.474 18518
2313 1 4 . 1 1 54 54 VAL N N 54 124.919 124.919 124.307 0.612 18518
2314 1 4 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.569 -0.010 18518
2315 1 4 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.779 0.351 18518
2316 1 4 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.211 1.757 18518
2317 1 4 . 1 1 54 54 VAL H H 54 8.922 8.922 8.545 0.377 18518
2318 1 4 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.859 -0.418 18518
2319 1 4 . 1 1 55 55 PRO C C 55 176.594 176.594 177.822 -1.228 18518
2320 1 4 . 1 1 55 55 PRO CA C 55 64.315 64.315 61.914 2.401 18518
2321 1 4 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.071 0.594 18518
2322 1 4 . 1 1 56 56 ASP N N 56 120.522 120.522 121.683 -1.161 18518
2323 1 4 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.182 -0.320 18518
2324 1 4 . 1 1 56 56 ASP C C 56 175.809 175.809 177.063 -1.254 18518
2325 1 4 . 1 1 56 56 ASP CA C 56 56.749 56.749 57.054 -0.305 18518
2326 1 4 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.550 -0.040 18518
2327 1 4 . 1 1 56 56 ASP H H 56 8.347 8.347 8.332 0.015 18518
2328 1 4 . 1 1 57 57 HIS N N 57 113.482 113.482 114.514 -1.032 18518
2329 1 4 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.459 0.261 18518
2330 1 4 . 1 1 57 57 HIS C C 57 176.507 176.507 175.313 1.194 18518
2331 1 4 . 1 1 57 57 HIS CA C 57 55.589 55.589 56.095 -0.506 18518
2332 1 4 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.424 1.219 18518
2333 1 4 . 1 1 57 57 HIS H H 57 7.557 7.557 7.917 -0.360 18518
2334 1 4 . 1 1 58 58 VAL N N 58 123.279 123.279 122.583 0.696 18518
2335 1 4 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.129 -0.293 18518
2336 1 4 . 1 1 58 58 VAL C C 58 175.019 175.019 175.424 -0.405 18518
2337 1 4 . 1 1 58 58 VAL CA C 58 62.823 62.823 62.893 -0.070 18518
2338 1 4 . 1 1 58 58 VAL CB C 58 32.310 32.310 32.446 -0.136 18518
2339 1 4 . 1 1 58 58 VAL H H 58 7.345 7.345 7.288 0.057 18518
2340 1 4 . 1 1 59 59 ASN N N 59 123.781 123.781 125.031 -1.250 18518
2341 1 4 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.207 -0.081 18518
2342 1 4 . 1 1 59 59 ASN C C 59 176.558 176.558 176.662 -0.104 18518
2343 1 4 . 1 1 59 59 ASN CA C 59 51.485 51.485 52.017 -0.532 18518
2344 1 4 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.212 -0.105 18518
2345 1 4 . 1 1 59 59 ASN H H 59 8.735 8.735 9.218 -0.483 18518
2346 1 4 . 1 1 60 60 MET N N 60 117.453 117.453 118.611 -1.158 18518
2347 1 4 . 1 1 60 60 MET HA H 60 4.395 4.395 4.058 0.337 18518
2348 1 4 . 1 1 60 60 MET C C 60 178.144 178.144 178.274 -0.130 18518
2349 1 4 . 1 1 60 60 MET CA C 60 57.097 57.097 58.059 -0.962 18518
2350 1 4 . 1 1 60 60 MET CB C 60 30.140 30.140 30.779 -0.638 18518
2351 1 4 . 1 1 60 60 MET H H 60 8.227 8.227 8.894 -0.667 18518
2352 1 4 . 1 1 61 61 SER N N 61 114.216 114.216 115.111 -0.895 18518
2353 1 4 . 1 1 61 61 SER HA H 61 4.111 4.111 4.068 0.043 18518
2354 1 4 . 1 1 61 61 SER C C 61 177.335 177.335 176.625 0.710 18518
2355 1 4 . 1 1 61 61 SER CA C 61 61.590 61.590 62.747 -1.157 18518
2356 1 4 . 1 1 61 61 SER CB C 61 62.402 62.402 62.783 -0.381 18518
2357 1 4 . 1 1 61 61 SER H H 61 8.464 8.464 8.362 0.102 18518
2358 1 4 . 1 1 62 62 GLU N N 62 123.004 123.004 121.386 1.618 18518
2359 1 4 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.132 -0.085 18518
2360 1 4 . 1 1 62 62 GLU C C 62 178.686 178.686 178.702 -0.016 18518
2361 1 4 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.801 -0.176 18518
2362 1 4 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.146 0.508 18518
2363 1 4 . 1 1 62 62 GLU H H 62 7.994 7.994 7.698 0.296 18518
2364 1 4 . 1 1 63 63 LEU N N 63 120.818 120.818 122.653 -1.835 18518
2365 1 4 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.986 -0.021 18518
2366 1 4 . 1 1 63 63 LEU C C 63 178.046 178.046 178.807 -0.761 18518
2367 1 4 . 1 1 63 63 LEU CA C 63 57.920 57.920 57.972 -0.052 18518
2368 1 4 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.379 0.245 18518
2369 1 4 . 1 1 63 63 LEU H H 63 8.130 8.130 8.254 -0.124 18518
2370 1 4 . 1 1 64 64 ILE N N 64 118.528 118.528 119.501 -0.973 18518
2371 1 4 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.560 -0.191 18518
2372 1 4 . 1 1 64 64 ILE C C 64 177.127 177.127 177.681 -0.554 18518
2373 1 4 . 1 1 64 64 ILE CA C 64 66.678 66.678 65.796 0.882 18518
2374 1 4 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.642 0.801 18518
2375 1 4 . 1 1 64 64 ILE H H 64 8.488 8.488 8.602 -0.114 18518
2376 1 4 . 1 1 65 65 LYS N N 65 118.336 118.336 120.937 -2.601 18518
2377 1 4 . 1 1 65 65 LYS HA H 65 3.701 3.701 3.979 -0.278 18518
2378 1 4 . 1 1 65 65 LYS C C 65 179.291 179.291 179.096 0.195 18518
2379 1 4 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.982 0.458 18518
2380 1 4 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.324 0.047 18518
2381 1 4 . 1 1 65 65 LYS H H 65 7.347 7.347 7.596 -0.249 18518
2382 1 4 . 1 1 66 66 ILE N N 66 120.171 120.171 119.952 0.219 18518
2383 1 4 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.669 -0.091 18518
2384 1 4 . 1 1 66 66 ILE C C 66 178.873 178.873 178.287 0.586 18518
2385 1 4 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.061 0.099 18518
2386 1 4 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.864 0.769 18518
2387 1 4 . 1 1 66 66 ILE H H 66 7.901 7.901 8.342 -0.441 18518
2388 1 4 . 1 1 67 67 ILE N N 67 121.185 121.185 120.905 0.280 18518
2389 1 4 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.608 -0.162 18518
2390 1 4 . 1 1 67 67 ILE C C 67 177.150 177.150 177.509 -0.359 18518
2391 1 4 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.587 -1.781 18518
2392 1 4 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.501 -2.506 18518
2393 1 4 . 1 1 67 67 ILE H H 67 8.290 8.290 7.966 0.324 18518
2394 1 4 . 1 1 68 68 ARG N N 68 119.173 119.173 119.009 0.164 18518
2395 1 4 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.762 -0.831 18518
2396 1 4 . 1 1 68 68 ARG C C 68 178.496 178.496 178.686 -0.190 18518
2397 1 4 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.617 1.019 18518
2398 1 4 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.728 0.712 18518
2399 1 4 . 1 1 68 68 ARG H H 68 8.438 8.438 8.314 0.124 18518
2400 1 4 . 1 1 69 69 ARG N N 69 116.511 116.511 121.074 -4.563 18518
2401 1 4 . 1 1 69 69 ARG HA H 69 4.134 4.134 4.086 0.048 18518
2402 1 4 . 1 1 69 69 ARG C C 69 180.262 180.262 178.385 1.877 18518
2403 1 4 . 1 1 69 69 ARG CA C 69 58.707 58.707 58.865 -0.158 18518
2404 1 4 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.067 -0.115 18518
2405 1 4 . 1 1 69 69 ARG H H 69 7.497 7.497 8.364 -0.867 18518
2406 1 4 . 1 1 70 70 ARG N N 70 123.297 123.297 117.832 5.465 18518
2407 1 4 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.205 -0.189 18518
2408 1 4 . 1 1 70 70 ARG C C 70 178.700 178.700 178.332 0.368 18518
2409 1 4 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.390 1.070 18518
2410 1 4 . 1 1 70 70 ARG CB C 70 30.312 30.312 30.259 0.053 18518
2411 1 4 . 1 1 70 70 ARG H H 70 8.075 8.075 7.842 0.233 18518
2412 1 4 . 1 1 71 71 LEU N N 71 116.829 116.829 118.879 -2.050 18518
2413 1 4 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.242 -0.177 18518
2414 1 4 . 1 1 71 71 LEU C C 71 174.956 174.956 176.690 -1.734 18518
2415 1 4 . 1 1 71 71 LEU CA C 71 55.126 55.126 55.969 -0.843 18518
2416 1 4 . 1 1 71 71 LEU CB C 71 43.246 43.246 41.992 1.254 18518
2417 1 4 . 1 1 71 71 LEU H H 71 7.719 7.719 8.051 -0.332 18518
2418 1 4 . 1 1 72 72 GLN N N 72 114.991 114.991 114.879 0.112 18518
2419 1 4 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.908 -0.072 18518
2420 1 4 . 1 1 72 72 GLN C C 72 175.683 175.683 175.288 0.395 18518
2421 1 4 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.155 0.170 18518
2422 1 4 . 1 1 72 72 GLN CB C 72 26.004 26.004 26.398 -0.394 18518
2423 1 4 . 1 1 72 72 GLN H H 72 7.744 7.744 7.947 -0.203 18518
2424 1 4 . 1 1 73 73 LEU N N 73 115.045 115.045 118.106 -3.061 18518
2425 1 4 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.218 0.018 18518
2426 1 4 . 1 1 73 73 LEU C C 73 178.762 178.762 177.693 1.069 18518
2427 1 4 . 1 1 73 73 LEU CA C 73 54.386 54.386 53.849 0.537 18518
2428 1 4 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.890 0.201 18518
2429 1 4 . 1 1 73 73 LEU H H 73 7.500 7.500 7.887 -0.387 18518
2430 1 4 . 1 1 74 74 ASN N N 74 121.700 121.700 118.599 3.101 18518
2431 1 4 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.584 0.106 18518
2432 1 4 . 1 1 74 74 ASN C C 74 176.617 176.617 175.932 0.685 18518
2433 1 4 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.530 -0.845 18518
2434 1 4 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.791 -0.193 18518
2435 1 4 . 1 1 74 74 ASN H H 74 9.045 9.045 8.372 0.673 18518
2436 1 4 . 1 1 75 75 ALA N N 75 123.952 123.952 124.400 -0.448 18518
2437 1 4 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.263 -0.299 18518
2438 1 4 . 1 1 75 75 ALA C C 75 178.131 178.131 177.776 0.355 18518
2439 1 4 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.763 1.105 18518
2440 1 4 . 1 1 75 75 ALA CB C 75 18.718 18.718 18.956 -0.238 18518
2441 1 4 . 1 1 75 75 ALA H H 75 8.784 8.784 8.452 0.332 18518
2442 1 4 . 1 1 76 76 ASN N N 76 112.295 112.295 116.204 -3.909 18518
2443 1 4 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.611 -0.031 18518
2444 1 4 . 1 1 76 76 ASN C C 76 175.448 175.448 175.269 0.179 18518
2445 1 4 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.523 -0.309 18518
2446 1 4 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.604 -0.284 18518
2447 1 4 . 1 1 76 76 ASN H H 76 8.391 8.391 8.731 -0.340 18518
2448 1 4 . 1 1 77 77 GLN N N 77 120.577 120.577 118.667 1.910 18518
2449 1 4 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.565 -0.292 18518
2450 1 4 . 1 1 77 77 GLN C C 77 175.045 175.045 173.895 1.150 18518
2451 1 4 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.986 0.820 18518
2452 1 4 . 1 1 77 77 GLN CB C 77 30.157 30.157 30.942 -0.785 18518
2453 1 4 . 1 1 77 77 GLN H H 77 7.552 7.552 7.317 0.235 18518
2454 1 4 . 1 1 78 78 ALA N N 78 130.670 130.670 125.061 5.609 18518
2455 1 4 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.662 -0.491 18518
2456 1 4 . 1 1 78 78 ALA C C 78 176.512 176.512 175.255 1.257 18518
2457 1 4 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.309 1.533 18518
2458 1 4 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.714 -1.654 18518
2459 1 4 . 1 1 78 78 ALA H H 78 8.799 8.799 8.883 -0.084 18518
2460 1 4 . 1 1 79 79 PHE N N 79 119.325 119.325 116.702 2.623 18518
2461 1 4 . 1 1 79 79 PHE HA H 79 4.434 4.434 5.283 -0.849 18518
2462 1 4 . 1 1 79 79 PHE C C 79 171.726 171.726 172.883 -1.157 18518
2463 1 4 . 1 1 79 79 PHE CA C 79 59.145 59.145 55.164 3.981 18518
2464 1 4 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.656 0.515 18518
2465 1 4 . 1 1 79 79 PHE H H 79 7.664 7.664 8.324 -0.660 18518
2466 1 4 . 1 1 80 80 PHE N N 80 126.314 126.314 117.488 8.826 18518
2467 1 4 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.340 0.052 18518
2468 1 4 . 1 1 80 80 PHE C C 80 177.169 177.169 173.127 4.042 18518
2469 1 4 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.461 0.192 18518
2470 1 4 . 1 1 80 80 PHE CB C 80 41.933 41.933 43.315 -1.382 18518
2471 1 4 . 1 1 80 80 PHE H H 80 8.508 8.508 8.961 -0.453 18518
2472 1 4 . 1 1 81 81 LEU N N 81 121.426 121.426 122.987 -1.561 18518
2473 1 4 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.076 -0.225 18518
2474 1 4 . 1 1 81 81 LEU C C 81 174.488 174.488 175.072 -0.584 18518
2475 1 4 . 1 1 81 81 LEU CA C 81 53.197 53.197 54.342 -1.145 18518
2476 1 4 . 1 1 81 81 LEU CB C 81 45.100 45.100 43.841 1.259 18518
2477 1 4 . 1 1 81 81 LEU H H 81 8.229 8.229 8.372 -0.143 18518
2478 1 4 . 1 1 82 82 LEU N N 82 125.155 125.155 127.240 -2.085 18518
2479 1 4 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.540 0.293 18518
2480 1 4 . 1 1 82 82 LEU C C 82 177.166 177.166 175.761 1.405 18518
2481 1 4 . 1 1 82 82 LEU CA C 82 54.197 54.197 53.753 0.444 18518
2482 1 4 . 1 1 82 82 LEU CB C 82 43.442 43.442 43.825 -0.383 18518
2483 1 4 . 1 1 82 82 LEU H H 82 9.400 9.400 9.068 0.332 18518
2484 1 4 . 1 1 83 83 VAL N N 83 123.886 123.886 119.942 3.944 18518
2485 1 4 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.573 -0.194 18518
2486 1 4 . 1 1 83 83 VAL C C 83 175.810 175.810 176.447 -0.637 18518
2487 1 4 . 1 1 83 83 VAL CA C 83 61.677 61.677 61.417 0.260 18518
2488 1 4 . 1 1 83 83 VAL CB C 83 33.758 33.758 32.897 0.861 18518
2489 1 4 . 1 1 83 83 VAL H H 83 8.721 8.721 8.285 0.436 18518
2490 1 4 . 1 1 84 84 ASN N N 84 126.474 126.474 125.065 1.409 18518
2491 1 4 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.468 -0.072 18518
2492 1 4 . 1 1 84 84 ASN C C 84 175.164 175.164 175.566 -0.402 18518
2493 1 4 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.963 -0.225 18518
2494 1 4 . 1 1 84 84 ASN CB C 84 37.950 37.950 38.066 -0.116 18518
2495 1 4 . 1 1 84 84 ASN H H 84 9.707 9.707 9.334 0.373 18518
2496 1 4 . 1 1 85 85 GLY N N 85 101.296 101.296 104.382 -3.086 18518
2497 1 4 . 1 1 85 85 GLY C C 85 173.680 173.680 173.078 0.602 18518
2498 1 4 . 1 1 85 85 GLY CA C 85 45.603 45.603 45.349 0.254 18518
2499 1 4 . 1 1 85 85 GLY H H 85 8.644 8.644 8.634 0.010 18518
2500 1 4 . 1 1 86 86 HIS N N 86 117.238 117.238 114.034 3.204 18518
2501 1 4 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.901 0.116 18518
2502 1 4 . 1 1 86 86 HIS C C 86 173.841 173.841 174.034 -0.193 18518
2503 1 4 . 1 1 86 86 HIS CA C 86 53.796 53.796 53.251 0.545 18518
2504 1 4 . 1 1 86 86 HIS CB C 86 31.280 31.280 32.302 -1.022 18518
2505 1 4 . 1 1 86 86 HIS H H 86 7.918 7.918 8.040 -0.122 18518
2506 1 4 . 1 1 87 87 SER N N 87 118.179 118.179 120.223 -2.044 18518
2507 1 4 . 1 1 87 87 SER HA H 87 4.699 4.699 4.505 0.194 18518
2508 1 4 . 1 1 87 87 SER C C 87 175.904 175.904 174.426 1.478 18518
2509 1 4 . 1 1 87 87 SER CA C 87 58.271 58.271 57.820 0.451 18518
2510 1 4 . 1 1 87 87 SER CB C 87 63.735 63.735 61.822 1.913 18518
2511 1 4 . 1 1 87 87 SER H H 87 8.977 8.977 8.847 0.130 18518
2512 1 4 . 1 1 88 88 MET N N 88 125.472 125.472 123.370 2.102 18518
2513 1 4 . 1 1 88 88 MET HA H 88 4.830 4.830 4.706 0.124 18518
2514 1 4 . 1 1 88 88 MET C C 88 176.419 176.419 175.529 0.890 18518
2515 1 4 . 1 1 88 88 MET CA C 88 54.899 54.899 56.373 -1.474 18518
2516 1 4 . 1 1 88 88 MET CB C 88 33.336 33.336 33.552 -0.216 18518
2517 1 4 . 1 1 88 88 MET H H 88 9.184 9.184 7.675 1.509 18518
2518 1 4 . 1 1 89 89 VAL N N 89 120.747 120.747 120.719 0.028 18518
2519 1 4 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.335 -0.102 18518
2520 1 4 . 1 1 89 89 VAL C C 89 175.958 175.958 175.936 0.022 18518
2521 1 4 . 1 1 89 89 VAL CA C 89 63.154 63.154 60.620 2.534 18518
2522 1 4 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.486 -1.607 18518
2523 1 4 . 1 1 89 89 VAL H H 89 8.233 8.233 7.366 0.867 18518
2524 1 4 . 1 1 90 90 SER N N 90 117.362 117.362 119.067 -1.705 18518
2525 1 4 . 1 1 90 90 SER HA H 90 4.590 4.590 4.495 0.095 18518
2526 1 4 . 1 1 90 90 SER C C 90 175.741 175.741 175.895 -0.154 18518
2527 1 4 . 1 1 90 90 SER CA C 90 57.717 57.717 58.019 -0.302 18518
2528 1 4 . 1 1 90 90 SER CB C 90 63.223 63.223 64.075 -0.852 18518
2529 1 4 . 1 1 90 90 SER H H 90 8.482 8.482 8.518 -0.036 18518
2530 1 4 . 1 1 91 91 VAL N N 91 120.466 120.466 119.675 0.791 18518
2531 1 4 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.954 0.093 18518
2532 1 4 . 1 1 91 91 VAL C C 91 176.329 176.329 175.930 0.399 18518
2533 1 4 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.484 -0.992 18518
2534 1 4 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.827 0.741 18518
2535 1 4 . 1 1 91 91 VAL H H 91 8.188 8.188 8.726 -0.538 18518
2536 1 4 . 1 1 92 92 SER N N 92 116.398 116.398 112.857 3.541 18518
2537 1 4 . 1 1 92 92 SER HA H 92 4.636 4.636 4.529 0.107 18518
2538 1 4 . 1 1 92 92 SER C C 92 174.159 174.159 174.710 -0.551 18518
2539 1 4 . 1 1 92 92 SER CA C 92 57.805 57.805 58.784 -0.979 18518
2540 1 4 . 1 1 92 92 SER CB C 92 63.046 63.046 63.290 -0.244 18518
2541 1 4 . 1 1 92 92 SER H H 92 8.370 8.370 7.928 0.442 18518
2542 1 4 . 1 1 93 93 THR N N 93 119.211 119.211 121.391 -2.180 18518
2543 1 4 . 1 1 93 93 THR HA H 93 4.484 4.484 4.354 0.130 18518
2544 1 4 . 1 1 93 93 THR CA C 93 60.884 60.884 62.528 -1.644 18518
2545 1 4 . 1 1 93 93 THR CB C 93 70.609 70.609 68.650 1.959 18518
2546 1 4 . 1 1 93 93 THR H H 93 7.416 7.416 7.322 0.094 18518
2547 1 4 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.511 -0.071 18518
2548 1 4 . 1 1 94 94 PRO C C 94 178.775 178.775 177.380 1.395 18518
2549 1 4 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.598 0.345 18518
2550 1 4 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.459 0.189 18518
2551 1 4 . 1 1 95 95 ILE N N 95 124.174 124.174 123.607 0.567 18518
2552 1 4 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.810 0.139 18518
2553 1 4 . 1 1 95 95 ILE C C 95 176.498 176.498 176.989 -0.491 18518
2554 1 4 . 1 1 95 95 ILE CA C 95 63.904 63.904 62.230 1.674 18518
2555 1 4 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.116 0.066 18518
2556 1 4 . 1 1 95 95 ILE H H 95 9.305 9.305 8.586 0.719 18518
2557 1 4 . 1 1 96 96 SER N N 96 116.920 116.920 117.072 -0.152 18518
2558 1 4 . 1 1 96 96 SER HA H 96 4.029 4.029 4.129 -0.100 18518
2559 1 4 . 1 1 96 96 SER C C 96 176.574 176.574 176.331 0.243 18518
2560 1 4 . 1 1 96 96 SER CA C 96 61.356 61.356 62.154 -0.798 18518
2561 1 4 . 1 1 96 96 SER CB C 96 61.723 61.723 62.515 -0.792 18518
2562 1 4 . 1 1 96 96 SER H H 96 8.335 8.335 7.878 0.457 18518
2563 1 4 . 1 1 97 97 GLU N N 97 123.255 123.255 122.196 1.059 18518
2564 1 4 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.203 0.075 18518
2565 1 4 . 1 1 97 97 GLU C C 97 179.716 179.716 179.045 0.671 18518
2566 1 4 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.723 0.069 18518
2567 1 4 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.303 0.259 18518
2568 1 4 . 1 1 97 97 GLU H H 97 7.376 7.376 7.799 -0.423 18518
2569 1 4 . 1 1 98 98 VAL N N 98 121.137 121.137 120.654 0.483 18518
2570 1 4 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.667 0.135 18518
2571 1 4 . 1 1 98 98 VAL C C 98 177.637 177.637 178.012 -0.375 18518
2572 1 4 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.387 -0.563 18518
2573 1 4 . 1 1 98 98 VAL CB C 98 32.154 32.154 30.881 1.273 18518
2574 1 4 . 1 1 98 98 VAL H H 98 7.387 7.387 7.938 -0.551 18518
2575 1 4 . 1 1 99 99 TYR N N 99 118.927 118.927 121.671 -2.744 18518
2576 1 4 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.046 -0.056 18518
2577 1 4 . 1 1 99 99 TYR C C 99 176.081 176.081 177.108 -1.027 18518
2578 1 4 . 1 1 99 99 TYR CA C 99 62.223 62.223 61.461 0.762 18518
2579 1 4 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.335 0.647 18518
2580 1 4 . 1 1 99 99 TYR H H 99 9.048 9.048 8.407 0.641 18518
2581 1 4 . 1 1 100 100 GLU N N 100 113.894 113.894 116.743 -2.849 18518
2582 1 4 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.314 0.532 18518
2583 1 4 . 1 1 100 100 GLU C C 100 177.989 177.989 178.102 -0.113 18518
2584 1 4 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.292 0.795 18518
2585 1 4 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.787 0.595 18518
2586 1 4 . 1 1 100 100 GLU H H 100 7.422 7.422 7.895 -0.473 18518
2587 1 4 . 1 1 101 101 SER N N 101 108.991 108.991 113.580 -4.589 18518
2588 1 4 . 1 1 101 101 SER HA H 101 4.524 4.524 4.380 0.144 18518
2589 1 4 . 1 1 101 101 SER C C 101 176.628 176.628 175.540 1.088 18518
2590 1 4 . 1 1 101 101 SER CA C 101 60.349 60.349 60.172 0.177 18518
2591 1 4 . 1 1 101 101 SER CB C 101 64.741 64.741 64.054 0.687 18518
2592 1 4 . 1 1 101 101 SER H H 101 7.424 7.424 7.763 -0.339 18518
2593 1 4 . 1 1 102 102 GLU N N 102 116.533 116.533 119.074 -2.541 18518
2594 1 4 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.535 0.209 18518
2595 1 4 . 1 1 102 102 GLU C C 102 176.774 176.774 175.941 0.833 18518
2596 1 4 . 1 1 102 102 GLU CA C 102 55.581 55.581 54.877 0.704 18518
2597 1 4 . 1 1 102 102 GLU CB C 102 30.697 30.697 30.407 0.290 18518
2598 1 4 . 1 1 102 102 GLU H H 102 8.487 8.487 8.022 0.465 18518
2599 1 4 . 1 1 103 103 LYS N N 103 118.370 118.370 119.080 -0.710 18518
2600 1 4 . 1 1 103 103 LYS HA H 103 4.178 4.178 4.108 0.070 18518
2601 1 4 . 1 1 103 103 LYS C C 103 175.018 175.018 176.708 -1.690 18518
2602 1 4 . 1 1 103 103 LYS CA C 103 57.329 57.329 56.949 0.380 18518
2603 1 4 . 1 1 103 103 LYS CB C 103 32.186 32.186 32.186 0.000 18518
2604 1 4 . 1 1 103 103 LYS H H 103 7.831 7.831 7.582 0.249 18518
2605 1 4 . 1 1 104 104 ASP N N 104 123.500 123.500 123.213 0.287 18518
2606 1 4 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.739 0.016 18518
2607 1 4 . 1 1 104 104 ASP C C 104 177.383 177.383 177.329 0.054 18518
2608 1 4 . 1 1 104 104 ASP CA C 104 53.846 53.846 54.287 -0.441 18518
2609 1 4 . 1 1 104 104 ASP CB C 104 43.411 43.411 43.070 0.341 18518
2610 1 4 . 1 1 104 104 ASP H H 104 9.041 9.041 8.333 0.708 18518
2611 1 4 . 1 1 105 105 GLU N N 105 125.448 125.448 118.430 7.018 18518
2612 1 4 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.229 -0.049 18518
2613 1 4 . 1 1 105 105 GLU C C 105 177.519 177.519 177.198 0.321 18518
2614 1 4 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.690 0.839 18518
2615 1 4 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.760 0.284 18518
2616 1 4 . 1 1 105 105 GLU H H 105 8.906 8.906 8.958 -0.052 18518
2617 1 4 . 1 1 106 106 ASP N N 106 118.824 118.824 115.852 2.972 18518
2618 1 4 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.647 -0.468 18518
2619 1 4 . 1 1 106 106 ASP C C 106 176.223 176.223 176.977 -0.754 18518
2620 1 4 . 1 1 106 106 ASP CA C 106 54.756 54.756 53.760 0.997 18518
2621 1 4 . 1 1 106 106 ASP CB C 106 39.999 39.999 41.461 -1.462 18518
2622 1 4 . 1 1 106 106 ASP H H 106 10.036 10.036 7.980 2.056 18518
2623 1 4 . 1 1 107 107 GLY N N 107 105.866 105.866 107.535 -1.669 18518
2624 1 4 . 1 1 107 107 GLY C C 107 175.136 175.136 174.681 0.455 18518
2625 1 4 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.200 0.022 18518
2626 1 4 . 1 1 107 107 GLY H H 107 8.001 8.001 7.391 0.610 18518
2627 1 4 . 1 1 108 108 PHE N N 108 123.820 123.820 121.129 2.691 18518
2628 1 4 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.506 0.156 18518
2629 1 4 . 1 1 108 108 PHE C C 108 174.899 174.899 174.945 -0.046 18518
2630 1 4 . 1 1 108 108 PHE CA C 108 60.238 60.238 59.605 0.633 18518
2631 1 4 . 1 1 108 108 PHE CB C 108 40.365 40.365 40.156 0.209 18518
2632 1 4 . 1 1 108 108 PHE H H 108 9.912 9.912 8.566 1.346 18518
2633 1 4 . 1 1 109 109 LEU N N 109 120.130 120.130 121.657 -1.527 18518
2634 1 4 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.844 0.186 18518
2635 1 4 . 1 1 109 109 LEU C C 109 173.916 173.916 174.901 -0.985 18518
2636 1 4 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.671 -0.247 18518
2637 1 4 . 1 1 109 109 LEU CB C 109 45.203 45.203 43.961 1.242 18518
2638 1 4 . 1 1 109 109 LEU H H 109 7.997 7.997 8.475 -0.478 18518
2639 1 4 . 1 1 110 110 TYR N N 110 126.579 126.579 125.236 1.343 18518
2640 1 4 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.597 0.406 18518
2641 1 4 . 1 1 110 110 TYR C C 110 176.671 176.671 175.514 1.157 18518
2642 1 4 . 1 1 110 110 TYR CA C 110 59.058 59.058 59.109 -0.051 18518
2643 1 4 . 1 1 110 110 TYR CB C 110 39.556 39.556 39.482 0.074 18518
2644 1 4 . 1 1 110 110 TYR H H 110 9.377 9.377 8.926 0.451 18518
2645 1 4 . 1 1 111 111 MET N N 111 119.240 119.240 120.731 -1.491 18518
2646 1 4 . 1 1 111 111 MET HA H 111 5.486 5.486 5.387 0.099 18518
2647 1 4 . 1 1 111 111 MET C C 111 175.695 175.695 174.603 1.092 18518
2648 1 4 . 1 1 111 111 MET CA C 111 54.124 54.124 54.884 -0.760 18518
2649 1 4 . 1 1 111 111 MET CB C 111 36.960 36.960 37.538 -0.578 18518
2650 1 4 . 1 1 111 111 MET H H 111 9.658 9.658 8.873 0.784 18518
2651 1 4 . 1 1 112 112 VAL N N 112 119.865 119.865 120.276 -0.411 18518
2652 1 4 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.503 0.460 18518
2653 1 4 . 1 1 112 112 VAL C C 112 175.058 175.058 174.832 0.226 18518
2654 1 4 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.745 -0.834 18518
2655 1 4 . 1 1 112 112 VAL CB C 112 36.051 36.051 34.991 1.060 18518
2656 1 4 . 1 1 112 112 VAL H H 112 8.794 8.794 9.089 -0.295 18518
2657 1 4 . 1 1 113 113 TYR N N 113 119.664 119.664 121.727 -2.063 18518
2658 1 4 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.676 0.442 18518
2659 1 4 . 1 1 113 113 TYR C C 113 173.375 173.375 173.415 -0.040 18518
2660 1 4 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.052 -0.899 18518
2661 1 4 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.904 1.408 18518
2662 1 4 . 1 1 113 113 TYR H H 113 8.315 8.315 8.577 -0.262 18518
2663 1 4 . 1 1 114 114 ALA N N 114 119.763 119.763 122.618 -2.855 18518
2664 1 4 . 1 1 114 114 ALA HA H 114 4.800 4.800 4.856 -0.056 18518
2665 1 4 . 1 1 114 114 ALA C C 114 176.216 176.216 174.708 1.508 18518
2666 1 4 . 1 1 114 114 ALA CA C 114 51.132 51.132 52.230 -1.098 18518
2667 1 4 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.256 2.340 18518
2668 1 4 . 1 1 114 114 ALA H H 114 8.465 8.465 8.821 -0.356 18518
2669 1 4 . 1 1 115 115 SER N N 115 114.763 114.763 115.890 -1.127 18518
2670 1 4 . 1 1 115 115 SER HA H 115 4.496 4.496 4.908 -0.412 18518
2671 1 4 . 1 1 115 115 SER C C 115 172.671 172.671 173.336 -0.665 18518
2672 1 4 . 1 1 115 115 SER CA C 115 58.651 58.651 57.282 1.369 18518
2673 1 4 . 1 1 115 115 SER CB C 115 63.526 63.526 61.934 1.593 18518
2674 1 4 . 1 1 115 115 SER H H 115 9.915 9.915 9.041 0.874 18518
2675 1 4 . 1 1 116 116 GLN N N 116 116.611 116.611 123.027 -6.416 18518
2676 1 4 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.550 -0.066 18518
2677 1 4 . 1 1 116 116 GLN C C 116 172.733 172.733 173.365 -0.632 18518
2678 1 4 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.549 -1.623 18518
2679 1 4 . 1 1 116 116 GLN CB C 116 32.358 32.358 29.866 2.492 18518
2680 1 4 . 1 1 116 116 GLN H H 116 7.219 7.219 7.863 -0.644 18518
2681 1 4 . 1 1 117 117 GLU N N 117 117.623 117.623 119.783 -2.160 18518
2682 1 4 . 1 1 117 117 GLU HA H 117 3.287 3.287 3.434 -0.147 18518
2683 1 4 . 1 1 117 117 GLU C C 117 175.168 175.168 175.693 -0.525 18518
2684 1 4 . 1 1 117 117 GLU CA C 117 56.882 56.882 56.035 0.847 18518
2685 1 4 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.705 0.817 18518
2686 1 4 . 1 1 117 117 GLU H H 117 7.882 7.882 8.565 -0.683 18518
2687 1 4 . 1 1 118 118 THR N N 118 109.820 109.820 110.807 -0.987 18518
2688 1 4 . 1 1 118 118 THR HA H 118 4.066 4.066 4.324 -0.258 18518
2689 1 4 . 1 1 118 118 THR C C 118 172.355 172.355 173.736 -1.381 18518
2690 1 4 . 1 1 118 118 THR CA C 118 60.029 60.029 60.670 -0.641 18518
2691 1 4 . 1 1 118 118 THR CB C 118 70.480 70.480 69.843 0.637 18518
2692 1 4 . 1 1 118 118 THR H H 118 6.992 6.992 7.320 -0.328 18518
2693 1 5 . 1 1 2 2 ALA HA H 2 4.336 4.336 5.264 -0.928 18518
2694 1 5 . 1 1 2 2 ALA C C 2 177.974 177.974 176.751 1.223 18518
2695 1 5 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.465 1.320 18518
2696 1 5 . 1 1 2 2 ALA CB C 2 19.444 19.444 20.782 -1.337 18518
2697 1 5 . 1 1 3 3 MET N N 3 119.311 119.311 121.802 -2.491 18518
2698 1 5 . 1 1 3 3 MET HA H 3 4.451 4.451 4.681 -0.230 18518
2699 1 5 . 1 1 3 3 MET C C 3 176.913 176.913 175.681 1.232 18518
2700 1 5 . 1 1 3 3 MET CA C 3 55.679 55.679 55.284 0.395 18518
2701 1 5 . 1 1 3 3 MET CB C 3 32.590 32.590 35.992 -3.401 18518
2702 1 5 . 1 1 3 3 MET H H 3 8.638 8.638 8.593 0.045 18518
2703 1 5 . 1 1 4 4 GLY N N 4 110.281 110.281 110.972 -0.691 18518
2704 1 5 . 1 1 4 4 GLY C C 4 174.180 174.180 173.621 0.559 18518
2705 1 5 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.688 0.807 18518
2706 1 5 . 1 1 4 4 GLY H H 4 8.552 8.552 8.667 -0.115 18518
2707 1 5 . 1 1 5 5 LYS N N 5 120.818 120.818 125.148 -4.330 18518
2708 1 5 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.642 -0.133 18518
2709 1 5 . 1 1 5 5 LYS C C 5 177.605 177.605 175.895 1.710 18518
2710 1 5 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.215 0.919 18518
2711 1 5 . 1 1 5 5 LYS CB C 5 34.813 34.813 32.585 2.228 18518
2712 1 5 . 1 1 5 5 LYS H H 5 8.133 8.133 8.195 -0.062 18518
2713 1 5 . 1 1 6 6 THR N N 6 114.781 114.781 117.735 -2.954 18518
2714 1 5 . 1 1 6 6 THR HA H 6 4.421 4.421 4.460 -0.039 18518
2715 1 5 . 1 1 6 6 THR C C 6 175.524 175.524 175.624 -0.100 18518
2716 1 5 . 1 1 6 6 THR CA C 6 61.127 61.127 60.488 0.639 18518
2717 1 5 . 1 1 6 6 THR CB C 6 69.926 69.926 70.827 -0.901 18518
2718 1 5 . 1 1 6 6 THR H H 6 8.483 8.483 8.106 0.377 18518
2719 1 5 . 1 1 7 7 PHE N N 7 125.552 125.552 120.702 4.850 18518
2720 1 5 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.194 -0.189 18518
2721 1 5 . 1 1 7 7 PHE C C 7 177.397 177.397 176.620 0.777 18518
2722 1 5 . 1 1 7 7 PHE CA C 7 63.393 63.393 61.092 2.301 18518
2723 1 5 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.164 1.403 18518
2724 1 5 . 1 1 7 7 PHE H H 7 10.245 10.245 9.114 1.131 18518
2725 1 5 . 1 1 8 8 LYS N N 8 114.053 114.053 118.113 -4.060 18518
2726 1 5 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.716 0.119 18518
2727 1 5 . 1 1 8 8 LYS C C 8 175.520 175.520 178.442 -2.922 18518
2728 1 5 . 1 1 8 8 LYS CA C 8 59.993 59.993 57.911 2.082 18518
2729 1 5 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.203 2.486 18518
2730 1 5 . 1 1 8 8 LYS H H 8 8.775 8.775 6.783 1.992 18518
2731 1 5 . 1 1 9 9 GLN N N 9 113.516 113.516 118.143 -4.627 18518
2732 1 5 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.142 0.007 18518
2733 1 5 . 1 1 9 9 GLN C C 9 177.615 177.615 177.747 -0.132 18518
2734 1 5 . 1 1 9 9 GLN CA C 9 56.819 56.819 58.313 -1.494 18518
2735 1 5 . 1 1 9 9 GLN CB C 9 30.019 30.019 29.132 0.887 18518
2736 1 5 . 1 1 9 9 GLN H H 9 7.355 7.355 7.521 -0.166 18518
2737 1 5 . 1 1 10 10 ARG N N 10 118.294 118.294 116.087 2.207 18518
2738 1 5 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.236 0.066 18518
2739 1 5 . 1 1 10 10 ARG C C 10 179.380 179.380 176.751 2.629 18518
2740 1 5 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.214 0.054 18518
2741 1 5 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.750 0.891 18518
2742 1 5 . 1 1 10 10 ARG H H 10 7.936 7.936 7.701 0.235 18518
2743 1 5 . 1 1 11 11 ARG N N 11 121.137 121.137 120.101 1.036 18518
2744 1 5 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.606 0.074 18518
2745 1 5 . 1 1 11 11 ARG CA C 11 53.453 53.453 54.382 -0.929 18518
2746 1 5 . 1 1 11 11 ARG CB C 11 32.938 32.938 32.937 0.001 18518
2747 1 5 . 1 1 11 11 ARG H H 11 7.390 7.390 7.719 -0.329 18518
2748 1 5 . 1 1 12 12 THR N N 12 116.819 116.819 118.194 -1.375 18518
2749 1 5 . 1 1 12 12 THR HA H 12 4.359 4.359 4.286 0.073 18518
2750 1 5 . 1 1 12 12 THR C C 12 174.989 174.989 176.057 -1.068 18518
2751 1 5 . 1 1 12 12 THR CA C 12 61.748 61.748 63.153 -1.405 18518
2752 1 5 . 1 1 12 12 THR CB C 12 71.068 71.068 70.140 0.928 18518
2753 1 5 . 1 1 12 12 THR H H 12 8.953 8.953 8.355 0.598 18518
2754 1 5 . 1 1 13 13 PHE N N 13 123.200 123.200 122.629 0.571 18518
2755 1 5 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.237 -0.209 18518
2756 1 5 . 1 1 13 13 PHE C C 13 176.029 176.029 176.940 -0.911 18518
2757 1 5 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.561 0.303 18518
2758 1 5 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.225 0.335 18518
2759 1 5 . 1 1 13 13 PHE H H 13 9.284 9.284 9.008 0.276 18518
2760 1 5 . 1 1 14 14 GLU N N 14 115.414 115.414 117.992 -2.578 18518
2761 1 5 . 1 1 14 14 GLU HA H 14 3.794 3.794 3.864 -0.070 18518
2762 1 5 . 1 1 14 14 GLU C C 14 180.081 180.081 179.128 0.953 18518
2763 1 5 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.989 0.630 18518
2764 1 5 . 1 1 14 14 GLU CB C 14 28.852 28.852 28.527 0.325 18518
2765 1 5 . 1 1 14 14 GLU H H 14 8.973 8.973 8.831 0.142 18518
2766 1 5 . 1 1 15 15 GLN N N 15 119.276 119.276 118.730 0.546 18518
2767 1 5 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.111 -0.111 18518
2768 1 5 . 1 1 15 15 GLN C C 15 177.978 177.978 178.610 -0.632 18518
2769 1 5 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.781 0.054 18518
2770 1 5 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.256 1.115 18518
2771 1 5 . 1 1 15 15 GLN H H 15 7.756 7.756 8.478 -0.722 18518
2772 1 5 . 1 1 16 16 ARG N N 16 121.336 121.336 120.171 1.165 18518
2773 1 5 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.084 0.186 18518
2774 1 5 . 1 1 16 16 ARG C C 16 177.416 177.416 178.674 -1.258 18518
2775 1 5 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.842 1.533 18518
2776 1 5 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.293 0.312 18518
2777 1 5 . 1 1 16 16 ARG H H 16 8.645 8.645 8.182 0.463 18518
2778 1 5 . 1 1 17 17 VAL N N 17 117.630 117.630 120.029 -2.399 18518
2779 1 5 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.631 0.226 18518
2780 1 5 . 1 1 17 17 VAL C C 17 179.748 179.748 178.399 1.349 18518
2781 1 5 . 1 1 17 17 VAL CA C 17 65.726 65.726 66.642 -0.916 18518
2782 1 5 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.165 1.029 18518
2783 1 5 . 1 1 17 17 VAL H H 17 8.373 8.373 8.267 0.106 18518
2784 1 5 . 1 1 18 18 GLU N N 18 120.864 120.864 119.742 1.122 18518
2785 1 5 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.949 0.353 18518
2786 1 5 . 1 1 18 18 GLU C C 18 177.728 177.728 178.823 -1.095 18518
2787 1 5 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.983 -1.497 18518
2788 1 5 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.237 0.145 18518
2789 1 5 . 1 1 18 18 GLU H H 18 7.368 7.368 7.788 -0.420 18518
2790 1 5 . 1 1 19 19 ASP N N 19 121.425 121.425 119.898 1.527 18518
2791 1 5 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.446 -0.012 18518
2792 1 5 . 1 1 19 19 ASP C C 19 179.978 179.978 178.758 1.220 18518
2793 1 5 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.392 0.030 18518
2794 1 5 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.828 0.459 18518
2795 1 5 . 1 1 19 19 ASP H H 19 8.671 8.671 8.070 0.601 18518
2796 1 5 . 1 1 20 20 VAL N N 20 119.730 119.730 117.880 1.850 18518
2797 1 5 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.593 -0.388 18518
2798 1 5 . 1 1 20 20 VAL C C 20 176.284 176.284 177.938 -1.654 18518
2799 1 5 . 1 1 20 20 VAL CA C 20 66.315 66.315 66.040 0.275 18518
2800 1 5 . 1 1 20 20 VAL CB C 20 31.107 31.107 30.773 0.334 18518
2801 1 5 . 1 1 20 20 VAL H H 20 7.999 7.999 8.346 -0.347 18518
2802 1 5 . 1 1 21 21 ARG N N 21 121.455 121.455 119.911 1.544 18518
2803 1 5 . 1 1 21 21 ARG HA H 21 3.814 3.814 4.047 -0.233 18518
2804 1 5 . 1 1 21 21 ARG C C 21 180.120 180.120 178.751 1.369 18518
2805 1 5 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.700 1.130 18518
2806 1 5 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.225 0.721 18518
2807 1 5 . 1 1 21 21 ARG H H 21 8.098 8.098 8.019 0.079 18518
2808 1 5 . 1 1 22 22 LEU N N 22 117.826 117.826 121.321 -3.495 18518
2809 1 5 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.000 0.049 18518
2810 1 5 . 1 1 22 22 LEU C C 22 180.115 180.115 179.231 0.884 18518
2811 1 5 . 1 1 22 22 LEU CA C 22 57.790 57.790 58.123 -0.333 18518
2812 1 5 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.907 0.235 18518
2813 1 5 . 1 1 22 22 LEU H H 22 8.207 8.207 8.227 -0.020 18518
2814 1 5 . 1 1 23 23 ILE N N 23 121.450 121.450 119.151 2.299 18518
2815 1 5 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.627 0.386 18518
2816 1 5 . 1 1 23 23 ILE C C 23 178.149 178.149 177.672 0.477 18518
2817 1 5 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.951 -2.780 18518
2818 1 5 . 1 1 23 23 ILE CB C 23 38.106 38.106 38.034 0.072 18518
2819 1 5 . 1 1 23 23 ILE H H 23 8.105 8.105 8.382 -0.277 18518
2820 1 5 . 1 1 24 24 ARG N N 24 121.139 121.139 118.632 2.507 18518
2821 1 5 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.219 -0.232 18518
2822 1 5 . 1 1 24 24 ARG C C 24 178.702 178.702 177.967 0.735 18518
2823 1 5 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.525 -0.807 18518
2824 1 5 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.797 -1.028 18518
2825 1 5 . 1 1 24 24 ARG H H 24 8.601 8.601 7.734 0.867 18518
2826 1 5 . 1 1 25 25 GLU N N 25 118.054 118.054 119.025 -0.971 18518
2827 1 5 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.130 -0.104 18518
2828 1 5 . 1 1 25 25 GLU C C 25 178.492 178.492 178.675 -0.183 18518
2829 1 5 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.700 0.080 18518
2830 1 5 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.957 0.044 18518
2831 1 5 . 1 1 25 25 GLU H H 25 7.423 7.423 7.691 -0.268 18518
2832 1 5 . 1 1 26 26 GLN N N 26 116.350 116.350 116.341 0.009 18518
2833 1 5 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.079 -0.143 18518
2834 1 5 . 1 1 26 26 GLN C C 26 176.305 176.305 177.017 -0.712 18518
2835 1 5 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.407 0.096 18518
2836 1 5 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.818 0.389 18518
2837 1 5 . 1 1 26 26 GLN H H 26 7.524 7.524 7.798 -0.274 18518
2838 1 5 . 1 1 27 27 HIS N N 27 116.017 116.017 117.931 -1.914 18518
2839 1 5 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.161 -0.231 18518
2840 1 5 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.631 0.423 18518
2841 1 5 . 1 1 27 27 HIS CB C 27 30.747 30.747 30.166 0.581 18518
2842 1 5 . 1 1 27 27 HIS H H 27 8.284 8.284 8.227 0.057 18518
2843 1 5 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.516 0.065 18518
2844 1 5 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.317 0.602 18518
2845 1 5 . 1 1 28 28 PRO CB C 28 32.455 32.455 31.863 0.592 18518
2846 1 5 . 1 1 29 29 THR N N 29 107.011 107.011 108.121 -1.110 18518
2847 1 5 . 1 1 29 29 THR HA H 29 4.599 4.599 4.736 -0.137 18518
2848 1 5 . 1 1 29 29 THR C C 29 172.884 172.884 173.986 -1.102 18518
2849 1 5 . 1 1 29 29 THR CA C 29 60.810 60.810 60.807 0.003 18518
2850 1 5 . 1 1 29 29 THR CB C 29 68.531 68.531 69.151 -0.620 18518
2851 1 5 . 1 1 29 29 THR H H 29 7.890 7.890 8.273 -0.383 18518
2852 1 5 . 1 1 30 30 LYS N N 30 117.679 117.679 121.842 -4.163 18518
2853 1 5 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.819 0.039 18518
2854 1 5 . 1 1 30 30 LYS C C 30 174.310 174.310 174.668 -0.358 18518
2855 1 5 . 1 1 30 30 LYS CA C 30 53.751 53.751 54.005 -0.254 18518
2856 1 5 . 1 1 30 30 LYS CB C 30 35.804 35.804 35.611 0.193 18518
2857 1 5 . 1 1 30 30 LYS H H 30 7.441 7.441 7.758 -0.317 18518
2858 1 5 . 1 1 31 31 ILE N N 31 122.849 122.849 124.742 -1.893 18518
2859 1 5 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.185 -0.080 18518
2860 1 5 . 1 1 31 31 ILE CA C 31 54.801 54.801 56.557 -1.756 18518
2861 1 5 . 1 1 31 31 ILE CB C 31 38.265 38.265 37.217 1.048 18518
2862 1 5 . 1 1 31 31 ILE H H 31 9.304 9.304 8.924 0.380 18518
2863 1 5 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.988 0.171 18518
2864 1 5 . 1 1 32 32 PRO C C 32 174.164 174.164 176.590 -2.426 18518
2865 1 5 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.197 -0.694 18518
2866 1 5 . 1 1 32 32 PRO CB C 32 31.145 31.145 30.478 0.667 18518
2867 1 5 . 1 1 33 33 VAL N N 33 125.606 125.606 120.103 5.503 18518
2868 1 5 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.431 -0.218 18518
2869 1 5 . 1 1 33 33 VAL C C 33 173.654 173.654 174.096 -0.442 18518
2870 1 5 . 1 1 33 33 VAL CA C 33 60.044 60.044 58.691 1.353 18518
2871 1 5 . 1 1 33 33 VAL CB C 33 35.604 35.604 35.938 -0.334 18518
2872 1 5 . 1 1 33 33 VAL H H 33 9.424 9.424 8.826 0.598 18518
2873 1 5 . 1 1 34 34 ILE N N 34 128.241 128.241 122.993 5.248 18518
2874 1 5 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.779 0.054 18518
2875 1 5 . 1 1 34 34 ILE C C 34 175.605 175.605 175.112 0.493 18518
2876 1 5 . 1 1 34 34 ILE CA C 34 56.765 56.765 57.998 -1.233 18518
2877 1 5 . 1 1 34 34 ILE CB C 34 36.799 36.799 39.056 -2.257 18518
2878 1 5 . 1 1 34 34 ILE H H 34 8.721 8.721 8.847 -0.126 18518
2879 1 5 . 1 1 35 35 ILE N N 35 125.650 125.650 126.932 -1.282 18518
2880 1 5 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.663 0.173 18518
2881 1 5 . 1 1 35 35 ILE C C 35 174.887 174.887 174.232 0.655 18518
2882 1 5 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.254 0.691 18518
2883 1 5 . 1 1 35 35 ILE CB C 35 39.210 39.210 39.950 -0.740 18518
2884 1 5 . 1 1 35 35 ILE H H 35 9.034 9.034 8.993 0.041 18518
2885 1 5 . 1 1 36 36 GLU N N 36 122.657 122.657 126.386 -3.729 18518
2886 1 5 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.857 0.004 18518
2887 1 5 . 1 1 36 36 GLU C C 36 173.848 173.848 174.985 -1.137 18518
2888 1 5 . 1 1 36 36 GLU CA C 36 53.932 53.932 53.855 0.077 18518
2889 1 5 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.488 0.794 18518
2890 1 5 . 1 1 36 36 GLU H H 36 8.303 8.303 8.369 -0.066 18518
2891 1 5 . 1 1 37 37 ARG N N 37 123.228 123.228 127.663 -4.435 18518
2892 1 5 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.355 -0.629 18518
2893 1 5 . 1 1 37 37 ARG C C 37 176.359 176.359 175.946 0.413 18518
2894 1 5 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.517 -0.158 18518
2895 1 5 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.310 1.031 18518
2896 1 5 . 1 1 37 37 ARG H H 37 8.856 8.856 8.760 0.096 18518
2897 1 5 . 1 1 38 38 TYR N N 38 128.981 128.981 128.852 0.129 18518
2898 1 5 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.268 0.084 18518
2899 1 5 . 1 1 38 38 TYR C C 38 177.316 177.316 176.566 0.750 18518
2900 1 5 . 1 1 38 38 TYR CA C 38 57.712 57.712 58.539 -0.827 18518
2901 1 5 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.060 -0.588 18518
2902 1 5 . 1 1 38 38 TYR H H 38 8.628 8.628 8.519 0.109 18518
2903 1 5 . 1 1 39 39 LYS N N 39 130.635 130.635 125.263 5.372 18518
2904 1 5 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.808 0.014 18518
2905 1 5 . 1 1 39 39 LYS CA C 39 58.887 58.887 57.904 0.984 18518
2906 1 5 . 1 1 39 39 LYS CB C 39 31.771 31.771 32.031 -0.260 18518
2907 1 5 . 1 1 39 39 LYS H H 39 8.594 8.594 8.059 0.535 18518
2908 1 5 . 1 1 40 40 GLY C C 40 173.447 173.447 173.948 -0.501 18518
2909 1 5 . 1 1 40 40 GLY CA C 40 44.663 44.663 43.981 0.682 18518
2910 1 5 . 1 1 40 40 GLY H H 40 5.188 5.188 6.494 -1.306 18518
2911 1 5 . 1 1 41 41 GLU N N 41 122.836 122.836 121.232 1.604 18518
2912 1 5 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.274 -0.017 18518
2913 1 5 . 1 1 41 41 GLU C C 41 176.524 176.524 176.310 0.214 18518
2914 1 5 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.485 0.040 18518
2915 1 5 . 1 1 41 41 GLU CB C 41 30.985 30.985 29.753 1.232 18518
2916 1 5 . 1 1 41 41 GLU H H 41 7.380 7.380 7.467 -0.087 18518
2917 1 5 . 1 1 42 42 LYS N N 42 124.040 124.040 125.550 -1.510 18518
2918 1 5 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.452 0.223 18518
2919 1 5 . 1 1 42 42 LYS C C 42 177.538 177.538 177.074 0.464 18518
2920 1 5 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.776 -0.936 18518
2921 1 5 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.141 1.838 18518
2922 1 5 . 1 1 42 42 LYS H H 42 9.034 9.034 8.485 0.549 18518
2923 1 5 . 1 1 43 43 GLN N N 43 119.259 119.259 119.191 0.068 18518
2924 1 5 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.405 0.137 18518
2925 1 5 . 1 1 43 43 GLN C C 43 177.336 177.336 176.334 1.002 18518
2926 1 5 . 1 1 43 43 GLN CA C 43 57.673 57.673 57.107 0.566 18518
2927 1 5 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.052 0.730 18518
2928 1 5 . 1 1 43 43 GLN H H 43 8.435 8.435 8.773 -0.338 18518
2929 1 5 . 1 1 44 44 LEU N N 44 120.760 120.760 122.599 -1.839 18518
2930 1 5 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.591 0.104 18518
2931 1 5 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.744 0.501 18518
2932 1 5 . 1 1 44 44 LEU CB C 44 43.596 43.596 42.658 0.938 18518
2933 1 5 . 1 1 44 44 LEU H H 44 9.126 9.126 8.205 0.921 18518
2934 1 5 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.570 0.147 18518
2935 1 5 . 1 1 45 45 PRO C C 45 175.797 175.797 176.216 -0.419 18518
2936 1 5 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.394 -0.283 18518
2937 1 5 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.368 0.224 18518
2938 1 5 . 1 1 46 46 VAL N N 46 119.052 119.052 120.842 -1.790 18518
2939 1 5 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.430 -0.563 18518
2940 1 5 . 1 1 46 46 VAL C C 46 175.640 175.640 176.406 -0.766 18518
2941 1 5 . 1 1 46 46 VAL CA C 46 62.944 62.944 61.759 1.185 18518
2942 1 5 . 1 1 46 46 VAL CB C 46 32.799 32.799 33.086 -0.287 18518
2943 1 5 . 1 1 46 46 VAL H H 46 8.543 8.543 8.244 0.299 18518
2944 1 5 . 1 1 47 47 LEU N N 47 130.203 130.203 127.098 3.105 18518
2945 1 5 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.472 -0.163 18518
2946 1 5 . 1 1 47 47 LEU C C 47 176.198 176.198 177.499 -1.301 18518
2947 1 5 . 1 1 47 47 LEU CA C 47 55.006 55.006 54.851 0.155 18518
2948 1 5 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.826 1.006 18518
2949 1 5 . 1 1 47 47 LEU H H 47 7.799 7.799 8.484 -0.685 18518
2950 1 5 . 1 1 48 48 ASP N N 48 122.403 122.403 120.125 2.278 18518
2951 1 5 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.508 -0.245 18518
2952 1 5 . 1 1 48 48 ASP C C 48 175.294 175.294 176.057 -0.763 18518
2953 1 5 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.749 0.083 18518
2954 1 5 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.446 -1.262 18518
2955 1 5 . 1 1 48 48 ASP H H 48 8.780 8.780 8.532 0.248 18518
2956 1 5 . 1 1 49 49 LYS N N 49 119.569 119.569 115.989 3.580 18518
2957 1 5 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.498 0.087 18518
2958 1 5 . 1 1 49 49 LYS C C 49 174.678 174.678 174.837 -0.159 18518
2959 1 5 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.415 -1.763 18518
2960 1 5 . 1 1 49 49 LYS CB C 49 35.945 35.945 33.908 2.037 18518
2961 1 5 . 1 1 49 49 LYS H H 49 7.280 7.280 7.544 -0.264 18518
2962 1 5 . 1 1 50 50 THR N N 50 110.862 110.862 112.642 -1.780 18518
2963 1 5 . 1 1 50 50 THR HA H 50 4.811 4.811 4.844 -0.033 18518
2964 1 5 . 1 1 50 50 THR C C 50 172.425 172.425 174.050 -1.625 18518
2965 1 5 . 1 1 50 50 THR CA C 50 62.645 62.645 62.005 0.640 18518
2966 1 5 . 1 1 50 50 THR CB C 50 71.648 71.648 70.288 1.360 18518
2967 1 5 . 1 1 50 50 THR H H 50 8.042 8.042 8.225 -0.183 18518
2968 1 5 . 1 1 51 51 LYS N N 51 120.008 120.008 123.268 -3.260 18518
2969 1 5 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.562 0.063 18518
2970 1 5 . 1 1 51 51 LYS C C 51 175.082 175.082 175.381 -0.299 18518
2971 1 5 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.265 -1.561 18518
2972 1 5 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.027 -0.651 18518
2973 1 5 . 1 1 51 51 LYS H H 51 7.119 7.119 7.589 -0.470 18518
2974 1 5 . 1 1 52 52 PHE N N 52 122.640 122.640 122.757 -0.117 18518
2975 1 5 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.804 0.533 18518
2976 1 5 . 1 1 52 52 PHE C C 52 174.213 174.213 174.512 -0.299 18518
2977 1 5 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.506 0.105 18518
2978 1 5 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.211 -0.071 18518
2979 1 5 . 1 1 52 52 PHE H H 52 9.709 9.709 9.235 0.474 18518
2980 1 5 . 1 1 53 53 LEU N N 53 122.157 122.157 122.781 -0.624 18518
2981 1 5 . 1 1 53 53 LEU HA H 53 4.947 4.947 5.024 -0.077 18518
2982 1 5 . 1 1 53 53 LEU C C 53 175.769 175.769 175.660 0.109 18518
2983 1 5 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.722 -0.765 18518
2984 1 5 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.822 0.593 18518
2985 1 5 . 1 1 53 53 LEU H H 53 8.959 8.959 8.401 0.558 18518
2986 1 5 . 1 1 54 54 VAL N N 54 124.919 124.919 124.943 -0.024 18518
2987 1 5 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.580 -0.021 18518
2988 1 5 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.237 0.893 18518
2989 1 5 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.144 1.824 18518
2990 1 5 . 1 1 54 54 VAL H H 54 8.922 8.922 8.511 0.411 18518
2991 1 5 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.741 -0.300 18518
2992 1 5 . 1 1 55 55 PRO C C 55 176.594 176.594 178.088 -1.494 18518
2993 1 5 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.146 2.169 18518
2994 1 5 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.066 0.600 18518
2995 1 5 . 1 1 56 56 ASP N N 56 120.522 120.522 121.577 -1.055 18518
2996 1 5 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.186 -0.324 18518
2997 1 5 . 1 1 56 56 ASP C C 56 175.809 175.809 177.401 -1.592 18518
2998 1 5 . 1 1 56 56 ASP CA C 56 56.749 56.749 57.166 -0.417 18518
2999 1 5 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.272 0.238 18518
3000 1 5 . 1 1 56 56 ASP H H 56 8.347 8.347 8.353 -0.006 18518
3001 1 5 . 1 1 57 57 HIS N N 57 113.482 113.482 115.160 -1.678 18518
3002 1 5 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.515 0.205 18518
3003 1 5 . 1 1 57 57 HIS C C 57 176.507 176.507 175.221 1.286 18518
3004 1 5 . 1 1 57 57 HIS CA C 57 55.589 55.589 56.194 -0.605 18518
3005 1 5 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.674 0.970 18518
3006 1 5 . 1 1 57 57 HIS H H 57 7.557 7.557 8.122 -0.565 18518
3007 1 5 . 1 1 58 58 VAL N N 58 123.279 123.279 116.899 6.380 18518
3008 1 5 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.363 -0.527 18518
3009 1 5 . 1 1 58 58 VAL C C 58 175.019 175.019 174.853 0.166 18518
3010 1 5 . 1 1 58 58 VAL CA C 58 62.823 62.823 60.849 1.974 18518
3011 1 5 . 1 1 58 58 VAL CB C 58 32.310 32.310 33.707 -1.397 18518
3012 1 5 . 1 1 58 58 VAL H H 58 7.345 7.345 7.284 0.061 18518
3013 1 5 . 1 1 59 59 ASN N N 59 123.781 123.781 119.017 4.764 18518
3014 1 5 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.057 0.069 18518
3015 1 5 . 1 1 59 59 ASN C C 59 176.558 176.558 176.266 0.292 18518
3016 1 5 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.293 0.192 18518
3017 1 5 . 1 1 59 59 ASN CB C 59 40.107 40.107 41.071 -0.964 18518
3018 1 5 . 1 1 59 59 ASN H H 59 8.735 8.735 8.216 0.519 18518
3019 1 5 . 1 1 60 60 MET N N 60 117.453 117.453 118.758 -1.305 18518
3020 1 5 . 1 1 60 60 MET HA H 60 4.395 4.395 4.035 0.360 18518
3021 1 5 . 1 1 60 60 MET C C 60 178.144 178.144 178.069 0.075 18518
3022 1 5 . 1 1 60 60 MET CA C 60 57.097 57.097 59.958 -2.861 18518
3023 1 5 . 1 1 60 60 MET CB C 60 30.140 30.140 32.256 -2.116 18518
3024 1 5 . 1 1 60 60 MET H H 60 8.227 8.227 8.336 -0.109 18518
3025 1 5 . 1 1 61 61 SER N N 61 114.216 114.216 115.082 -0.866 18518
3026 1 5 . 1 1 61 61 SER HA H 61 4.111 4.111 4.091 0.020 18518
3027 1 5 . 1 1 61 61 SER C C 61 177.335 177.335 176.977 0.358 18518
3028 1 5 . 1 1 61 61 SER CA C 61 61.590 61.590 62.392 -0.801 18518
3029 1 5 . 1 1 61 61 SER CB C 61 62.402 62.402 62.742 -0.340 18518
3030 1 5 . 1 1 61 61 SER H H 61 8.464 8.464 8.547 -0.083 18518
3031 1 5 . 1 1 62 62 GLU N N 62 123.004 123.004 121.088 1.916 18518
3032 1 5 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.123 -0.076 18518
3033 1 5 . 1 1 62 62 GLU C C 62 178.686 178.686 178.810 -0.124 18518
3034 1 5 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.862 -0.237 18518
3035 1 5 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.339 0.315 18518
3036 1 5 . 1 1 62 62 GLU H H 62 7.994 7.994 7.676 0.318 18518
3037 1 5 . 1 1 63 63 LEU N N 63 120.818 120.818 121.837 -1.019 18518
3038 1 5 . 1 1 63 63 LEU HA H 63 3.965 3.965 4.012 -0.047 18518
3039 1 5 . 1 1 63 63 LEU C C 63 178.046 178.046 178.934 -0.888 18518
3040 1 5 . 1 1 63 63 LEU CA C 63 57.920 57.920 58.057 -0.138 18518
3041 1 5 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.381 0.243 18518
3042 1 5 . 1 1 63 63 LEU H H 63 8.130 8.130 7.791 0.339 18518
3043 1 5 . 1 1 64 64 ILE N N 64 118.528 118.528 118.907 -0.379 18518
3044 1 5 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.604 -0.235 18518
3045 1 5 . 1 1 64 64 ILE C C 64 177.127 177.127 177.845 -0.718 18518
3046 1 5 . 1 1 64 64 ILE CA C 64 66.678 66.678 65.851 0.827 18518
3047 1 5 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.556 0.888 18518
3048 1 5 . 1 1 64 64 ILE H H 64 8.488 8.488 8.643 -0.155 18518
3049 1 5 . 1 1 65 65 LYS N N 65 118.336 118.336 120.930 -2.594 18518
3050 1 5 . 1 1 65 65 LYS HA H 65 3.701 3.701 4.003 -0.302 18518
3051 1 5 . 1 1 65 65 LYS C C 65 179.291 179.291 179.174 0.117 18518
3052 1 5 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.736 0.704 18518
3053 1 5 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.290 0.081 18518
3054 1 5 . 1 1 65 65 LYS H H 65 7.347 7.347 7.794 -0.447 18518
3055 1 5 . 1 1 66 66 ILE N N 66 120.171 120.171 120.295 -0.124 18518
3056 1 5 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.698 -0.120 18518
3057 1 5 . 1 1 66 66 ILE C C 66 178.873 178.873 178.255 0.618 18518
3058 1 5 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.440 -0.280 18518
3059 1 5 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.864 0.769 18518
3060 1 5 . 1 1 66 66 ILE H H 66 7.901 7.901 8.443 -0.542 18518
3061 1 5 . 1 1 67 67 ILE N N 67 121.185 121.185 120.545 0.640 18518
3062 1 5 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.562 -0.116 18518
3063 1 5 . 1 1 67 67 ILE C C 67 177.150 177.150 177.874 -0.724 18518
3064 1 5 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.089 -1.283 18518
3065 1 5 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.051 -2.057 18518
3066 1 5 . 1 1 67 67 ILE H H 67 8.290 8.290 8.007 0.283 18518
3067 1 5 . 1 1 68 68 ARG N N 68 119.173 119.173 118.719 0.454 18518
3068 1 5 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.744 -0.813 18518
3069 1 5 . 1 1 68 68 ARG C C 68 178.496 178.496 178.686 -0.190 18518
3070 1 5 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.546 1.090 18518
3071 1 5 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.866 0.574 18518
3072 1 5 . 1 1 68 68 ARG H H 68 8.438 8.438 8.269 0.169 18518
3073 1 5 . 1 1 69 69 ARG N N 69 116.511 116.511 120.149 -3.638 18518
3074 1 5 . 1 1 69 69 ARG HA H 69 4.134 4.134 3.974 0.160 18518
3075 1 5 . 1 1 69 69 ARG C C 69 180.262 180.262 178.385 1.877 18518
3076 1 5 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.235 -0.528 18518
3077 1 5 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.214 -0.261 18518
3078 1 5 . 1 1 69 69 ARG H H 69 7.497 7.497 8.223 -0.726 18518
3079 1 5 . 1 1 70 70 ARG N N 70 123.297 123.297 117.179 6.118 18518
3080 1 5 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.146 -0.130 18518
3081 1 5 . 1 1 70 70 ARG C C 70 178.700 178.700 178.236 0.464 18518
3082 1 5 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.233 1.227 18518
3083 1 5 . 1 1 70 70 ARG CB C 70 30.312 30.312 30.011 0.301 18518
3084 1 5 . 1 1 70 70 ARG H H 70 8.075 8.075 7.808 0.267 18518
3085 1 5 . 1 1 71 71 LEU N N 71 116.829 116.829 120.094 -3.265 18518
3086 1 5 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.128 -0.063 18518
3087 1 5 . 1 1 71 71 LEU C C 71 174.956 174.956 176.302 -1.346 18518
3088 1 5 . 1 1 71 71 LEU CA C 71 55.126 55.126 55.568 -0.442 18518
3089 1 5 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.461 0.785 18518
3090 1 5 . 1 1 71 71 LEU H H 71 7.719 7.719 7.962 -0.243 18518
3091 1 5 . 1 1 72 72 GLN N N 72 114.991 114.991 113.654 1.337 18518
3092 1 5 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.888 -0.052 18518
3093 1 5 . 1 1 72 72 GLN C C 72 175.683 175.683 175.395 0.288 18518
3094 1 5 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.250 0.075 18518
3095 1 5 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.582 0.422 18518
3096 1 5 . 1 1 72 72 GLN H H 72 7.744 7.744 7.795 -0.051 18518
3097 1 5 . 1 1 73 73 LEU N N 73 115.045 115.045 116.528 -1.483 18518
3098 1 5 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.151 0.085 18518
3099 1 5 . 1 1 73 73 LEU C C 73 178.762 178.762 176.994 1.768 18518
3100 1 5 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.468 -1.083 18518
3101 1 5 . 1 1 73 73 LEU CB C 73 42.091 42.091 42.495 -0.404 18518
3102 1 5 . 1 1 73 73 LEU H H 73 7.500 7.500 7.327 0.173 18518
3103 1 5 . 1 1 74 74 ASN N N 74 121.700 121.700 119.280 2.420 18518
3104 1 5 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.685 0.005 18518
3105 1 5 . 1 1 74 74 ASN C C 74 176.617 176.617 175.269 1.348 18518
3106 1 5 . 1 1 74 74 ASN CA C 74 52.685 52.685 52.931 -0.246 18518
3107 1 5 . 1 1 74 74 ASN CB C 74 39.598 39.598 40.095 -0.497 18518
3108 1 5 . 1 1 74 74 ASN H H 74 9.045 9.045 8.418 0.627 18518
3109 1 5 . 1 1 75 75 ALA N N 75 123.952 123.952 122.022 1.930 18518
3110 1 5 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.365 -0.401 18518
3111 1 5 . 1 1 75 75 ALA C C 75 178.131 178.131 177.250 0.881 18518
3112 1 5 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.701 1.167 18518
3113 1 5 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.496 -0.778 18518
3114 1 5 . 1 1 75 75 ALA H H 75 8.784 8.784 8.474 0.310 18518
3115 1 5 . 1 1 76 76 ASN N N 76 112.295 112.295 116.464 -4.169 18518
3116 1 5 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.617 -0.037 18518
3117 1 5 . 1 1 76 76 ASN C C 76 175.448 175.448 175.570 -0.122 18518
3118 1 5 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.627 -0.413 18518
3119 1 5 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.345 -0.025 18518
3120 1 5 . 1 1 76 76 ASN H H 76 8.391 8.391 8.409 -0.018 18518
3121 1 5 . 1 1 77 77 GLN N N 77 120.577 120.577 118.115 2.462 18518
3122 1 5 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.653 -0.380 18518
3123 1 5 . 1 1 77 77 GLN C C 77 175.045 175.045 173.871 1.174 18518
3124 1 5 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.974 0.831 18518
3125 1 5 . 1 1 77 77 GLN CB C 77 30.157 30.157 30.616 -0.459 18518
3126 1 5 . 1 1 77 77 GLN H H 77 7.552 7.552 7.546 0.006 18518
3127 1 5 . 1 1 78 78 ALA N N 78 130.670 130.670 122.844 7.826 18518
3128 1 5 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.611 -0.440 18518
3129 1 5 . 1 1 78 78 ALA C C 78 176.512 176.512 174.995 1.517 18518
3130 1 5 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.154 1.688 18518
3131 1 5 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.629 -1.569 18518
3132 1 5 . 1 1 78 78 ALA H H 78 8.799 8.799 8.747 0.052 18518
3133 1 5 . 1 1 79 79 PHE N N 79 119.325 119.325 118.725 0.600 18518
3134 1 5 . 1 1 79 79 PHE HA H 79 4.434 4.434 5.278 -0.844 18518
3135 1 5 . 1 1 79 79 PHE C C 79 171.726 171.726 172.264 -0.538 18518
3136 1 5 . 1 1 79 79 PHE CA C 79 59.145 59.145 56.247 2.898 18518
3137 1 5 . 1 1 79 79 PHE CB C 79 42.171 42.171 42.694 -0.523 18518
3138 1 5 . 1 1 79 79 PHE H H 79 7.664 7.664 7.904 -0.240 18518
3139 1 5 . 1 1 80 80 PHE N N 80 126.314 126.314 118.689 7.625 18518
3140 1 5 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.445 -0.053 18518
3141 1 5 . 1 1 80 80 PHE C C 80 177.169 177.169 173.408 3.761 18518
3142 1 5 . 1 1 80 80 PHE CA C 80 56.653 56.653 55.751 0.902 18518
3143 1 5 . 1 1 80 80 PHE CB C 80 41.933 41.933 42.663 -0.731 18518
3144 1 5 . 1 1 80 80 PHE H H 80 8.508 8.508 8.715 -0.207 18518
3145 1 5 . 1 1 81 81 LEU N N 81 121.426 121.426 122.643 -1.217 18518
3146 1 5 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.168 -0.317 18518
3147 1 5 . 1 1 81 81 LEU C C 81 174.488 174.488 174.973 -0.485 18518
3148 1 5 . 1 1 81 81 LEU CA C 81 53.197 53.197 53.727 -0.530 18518
3149 1 5 . 1 1 81 81 LEU CB C 81 45.100 45.100 44.197 0.902 18518
3150 1 5 . 1 1 81 81 LEU H H 81 8.229 8.229 8.498 -0.269 18518
3151 1 5 . 1 1 82 82 LEU N N 82 125.155 125.155 127.358 -2.203 18518
3152 1 5 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.506 0.327 18518
3153 1 5 . 1 1 82 82 LEU C C 82 177.166 177.166 175.570 1.596 18518
3154 1 5 . 1 1 82 82 LEU CA C 82 54.197 54.197 53.959 0.237 18518
3155 1 5 . 1 1 82 82 LEU CB C 82 43.442 43.442 44.250 -0.808 18518
3156 1 5 . 1 1 82 82 LEU H H 82 9.400 9.400 9.274 0.126 18518
3157 1 5 . 1 1 83 83 VAL N N 83 123.886 123.886 122.361 1.525 18518
3158 1 5 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.494 -0.115 18518
3159 1 5 . 1 1 83 83 VAL C C 83 175.810 175.810 176.280 -0.470 18518
3160 1 5 . 1 1 83 83 VAL CA C 83 61.677 61.677 61.959 -0.282 18518
3161 1 5 . 1 1 83 83 VAL CB C 83 33.758 33.758 32.440 1.318 18518
3162 1 5 . 1 1 83 83 VAL H H 83 8.721 8.721 8.476 0.245 18518
3163 1 5 . 1 1 84 84 ASN N N 84 126.474 126.474 128.091 -1.617 18518
3164 1 5 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.488 -0.092 18518
3165 1 5 . 1 1 84 84 ASN C C 84 175.164 175.164 174.861 0.303 18518
3166 1 5 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.500 0.238 18518
3167 1 5 . 1 1 84 84 ASN CB C 84 37.950 37.950 37.201 0.749 18518
3168 1 5 . 1 1 84 84 ASN H H 84 9.707 9.707 9.575 0.132 18518
3169 1 5 . 1 1 85 85 GLY N N 85 101.296 101.296 103.833 -2.537 18518
3170 1 5 . 1 1 85 85 GLY C C 85 173.680 173.680 173.172 0.508 18518
3171 1 5 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.740 0.863 18518
3172 1 5 . 1 1 85 85 GLY H H 85 8.644 8.644 8.263 0.381 18518
3173 1 5 . 1 1 86 86 HIS N N 86 117.238 117.238 118.900 -1.662 18518
3174 1 5 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.615 0.402 18518
3175 1 5 . 1 1 86 86 HIS C C 86 173.841 173.841 174.072 -0.231 18518
3176 1 5 . 1 1 86 86 HIS CA C 86 53.796 53.796 53.951 -0.155 18518
3177 1 5 . 1 1 86 86 HIS CB C 86 31.280 31.280 31.262 0.018 18518
3178 1 5 . 1 1 86 86 HIS H H 86 7.918 7.918 8.058 -0.140 18518
3179 1 5 . 1 1 87 87 SER N N 87 118.179 118.179 120.369 -2.190 18518
3180 1 5 . 1 1 87 87 SER HA H 87 4.699 4.699 4.389 0.310 18518
3181 1 5 . 1 1 87 87 SER C C 87 175.904 175.904 174.742 1.162 18518
3182 1 5 . 1 1 87 87 SER CA C 87 58.271 58.271 58.335 -0.064 18518
3183 1 5 . 1 1 87 87 SER CB C 87 63.735 63.735 61.831 1.904 18518
3184 1 5 . 1 1 87 87 SER H H 87 8.977 8.977 8.802 0.175 18518
3185 1 5 . 1 1 88 88 MET N N 88 125.472 125.472 122.019 3.453 18518
3186 1 5 . 1 1 88 88 MET HA H 88 4.830 4.830 4.723 0.107 18518
3187 1 5 . 1 1 88 88 MET C C 88 176.419 176.419 175.972 0.447 18518
3188 1 5 . 1 1 88 88 MET CA C 88 54.899 54.899 55.550 -0.652 18518
3189 1 5 . 1 1 88 88 MET CB C 88 33.336 33.336 33.825 -0.489 18518
3190 1 5 . 1 1 88 88 MET H H 88 9.184 9.184 7.922 1.262 18518
3191 1 5 . 1 1 89 89 VAL N N 89 120.747 120.747 121.266 -0.519 18518
3192 1 5 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.120 0.112 18518
3193 1 5 . 1 1 89 89 VAL C C 89 175.958 175.958 175.519 0.439 18518
3194 1 5 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.965 1.189 18518
3195 1 5 . 1 1 89 89 VAL CB C 89 31.878 31.878 32.282 -0.404 18518
3196 1 5 . 1 1 89 89 VAL H H 89 8.233 8.233 7.519 0.714 18518
3197 1 5 . 1 1 90 90 SER N N 90 117.362 117.362 116.581 0.781 18518
3198 1 5 . 1 1 90 90 SER HA H 90 4.590 4.590 4.760 -0.170 18518
3199 1 5 . 1 1 90 90 SER C C 90 175.741 175.741 176.067 -0.326 18518
3200 1 5 . 1 1 90 90 SER CA C 90 57.717 57.717 56.371 1.346 18518
3201 1 5 . 1 1 90 90 SER CB C 90 63.223 63.223 64.537 -1.314 18518
3202 1 5 . 1 1 90 90 SER H H 90 8.482 8.482 8.028 0.454 18518
3203 1 5 . 1 1 91 91 VAL N N 91 120.466 120.466 119.644 0.822 18518
3204 1 5 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.917 0.130 18518
3205 1 5 . 1 1 91 91 VAL C C 91 176.329 176.329 175.964 0.365 18518
3206 1 5 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.088 -0.596 18518
3207 1 5 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.488 1.080 18518
3208 1 5 . 1 1 91 91 VAL H H 91 8.188 8.188 8.879 -0.691 18518
3209 1 5 . 1 1 92 92 SER N N 92 116.398 116.398 115.135 1.263 18518
3210 1 5 . 1 1 92 92 SER HA H 92 4.636 4.636 4.545 0.091 18518
3211 1 5 . 1 1 92 92 SER C C 92 174.159 174.159 174.709 -0.550 18518
3212 1 5 . 1 1 92 92 SER CA C 92 57.805 57.805 58.343 -0.538 18518
3213 1 5 . 1 1 92 92 SER CB C 92 63.046 63.046 63.749 -0.703 18518
3214 1 5 . 1 1 92 92 SER H H 92 8.370 8.370 7.707 0.663 18518
3215 1 5 . 1 1 93 93 THR N N 93 119.211 119.211 120.669 -1.458 18518
3216 1 5 . 1 1 93 93 THR HA H 93 4.484 4.484 4.667 -0.183 18518
3217 1 5 . 1 1 93 93 THR CA C 93 60.884 60.884 60.795 0.089 18518
3218 1 5 . 1 1 93 93 THR CB C 93 70.609 70.609 68.904 1.705 18518
3219 1 5 . 1 1 93 93 THR H H 93 7.416 7.416 7.550 -0.134 18518
3220 1 5 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.642 -0.202 18518
3221 1 5 . 1 1 94 94 PRO C C 94 178.775 178.775 177.222 1.553 18518
3222 1 5 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.475 0.468 18518
3223 1 5 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.467 0.182 18518
3224 1 5 . 1 1 95 95 ILE N N 95 124.174 124.174 123.125 1.049 18518
3225 1 5 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.857 0.092 18518
3226 1 5 . 1 1 95 95 ILE C C 95 176.498 176.498 176.898 -0.400 18518
3227 1 5 . 1 1 95 95 ILE CA C 95 63.904 63.904 62.097 1.807 18518
3228 1 5 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.135 0.047 18518
3229 1 5 . 1 1 95 95 ILE H H 95 9.305 9.305 8.140 1.165 18518
3230 1 5 . 1 1 96 96 SER N N 96 116.920 116.920 116.314 0.606 18518
3231 1 5 . 1 1 96 96 SER HA H 96 4.029 4.029 4.074 -0.045 18518
3232 1 5 . 1 1 96 96 SER C C 96 176.574 176.574 176.454 0.120 18518
3233 1 5 . 1 1 96 96 SER CA C 96 61.356 61.356 62.394 -1.038 18518
3234 1 5 . 1 1 96 96 SER CB C 96 61.723 61.723 62.660 -0.937 18518
3235 1 5 . 1 1 96 96 SER H H 96 8.335 8.335 8.389 -0.054 18518
3236 1 5 . 1 1 97 97 GLU N N 97 123.255 123.255 122.367 0.888 18518
3237 1 5 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.266 0.012 18518
3238 1 5 . 1 1 97 97 GLU C C 97 179.716 179.716 179.117 0.599 18518
3239 1 5 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.842 -0.050 18518
3240 1 5 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.208 0.354 18518
3241 1 5 . 1 1 97 97 GLU H H 97 7.376 7.376 7.759 -0.383 18518
3242 1 5 . 1 1 98 98 VAL N N 98 121.137 121.137 120.616 0.521 18518
3243 1 5 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.697 0.105 18518
3244 1 5 . 1 1 98 98 VAL C C 98 177.637 177.637 178.037 -0.400 18518
3245 1 5 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.393 -0.569 18518
3246 1 5 . 1 1 98 98 VAL CB C 98 32.154 32.154 30.974 1.179 18518
3247 1 5 . 1 1 98 98 VAL H H 98 7.387 7.387 7.914 -0.527 18518
3248 1 5 . 1 1 99 99 TYR N N 99 118.927 118.927 121.450 -2.523 18518
3249 1 5 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.077 -0.087 18518
3250 1 5 . 1 1 99 99 TYR C C 99 176.081 176.081 176.878 -0.797 18518
3251 1 5 . 1 1 99 99 TYR CA C 99 62.223 62.223 61.905 0.318 18518
3252 1 5 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.447 0.535 18518
3253 1 5 . 1 1 99 99 TYR H H 99 9.048 9.048 8.505 0.543 18518
3254 1 5 . 1 1 100 100 GLU N N 100 113.894 113.894 117.111 -3.217 18518
3255 1 5 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.841 0.005 18518
3256 1 5 . 1 1 100 100 GLU C C 100 177.989 177.989 178.660 -0.671 18518
3257 1 5 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.555 0.532 18518
3258 1 5 . 1 1 100 100 GLU CB C 100 29.382 29.382 29.167 0.215 18518
3259 1 5 . 1 1 100 100 GLU H H 100 7.422 7.422 8.162 -0.740 18518
3260 1 5 . 1 1 101 101 SER N N 101 108.991 108.991 114.123 -5.132 18518
3261 1 5 . 1 1 101 101 SER HA H 101 4.524 4.524 4.368 0.156 18518
3262 1 5 . 1 1 101 101 SER C C 101 176.628 176.628 175.172 1.456 18518
3263 1 5 . 1 1 101 101 SER CA C 101 60.349 60.349 60.369 -0.020 18518
3264 1 5 . 1 1 101 101 SER CB C 101 64.741 64.741 63.949 0.792 18518
3265 1 5 . 1 1 101 101 SER H H 101 7.424 7.424 7.804 -0.380 18518
3266 1 5 . 1 1 102 102 GLU N N 102 116.533 116.533 119.528 -2.995 18518
3267 1 5 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.602 0.142 18518
3268 1 5 . 1 1 102 102 GLU C C 102 176.774 176.774 175.194 1.580 18518
3269 1 5 . 1 1 102 102 GLU CA C 102 55.581 55.581 55.675 -0.094 18518
3270 1 5 . 1 1 102 102 GLU CB C 102 30.697 30.697 31.715 -1.018 18518
3271 1 5 . 1 1 102 102 GLU H H 102 8.487 8.487 7.893 0.594 18518
3272 1 5 . 1 1 103 103 LYS N N 103 118.370 118.370 119.727 -1.357 18518
3273 1 5 . 1 1 103 103 LYS HA H 103 4.178 4.178 4.365 -0.187 18518
3274 1 5 . 1 1 103 103 LYS C C 103 175.018 175.018 176.852 -1.834 18518
3275 1 5 . 1 1 103 103 LYS CA C 103 57.329 57.329 56.380 0.949 18518
3276 1 5 . 1 1 103 103 LYS CB C 103 32.186 32.186 32.009 0.177 18518
3277 1 5 . 1 1 103 103 LYS H H 103 7.831 7.831 7.680 0.151 18518
3278 1 5 . 1 1 104 104 ASP N N 104 123.500 123.500 122.903 0.597 18518
3279 1 5 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.625 0.130 18518
3280 1 5 . 1 1 104 104 ASP C C 104 177.383 177.383 177.508 -0.125 18518
3281 1 5 . 1 1 104 104 ASP CA C 104 53.846 53.846 53.896 -0.050 18518
3282 1 5 . 1 1 104 104 ASP CB C 104 43.411 43.411 43.270 0.141 18518
3283 1 5 . 1 1 104 104 ASP H H 104 9.041 9.041 8.503 0.538 18518
3284 1 5 . 1 1 105 105 GLU N N 105 125.448 125.448 120.366 5.082 18518
3285 1 5 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.137 0.043 18518
3286 1 5 . 1 1 105 105 GLU C C 105 177.519 177.519 177.429 0.090 18518
3287 1 5 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.823 0.706 18518
3288 1 5 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.792 0.252 18518
3289 1 5 . 1 1 105 105 GLU H H 105 8.906 8.906 8.672 0.234 18518
3290 1 5 . 1 1 106 106 ASP N N 106 118.824 118.824 118.094 0.730 18518
3291 1 5 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.526 -0.347 18518
3292 1 5 . 1 1 106 106 ASP C C 106 176.223 176.223 176.815 -0.592 18518
3293 1 5 . 1 1 106 106 ASP CA C 106 54.756 54.756 55.518 -0.762 18518
3294 1 5 . 1 1 106 106 ASP CB C 106 39.999 39.999 41.715 -1.716 18518
3295 1 5 . 1 1 106 106 ASP H H 106 10.036 10.036 8.585 1.451 18518
3296 1 5 . 1 1 107 107 GLY N N 107 105.866 105.866 105.719 0.147 18518
3297 1 5 . 1 1 107 107 GLY C C 107 175.136 175.136 173.998 1.138 18518
3298 1 5 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.100 0.122 18518
3299 1 5 . 1 1 107 107 GLY H H 107 8.001 8.001 7.376 0.625 18518
3300 1 5 . 1 1 108 108 PHE N N 108 123.820 123.820 120.070 3.750 18518
3301 1 5 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.699 -0.037 18518
3302 1 5 . 1 1 108 108 PHE C C 108 174.899 174.899 174.885 0.014 18518
3303 1 5 . 1 1 108 108 PHE CA C 108 60.238 60.238 58.290 1.948 18518
3304 1 5 . 1 1 108 108 PHE CB C 108 40.365 40.365 40.336 0.029 18518
3305 1 5 . 1 1 108 108 PHE H H 108 9.912 9.912 7.663 2.249 18518
3306 1 5 . 1 1 109 109 LEU N N 109 120.130 120.130 123.576 -3.446 18518
3307 1 5 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.924 0.106 18518
3308 1 5 . 1 1 109 109 LEU C C 109 173.916 173.916 174.802 -0.886 18518
3309 1 5 . 1 1 109 109 LEU CA C 109 53.424 53.424 54.058 -0.634 18518
3310 1 5 . 1 1 109 109 LEU CB C 109 45.203 45.203 44.030 1.173 18518
3311 1 5 . 1 1 109 109 LEU H H 109 7.997 7.997 8.809 -0.812 18518
3312 1 5 . 1 1 110 110 TYR N N 110 126.579 126.579 126.792 -0.213 18518
3313 1 5 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.608 0.395 18518
3314 1 5 . 1 1 110 110 TYR C C 110 176.671 176.671 175.175 1.496 18518
3315 1 5 . 1 1 110 110 TYR CA C 110 59.058 59.058 58.408 0.650 18518
3316 1 5 . 1 1 110 110 TYR CB C 110 39.556 39.556 39.977 -0.421 18518
3317 1 5 . 1 1 110 110 TYR H H 110 9.377 9.377 8.466 0.911 18518
3318 1 5 . 1 1 111 111 MET N N 111 119.240 119.240 120.225 -0.985 18518
3319 1 5 . 1 1 111 111 MET HA H 111 5.486 5.486 5.360 0.126 18518
3320 1 5 . 1 1 111 111 MET C C 111 175.695 175.695 174.495 1.200 18518
3321 1 5 . 1 1 111 111 MET CA C 111 54.124 54.124 54.550 -0.426 18518
3322 1 5 . 1 1 111 111 MET CB C 111 36.960 36.960 37.460 -0.500 18518
3323 1 5 . 1 1 111 111 MET H H 111 9.658 9.658 8.664 0.994 18518
3324 1 5 . 1 1 112 112 VAL N N 112 119.865 119.865 116.377 3.488 18518
3325 1 5 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.369 0.594 18518
3326 1 5 . 1 1 112 112 VAL C C 112 175.058 175.058 173.734 1.324 18518
3327 1 5 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.901 -0.990 18518
3328 1 5 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.635 0.416 18518
3329 1 5 . 1 1 112 112 VAL H H 112 8.794 8.794 8.948 -0.154 18518
3330 1 5 . 1 1 113 113 TYR N N 113 119.664 119.664 119.551 0.113 18518
3331 1 5 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.797 0.321 18518
3332 1 5 . 1 1 113 113 TYR C C 113 173.375 173.375 173.754 -0.379 18518
3333 1 5 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.163 -1.010 18518
3334 1 5 . 1 1 113 113 TYR CB C 113 43.312 43.312 42.023 1.289 18518
3335 1 5 . 1 1 113 113 TYR H H 113 8.315 8.315 8.498 -0.183 18518
3336 1 5 . 1 1 114 114 ALA N N 114 119.763 119.763 122.653 -2.890 18518
3337 1 5 . 1 1 114 114 ALA HA H 114 4.800 4.800 5.065 -0.265 18518
3338 1 5 . 1 1 114 114 ALA C C 114 176.216 176.216 175.201 1.015 18518
3339 1 5 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.862 -0.730 18518
3340 1 5 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.387 2.209 18518
3341 1 5 . 1 1 114 114 ALA H H 114 8.465 8.465 8.998 -0.533 18518
3342 1 5 . 1 1 115 115 SER N N 115 114.763 114.763 115.910 -1.147 18518
3343 1 5 . 1 1 115 115 SER HA H 115 4.496 4.496 5.071 -0.575 18518
3344 1 5 . 1 1 115 115 SER C C 115 172.671 172.671 173.687 -1.016 18518
3345 1 5 . 1 1 115 115 SER CA C 115 58.651 58.651 57.291 1.360 18518
3346 1 5 . 1 1 115 115 SER CB C 115 63.526 63.526 62.292 1.234 18518
3347 1 5 . 1 1 115 115 SER H H 115 9.915 9.915 9.105 0.810 18518
3348 1 5 . 1 1 116 116 GLN N N 116 116.611 116.611 124.076 -7.465 18518
3349 1 5 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.620 -0.136 18518
3350 1 5 . 1 1 116 116 GLN C C 116 172.733 172.733 174.068 -1.335 18518
3351 1 5 . 1 1 116 116 GLN CA C 116 53.926 53.926 56.011 -2.085 18518
3352 1 5 . 1 1 116 116 GLN CB C 116 32.358 32.358 30.919 1.440 18518
3353 1 5 . 1 1 116 116 GLN H H 116 7.219 7.219 8.250 -1.031 18518
3354 1 5 . 1 1 117 117 GLU N N 117 117.623 117.623 122.606 -4.983 18518
3355 1 5 . 1 1 117 117 GLU HA H 117 3.287 3.287 3.207 0.080 18518
3356 1 5 . 1 1 117 117 GLU C C 117 175.168 175.168 176.197 -1.029 18518
3357 1 5 . 1 1 117 117 GLU CA C 117 56.882 56.882 57.044 -0.162 18518
3358 1 5 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.552 0.970 18518
3359 1 5 . 1 1 117 117 GLU H H 117 7.882 7.882 8.619 -0.737 18518
3360 1 5 . 1 1 118 118 THR N N 118 109.820 109.820 110.677 -0.857 18518
3361 1 5 . 1 1 118 118 THR HA H 118 4.066 4.066 4.450 -0.384 18518
3362 1 5 . 1 1 118 118 THR C C 118 172.355 172.355 174.725 -2.370 18518
3363 1 5 . 1 1 118 118 THR CA C 118 60.029 60.029 60.814 -0.785 18518
3364 1 5 . 1 1 118 118 THR CB C 118 70.480 70.480 69.065 1.415 18518
3365 1 5 . 1 1 118 118 THR H H 118 6.992 6.992 7.558 -0.566 18518
3366 1 6 . 1 1 2 2 ALA HA H 2 4.336 4.336 4.796 -0.460 18518
3367 1 6 . 1 1 2 2 ALA C C 2 177.974 177.974 175.887 2.087 18518
3368 1 6 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.925 0.860 18518
3369 1 6 . 1 1 2 2 ALA CB C 2 19.444 19.444 20.016 -0.572 18518
3370 1 6 . 1 1 3 3 MET N N 3 119.311 119.311 119.124 0.187 18518
3371 1 6 . 1 1 3 3 MET HA H 3 4.451 4.451 4.948 -0.497 18518
3372 1 6 . 1 1 3 3 MET C C 3 176.913 176.913 175.881 1.032 18518
3373 1 6 . 1 1 3 3 MET CA C 3 55.679 55.679 54.425 1.254 18518
3374 1 6 . 1 1 3 3 MET CB C 3 32.590 32.590 34.710 -2.120 18518
3375 1 6 . 1 1 3 3 MET H H 3 8.638 8.638 8.552 0.086 18518
3376 1 6 . 1 1 4 4 GLY N N 4 110.281 110.281 108.890 1.391 18518
3377 1 6 . 1 1 4 4 GLY C C 4 174.180 174.180 174.486 -0.306 18518
3378 1 6 . 1 1 4 4 GLY CA C 4 45.495 45.495 45.171 0.324 18518
3379 1 6 . 1 1 4 4 GLY H H 4 8.552 8.552 8.451 0.101 18518
3380 1 6 . 1 1 5 5 LYS N N 5 120.818 120.818 126.101 -5.283 18518
3381 1 6 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.146 0.363 18518
3382 1 6 . 1 1 5 5 LYS C C 5 177.605 177.605 176.706 0.899 18518
3383 1 6 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.575 0.559 18518
3384 1 6 . 1 1 5 5 LYS CB C 5 34.813 34.813 31.969 2.844 18518
3385 1 6 . 1 1 5 5 LYS H H 5 8.133 8.133 8.045 0.088 18518
3386 1 6 . 1 1 6 6 THR N N 6 114.781 114.781 117.674 -2.893 18518
3387 1 6 . 1 1 6 6 THR HA H 6 4.421 4.421 4.373 0.048 18518
3388 1 6 . 1 1 6 6 THR C C 6 175.524 175.524 175.858 -0.334 18518
3389 1 6 . 1 1 6 6 THR CA C 6 61.127 61.127 60.644 0.483 18518
3390 1 6 . 1 1 6 6 THR CB C 6 69.926 69.926 70.383 -0.457 18518
3391 1 6 . 1 1 6 6 THR H H 6 8.483 8.483 7.754 0.729 18518
3392 1 6 . 1 1 7 7 PHE N N 7 125.552 125.552 121.593 3.959 18518
3393 1 6 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.194 -0.189 18518
3394 1 6 . 1 1 7 7 PHE C C 7 177.397 177.397 176.569 0.828 18518
3395 1 6 . 1 1 7 7 PHE CA C 7 63.393 63.393 60.642 2.751 18518
3396 1 6 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.174 1.393 18518
3397 1 6 . 1 1 7 7 PHE H H 7 10.245 10.245 9.038 1.207 18518
3398 1 6 . 1 1 8 8 LYS N N 8 114.053 114.053 117.064 -3.011 18518
3399 1 6 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.773 0.062 18518
3400 1 6 . 1 1 8 8 LYS C C 8 175.520 175.520 178.266 -2.746 18518
3401 1 6 . 1 1 8 8 LYS CA C 8 59.993 59.993 57.869 2.124 18518
3402 1 6 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.184 2.505 18518
3403 1 6 . 1 1 8 8 LYS H H 8 8.775 8.775 6.532 2.244 18518
3404 1 6 . 1 1 9 9 GLN N N 9 113.516 113.516 119.058 -5.542 18518
3405 1 6 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.106 0.043 18518
3406 1 6 . 1 1 9 9 GLN C C 9 177.615 177.615 177.478 0.137 18518
3407 1 6 . 1 1 9 9 GLN CA C 9 56.819 56.819 58.222 -1.403 18518
3408 1 6 . 1 1 9 9 GLN CB C 9 30.019 30.019 28.988 1.031 18518
3409 1 6 . 1 1 9 9 GLN H H 9 7.355 7.355 7.621 -0.266 18518
3410 1 6 . 1 1 10 10 ARG N N 10 118.294 118.294 116.517 1.777 18518
3411 1 6 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.263 0.039 18518
3412 1 6 . 1 1 10 10 ARG C C 10 179.380 179.380 177.271 2.109 18518
3413 1 6 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.000 0.268 18518
3414 1 6 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.517 1.125 18518
3415 1 6 . 1 1 10 10 ARG H H 10 7.936 7.936 7.710 0.226 18518
3416 1 6 . 1 1 11 11 ARG N N 11 121.137 121.137 118.530 2.607 18518
3417 1 6 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.826 -0.146 18518
3418 1 6 . 1 1 11 11 ARG CA C 11 53.453 53.453 55.308 -1.855 18518
3419 1 6 . 1 1 11 11 ARG CB C 11 32.938 32.938 33.031 -0.092 18518
3420 1 6 . 1 1 11 11 ARG H H 11 7.390 7.390 7.394 -0.004 18518
3421 1 6 . 1 1 12 12 THR N N 12 116.819 116.819 119.806 -2.987 18518
3422 1 6 . 1 1 12 12 THR HA H 12 4.359 4.359 4.305 0.054 18518
3423 1 6 . 1 1 12 12 THR C C 12 174.989 174.989 175.650 -0.661 18518
3424 1 6 . 1 1 12 12 THR CA C 12 61.748 61.748 63.413 -1.665 18518
3425 1 6 . 1 1 12 12 THR CB C 12 71.068 71.068 70.129 0.939 18518
3426 1 6 . 1 1 12 12 THR H H 12 8.953 8.953 8.484 0.469 18518
3427 1 6 . 1 1 13 13 PHE N N 13 123.200 123.200 123.411 -0.211 18518
3428 1 6 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.243 -0.215 18518
3429 1 6 . 1 1 13 13 PHE C C 13 176.029 176.029 177.127 -1.098 18518
3430 1 6 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.606 0.258 18518
3431 1 6 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.387 0.173 18518
3432 1 6 . 1 1 13 13 PHE H H 13 9.284 9.284 8.960 0.324 18518
3433 1 6 . 1 1 14 14 GLU N N 14 115.414 115.414 118.318 -2.904 18518
3434 1 6 . 1 1 14 14 GLU HA H 14 3.794 3.794 4.075 -0.281 18518
3435 1 6 . 1 1 14 14 GLU C C 14 180.081 180.081 179.242 0.839 18518
3436 1 6 . 1 1 14 14 GLU CA C 14 60.619 60.619 60.534 0.085 18518
3437 1 6 . 1 1 14 14 GLU CB C 14 28.852 28.852 28.992 -0.140 18518
3438 1 6 . 1 1 14 14 GLU H H 14 8.973 8.973 8.846 0.127 18518
3439 1 6 . 1 1 15 15 GLN N N 15 119.276 119.276 117.628 1.648 18518
3440 1 6 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.103 -0.103 18518
3441 1 6 . 1 1 15 15 GLN C C 15 177.978 177.978 178.844 -0.866 18518
3442 1 6 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.811 0.024 18518
3443 1 6 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.567 0.803 18518
3444 1 6 . 1 1 15 15 GLN H H 15 7.756 7.756 7.823 -0.067 18518
3445 1 6 . 1 1 16 16 ARG N N 16 121.336 121.336 120.774 0.562 18518
3446 1 6 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.165 0.105 18518
3447 1 6 . 1 1 16 16 ARG C C 16 177.416 177.416 178.557 -1.141 18518
3448 1 6 . 1 1 16 16 ARG CA C 16 61.375 61.375 60.026 1.349 18518
3449 1 6 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.204 0.401 18518
3450 1 6 . 1 1 16 16 ARG H H 16 8.645 8.645 7.877 0.768 18518
3451 1 6 . 1 1 17 17 VAL N N 17 117.630 117.630 121.188 -3.558 18518
3452 1 6 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.715 0.142 18518
3453 1 6 . 1 1 17 17 VAL C C 17 179.748 179.748 177.555 2.193 18518
3454 1 6 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.575 0.151 18518
3455 1 6 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.566 0.628 18518
3456 1 6 . 1 1 17 17 VAL H H 17 8.373 8.373 8.056 0.317 18518
3457 1 6 . 1 1 18 18 GLU N N 18 120.864 120.864 119.187 1.677 18518
3458 1 6 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.967 0.335 18518
3459 1 6 . 1 1 18 18 GLU C C 18 177.728 177.728 178.791 -1.063 18518
3460 1 6 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.871 -1.385 18518
3461 1 6 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.253 0.129 18518
3462 1 6 . 1 1 18 18 GLU H H 18 7.368 7.368 8.203 -0.835 18518
3463 1 6 . 1 1 19 19 ASP N N 19 121.425 121.425 120.635 0.790 18518
3464 1 6 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.472 -0.038 18518
3465 1 6 . 1 1 19 19 ASP C C 19 179.978 179.978 178.404 1.574 18518
3466 1 6 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.316 0.106 18518
3467 1 6 . 1 1 19 19 ASP CB C 19 41.287 41.287 41.267 0.020 18518
3468 1 6 . 1 1 19 19 ASP H H 19 8.671 8.671 7.997 0.674 18518
3469 1 6 . 1 1 20 20 VAL N N 20 119.730 119.730 120.972 -1.242 18518
3470 1 6 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.308 -0.103 18518
3471 1 6 . 1 1 20 20 VAL C C 20 176.284 176.284 177.886 -1.602 18518
3472 1 6 . 1 1 20 20 VAL CA C 20 66.315 66.315 66.227 0.088 18518
3473 1 6 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.474 -0.367 18518
3474 1 6 . 1 1 20 20 VAL H H 20 7.999 7.999 8.264 -0.265 18518
3475 1 6 . 1 1 21 21 ARG N N 21 121.455 121.455 119.355 2.100 18518
3476 1 6 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.986 -0.172 18518
3477 1 6 . 1 1 21 21 ARG C C 21 180.120 180.120 178.486 1.634 18518
3478 1 6 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.937 0.893 18518
3479 1 6 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.108 0.838 18518
3480 1 6 . 1 1 21 21 ARG H H 21 8.098 8.098 8.211 -0.113 18518
3481 1 6 . 1 1 22 22 LEU N N 22 117.826 117.826 121.261 -3.435 18518
3482 1 6 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.047 0.002 18518
3483 1 6 . 1 1 22 22 LEU C C 22 180.115 180.115 178.635 1.480 18518
3484 1 6 . 1 1 22 22 LEU CA C 22 57.790 57.790 57.838 -0.048 18518
3485 1 6 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.449 0.693 18518
3486 1 6 . 1 1 22 22 LEU H H 22 8.207 8.207 7.803 0.404 18518
3487 1 6 . 1 1 23 23 ILE N N 23 121.450 121.450 120.433 1.017 18518
3488 1 6 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.960 0.053 18518
3489 1 6 . 1 1 23 23 ILE C C 23 178.149 178.149 178.454 -0.305 18518
3490 1 6 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.487 -2.316 18518
3491 1 6 . 1 1 23 23 ILE CB C 23 38.106 38.106 37.730 0.376 18518
3492 1 6 . 1 1 23 23 ILE H H 23 8.105 8.105 8.499 -0.394 18518
3493 1 6 . 1 1 24 24 ARG N N 24 121.139 121.139 118.588 2.551 18518
3494 1 6 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.179 -0.192 18518
3495 1 6 . 1 1 24 24 ARG C C 24 178.702 178.702 178.917 -0.215 18518
3496 1 6 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.832 -1.114 18518
3497 1 6 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.646 -0.877 18518
3498 1 6 . 1 1 24 24 ARG H H 24 8.601 8.601 8.442 0.159 18518
3499 1 6 . 1 1 25 25 GLU N N 25 118.054 118.054 119.666 -1.612 18518
3500 1 6 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.107 -0.081 18518
3501 1 6 . 1 1 25 25 GLU C C 25 178.492 178.492 178.158 0.334 18518
3502 1 6 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.419 0.361 18518
3503 1 6 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.677 0.324 18518
3504 1 6 . 1 1 25 25 GLU H H 25 7.423 7.423 7.990 -0.567 18518
3505 1 6 . 1 1 26 26 GLN N N 26 116.350 116.350 117.346 -0.996 18518
3506 1 6 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.024 -0.088 18518
3507 1 6 . 1 1 26 26 GLN C C 26 176.305 176.305 176.865 -0.560 18518
3508 1 6 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.515 -0.012 18518
3509 1 6 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.331 0.876 18518
3510 1 6 . 1 1 26 26 GLN H H 26 7.524 7.524 8.179 -0.655 18518
3511 1 6 . 1 1 27 27 HIS N N 27 116.017 116.017 118.281 -2.264 18518
3512 1 6 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.107 -0.177 18518
3513 1 6 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.742 0.312 18518
3514 1 6 . 1 1 27 27 HIS CB C 27 30.747 30.747 30.975 -0.228 18518
3515 1 6 . 1 1 27 27 HIS H H 27 8.284 8.284 8.187 0.097 18518
3516 1 6 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.616 -0.035 18518
3517 1 6 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.366 0.553 18518
3518 1 6 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.305 0.150 18518
3519 1 6 . 1 1 29 29 THR N N 29 107.011 107.011 107.128 -0.117 18518
3520 1 6 . 1 1 29 29 THR HA H 29 4.599 4.599 4.322 0.277 18518
3521 1 6 . 1 1 29 29 THR C C 29 172.884 172.884 174.131 -1.247 18518
3522 1 6 . 1 1 29 29 THR CA C 29 60.810 60.810 61.611 -0.801 18518
3523 1 6 . 1 1 29 29 THR CB C 29 68.531 68.531 68.636 -0.105 18518
3524 1 6 . 1 1 29 29 THR H H 29 7.890 7.890 8.330 -0.440 18518
3525 1 6 . 1 1 30 30 LYS N N 30 117.679 117.679 121.478 -3.799 18518
3526 1 6 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.950 -0.092 18518
3527 1 6 . 1 1 30 30 LYS C C 30 174.310 174.310 175.098 -0.788 18518
3528 1 6 . 1 1 30 30 LYS CA C 30 53.751 53.751 53.935 -0.184 18518
3529 1 6 . 1 1 30 30 LYS CB C 30 35.804 35.804 35.272 0.532 18518
3530 1 6 . 1 1 30 30 LYS H H 30 7.441 7.441 7.482 -0.041 18518
3531 1 6 . 1 1 31 31 ILE N N 31 122.849 122.849 122.395 0.454 18518
3532 1 6 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.242 -0.137 18518
3533 1 6 . 1 1 31 31 ILE CA C 31 54.801 54.801 58.034 -3.233 18518
3534 1 6 . 1 1 31 31 ILE CB C 31 38.265 38.265 39.715 -1.450 18518
3535 1 6 . 1 1 31 31 ILE H H 31 9.304 9.304 8.928 0.376 18518
3536 1 6 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.918 0.241 18518
3537 1 6 . 1 1 32 32 PRO C C 32 174.164 174.164 176.115 -1.951 18518
3538 1 6 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.166 -0.663 18518
3539 1 6 . 1 1 32 32 PRO CB C 32 31.145 31.145 30.625 0.520 18518
3540 1 6 . 1 1 33 33 VAL N N 33 125.606 125.606 121.502 4.104 18518
3541 1 6 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.081 0.132 18518
3542 1 6 . 1 1 33 33 VAL C C 33 173.654 173.654 173.890 -0.236 18518
3543 1 6 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.703 0.341 18518
3544 1 6 . 1 1 33 33 VAL CB C 33 35.604 35.604 35.663 -0.060 18518
3545 1 6 . 1 1 33 33 VAL H H 33 9.424 9.424 8.484 0.940 18518
3546 1 6 . 1 1 34 34 ILE N N 34 128.241 128.241 125.714 2.527 18518
3547 1 6 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.698 0.135 18518
3548 1 6 . 1 1 34 34 ILE C C 34 175.605 175.605 174.715 0.890 18518
3549 1 6 . 1 1 34 34 ILE CA C 34 56.765 56.765 59.965 -3.200 18518
3550 1 6 . 1 1 34 34 ILE CB C 34 36.799 36.799 39.180 -2.381 18518
3551 1 6 . 1 1 34 34 ILE H H 34 8.721 8.721 8.860 -0.139 18518
3552 1 6 . 1 1 35 35 ILE N N 35 125.650 125.650 128.304 -2.654 18518
3553 1 6 . 1 1 35 35 ILE HA H 35 4.836 4.836 5.029 -0.193 18518
3554 1 6 . 1 1 35 35 ILE C C 35 174.887 174.887 174.526 0.361 18518
3555 1 6 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.190 0.755 18518
3556 1 6 . 1 1 35 35 ILE CB C 35 39.210 39.210 40.112 -0.902 18518
3557 1 6 . 1 1 35 35 ILE H H 35 9.034 9.034 8.740 0.294 18518
3558 1 6 . 1 1 36 36 GLU N N 36 122.657 122.657 125.293 -2.636 18518
3559 1 6 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.817 0.044 18518
3560 1 6 . 1 1 36 36 GLU C C 36 173.848 173.848 174.191 -0.343 18518
3561 1 6 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.452 -0.520 18518
3562 1 6 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.484 0.798 18518
3563 1 6 . 1 1 36 36 GLU H H 36 8.303 8.303 8.413 -0.110 18518
3564 1 6 . 1 1 37 37 ARG N N 37 123.228 123.228 125.669 -2.441 18518
3565 1 6 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.327 -0.601 18518
3566 1 6 . 1 1 37 37 ARG C C 37 176.359 176.359 175.999 0.360 18518
3567 1 6 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.332 0.027 18518
3568 1 6 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.488 0.852 18518
3569 1 6 . 1 1 37 37 ARG H H 37 8.856 8.856 8.623 0.233 18518
3570 1 6 . 1 1 38 38 TYR N N 38 128.981 128.981 128.096 0.885 18518
3571 1 6 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.201 0.151 18518
3572 1 6 . 1 1 38 38 TYR C C 38 177.316 177.316 176.396 0.920 18518
3573 1 6 . 1 1 38 38 TYR CA C 38 57.712 57.712 58.682 -0.970 18518
3574 1 6 . 1 1 38 38 TYR CB C 38 39.472 39.472 39.821 -0.349 18518
3575 1 6 . 1 1 38 38 TYR H H 38 8.628 8.628 8.546 0.082 18518
3576 1 6 . 1 1 39 39 LYS N N 39 130.635 130.635 127.050 3.585 18518
3577 1 6 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.842 -0.020 18518
3578 1 6 . 1 1 39 39 LYS CA C 39 58.887 58.887 58.130 0.757 18518
3579 1 6 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.980 -0.208 18518
3580 1 6 . 1 1 39 39 LYS H H 39 8.594 8.594 8.363 0.231 18518
3581 1 6 . 1 1 40 40 GLY C C 40 173.447 173.447 174.700 -1.253 18518
3582 1 6 . 1 1 40 40 GLY CA C 40 44.663 44.663 44.273 0.390 18518
3583 1 6 . 1 1 40 40 GLY H H 40 5.188 5.188 6.499 -1.311 18518
3584 1 6 . 1 1 41 41 GLU N N 41 122.836 122.836 120.428 2.408 18518
3585 1 6 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.343 -0.086 18518
3586 1 6 . 1 1 41 41 GLU C C 41 176.524 176.524 176.090 0.434 18518
3587 1 6 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.538 -0.013 18518
3588 1 6 . 1 1 41 41 GLU CB C 41 30.985 30.985 30.200 0.785 18518
3589 1 6 . 1 1 41 41 GLU H H 41 7.380 7.380 7.611 -0.231 18518
3590 1 6 . 1 1 42 42 LYS N N 42 124.040 124.040 123.721 0.319 18518
3591 1 6 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.441 0.234 18518
3592 1 6 . 1 1 42 42 LYS C C 42 177.538 177.538 177.589 -0.051 18518
3593 1 6 . 1 1 42 42 LYS CA C 42 55.840 55.840 57.029 -1.189 18518
3594 1 6 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.955 1.024 18518
3595 1 6 . 1 1 42 42 LYS H H 42 9.034 9.034 8.412 0.622 18518
3596 1 6 . 1 1 43 43 GLN N N 43 119.259 119.259 117.872 1.387 18518
3597 1 6 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.239 0.303 18518
3598 1 6 . 1 1 43 43 GLN C C 43 177.336 177.336 176.353 0.983 18518
3599 1 6 . 1 1 43 43 GLN CA C 43 57.673 57.673 57.394 0.279 18518
3600 1 6 . 1 1 43 43 GLN CB C 43 30.782 30.782 29.564 1.218 18518
3601 1 6 . 1 1 43 43 GLN H H 43 8.435 8.435 8.281 0.154 18518
3602 1 6 . 1 1 44 44 LEU N N 44 120.760 120.760 123.284 -2.524 18518
3603 1 6 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.785 -0.090 18518
3604 1 6 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.460 0.785 18518
3605 1 6 . 1 1 44 44 LEU CB C 44 43.596 43.596 41.509 2.087 18518
3606 1 6 . 1 1 44 44 LEU H H 44 9.126 9.126 8.356 0.770 18518
3607 1 6 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.522 0.195 18518
3608 1 6 . 1 1 45 45 PRO C C 45 175.797 175.797 176.195 -0.398 18518
3609 1 6 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.213 -0.102 18518
3610 1 6 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.326 0.266 18518
3611 1 6 . 1 1 46 46 VAL N N 46 119.052 119.052 119.869 -0.817 18518
3612 1 6 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.169 -0.302 18518
3613 1 6 . 1 1 46 46 VAL C C 46 175.640 175.640 176.660 -1.020 18518
3614 1 6 . 1 1 46 46 VAL CA C 46 62.944 62.944 62.127 0.817 18518
3615 1 6 . 1 1 46 46 VAL CB C 46 32.799 32.799 32.710 0.089 18518
3616 1 6 . 1 1 46 46 VAL H H 46 8.543 8.543 8.228 0.315 18518
3617 1 6 . 1 1 47 47 LEU N N 47 130.203 130.203 127.377 2.826 18518
3618 1 6 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.445 -0.136 18518
3619 1 6 . 1 1 47 47 LEU C C 47 176.198 176.198 177.602 -1.404 18518
3620 1 6 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.215 -0.208 18518
3621 1 6 . 1 1 47 47 LEU CB C 47 43.832 43.832 43.022 0.810 18518
3622 1 6 . 1 1 47 47 LEU H H 47 7.799 7.799 8.378 -0.579 18518
3623 1 6 . 1 1 48 48 ASP N N 48 122.403 122.403 123.735 -1.332 18518
3624 1 6 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.519 -0.256 18518
3625 1 6 . 1 1 48 48 ASP C C 48 175.294 175.294 175.727 -0.433 18518
3626 1 6 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.395 0.437 18518
3627 1 6 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.184 -1.000 18518
3628 1 6 . 1 1 48 48 ASP H H 48 8.780 8.780 8.529 0.251 18518
3629 1 6 . 1 1 49 49 LYS N N 49 119.569 119.569 118.968 0.601 18518
3630 1 6 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.543 0.042 18518
3631 1 6 . 1 1 49 49 LYS C C 49 174.678 174.678 176.154 -1.476 18518
3632 1 6 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.045 -1.393 18518
3633 1 6 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.634 1.311 18518
3634 1 6 . 1 1 49 49 LYS H H 49 7.280 7.280 7.622 -0.342 18518
3635 1 6 . 1 1 50 50 THR N N 50 110.862 110.862 114.385 -3.523 18518
3636 1 6 . 1 1 50 50 THR HA H 50 4.811 4.811 4.795 0.016 18518
3637 1 6 . 1 1 50 50 THR C C 50 172.425 172.425 174.122 -1.697 18518
3638 1 6 . 1 1 50 50 THR CA C 50 62.645 62.645 62.502 0.143 18518
3639 1 6 . 1 1 50 50 THR CB C 50 71.648 71.648 70.257 1.391 18518
3640 1 6 . 1 1 50 50 THR H H 50 8.042 8.042 8.079 -0.037 18518
3641 1 6 . 1 1 51 51 LYS N N 51 120.008 120.008 123.462 -3.454 18518
3642 1 6 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.477 0.148 18518
3643 1 6 . 1 1 51 51 LYS C C 51 175.082 175.082 175.416 -0.334 18518
3644 1 6 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.790 -2.086 18518
3645 1 6 . 1 1 51 51 LYS CB C 51 32.376 32.376 32.846 -0.470 18518
3646 1 6 . 1 1 51 51 LYS H H 51 7.119 7.119 7.813 -0.694 18518
3647 1 6 . 1 1 52 52 PHE N N 52 122.640 122.640 122.407 0.233 18518
3648 1 6 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.730 0.607 18518
3649 1 6 . 1 1 52 52 PHE C C 52 174.213 174.213 174.315 -0.102 18518
3650 1 6 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.491 0.120 18518
3651 1 6 . 1 1 52 52 PHE CB C 52 43.140 43.140 42.914 0.226 18518
3652 1 6 . 1 1 52 52 PHE H H 52 9.709 9.709 9.068 0.641 18518
3653 1 6 . 1 1 53 53 LEU N N 53 122.157 122.157 123.879 -1.722 18518
3654 1 6 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.823 0.124 18518
3655 1 6 . 1 1 53 53 LEU C C 53 175.769 175.769 175.450 0.319 18518
3656 1 6 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.952 -0.995 18518
3657 1 6 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.268 1.147 18518
3658 1 6 . 1 1 53 53 LEU H H 53 8.959 8.959 8.392 0.567 18518
3659 1 6 . 1 1 54 54 VAL N N 54 124.919 124.919 125.199 -0.280 18518
3660 1 6 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.496 0.063 18518
3661 1 6 . 1 1 54 54 VAL CA C 54 59.130 59.130 57.984 1.146 18518
3662 1 6 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.555 1.413 18518
3663 1 6 . 1 1 54 54 VAL H H 54 8.922 8.922 8.550 0.372 18518
3664 1 6 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.909 -0.468 18518
3665 1 6 . 1 1 55 55 PRO C C 55 176.594 176.594 177.892 -1.298 18518
3666 1 6 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.008 2.307 18518
3667 1 6 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.404 0.261 18518
3668 1 6 . 1 1 56 56 ASP N N 56 120.522 120.522 121.985 -1.463 18518
3669 1 6 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.219 -0.357 18518
3670 1 6 . 1 1 56 56 ASP C C 56 175.809 175.809 176.373 -0.564 18518
3671 1 6 . 1 1 56 56 ASP CA C 56 56.749 56.749 56.564 0.185 18518
3672 1 6 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.294 0.216 18518
3673 1 6 . 1 1 56 56 ASP H H 56 8.347 8.347 8.325 0.022 18518
3674 1 6 . 1 1 57 57 HIS N N 57 113.482 113.482 113.936 -0.454 18518
3675 1 6 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.655 0.065 18518
3676 1 6 . 1 1 57 57 HIS C C 57 176.507 176.507 174.835 1.672 18518
3677 1 6 . 1 1 57 57 HIS CA C 57 55.589 55.589 55.642 -0.053 18518
3678 1 6 . 1 1 57 57 HIS CB C 57 30.643 30.643 30.088 0.555 18518
3679 1 6 . 1 1 57 57 HIS H H 57 7.557 7.557 7.756 -0.199 18518
3680 1 6 . 1 1 58 58 VAL N N 58 123.279 123.279 119.363 3.916 18518
3681 1 6 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.350 -0.514 18518
3682 1 6 . 1 1 58 58 VAL C C 58 175.019 175.019 174.978 0.041 18518
3683 1 6 . 1 1 58 58 VAL CA C 58 62.823 62.823 60.442 2.381 18518
3684 1 6 . 1 1 58 58 VAL CB C 58 32.310 32.310 32.640 -0.330 18518
3685 1 6 . 1 1 58 58 VAL H H 58 7.345 7.345 7.282 0.063 18518
3686 1 6 . 1 1 59 59 ASN N N 59 123.781 123.781 123.522 0.259 18518
3687 1 6 . 1 1 59 59 ASN HA H 59 5.126 5.126 4.777 0.349 18518
3688 1 6 . 1 1 59 59 ASN C C 59 176.558 176.558 176.520 0.038 18518
3689 1 6 . 1 1 59 59 ASN CA C 59 51.485 51.485 52.470 -0.985 18518
3690 1 6 . 1 1 59 59 ASN CB C 59 40.107 40.107 39.568 0.539 18518
3691 1 6 . 1 1 59 59 ASN H H 59 8.735 8.735 8.454 0.281 18518
3692 1 6 . 1 1 60 60 MET N N 60 117.453 117.453 117.670 -0.217 18518
3693 1 6 . 1 1 60 60 MET HA H 60 4.395 4.395 4.172 0.223 18518
3694 1 6 . 1 1 60 60 MET C C 60 178.144 178.144 178.262 -0.118 18518
3695 1 6 . 1 1 60 60 MET CA C 60 57.097 57.097 59.747 -2.650 18518
3696 1 6 . 1 1 60 60 MET CB C 60 30.140 30.140 32.112 -1.972 18518
3697 1 6 . 1 1 60 60 MET H H 60 8.227 8.227 8.470 -0.243 18518
3698 1 6 . 1 1 61 61 SER N N 61 114.216 114.216 114.952 -0.736 18518
3699 1 6 . 1 1 61 61 SER HA H 61 4.111 4.111 4.085 0.026 18518
3700 1 6 . 1 1 61 61 SER C C 61 177.335 177.335 176.730 0.605 18518
3701 1 6 . 1 1 61 61 SER CA C 61 61.590 61.590 62.105 -0.515 18518
3702 1 6 . 1 1 61 61 SER CB C 61 62.402 62.402 62.395 0.007 18518
3703 1 6 . 1 1 61 61 SER H H 61 8.464 8.464 8.597 -0.133 18518
3704 1 6 . 1 1 62 62 GLU N N 62 123.004 123.004 120.864 2.140 18518
3705 1 6 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.093 -0.046 18518
3706 1 6 . 1 1 62 62 GLU C C 62 178.686 178.686 178.801 -0.115 18518
3707 1 6 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.866 -0.241 18518
3708 1 6 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.357 0.297 18518
3709 1 6 . 1 1 62 62 GLU H H 62 7.994 7.994 7.643 0.351 18518
3710 1 6 . 1 1 63 63 LEU N N 63 120.818 120.818 121.763 -0.945 18518
3711 1 6 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.970 -0.005 18518
3712 1 6 . 1 1 63 63 LEU C C 63 178.046 178.046 178.936 -0.890 18518
3713 1 6 . 1 1 63 63 LEU CA C 63 57.920 57.920 57.946 -0.026 18518
3714 1 6 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.330 0.294 18518
3715 1 6 . 1 1 63 63 LEU H H 63 8.130 8.130 7.771 0.359 18518
3716 1 6 . 1 1 64 64 ILE N N 64 118.528 118.528 119.799 -1.271 18518
3717 1 6 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.581 -0.212 18518
3718 1 6 . 1 1 64 64 ILE C C 64 177.127 177.127 177.759 -0.632 18518
3719 1 6 . 1 1 64 64 ILE CA C 64 66.678 66.678 66.120 0.558 18518
3720 1 6 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.576 0.868 18518
3721 1 6 . 1 1 64 64 ILE H H 64 8.488 8.488 8.561 -0.073 18518
3722 1 6 . 1 1 65 65 LYS N N 65 118.336 118.336 120.629 -2.293 18518
3723 1 6 . 1 1 65 65 LYS HA H 65 3.701 3.701 3.964 -0.263 18518
3724 1 6 . 1 1 65 65 LYS C C 65 179.291 179.291 179.238 0.053 18518
3725 1 6 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.605 0.835 18518
3726 1 6 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.052 0.319 18518
3727 1 6 . 1 1 65 65 LYS H H 65 7.347 7.347 7.803 -0.456 18518
3728 1 6 . 1 1 66 66 ILE N N 66 120.171 120.171 120.542 -0.371 18518
3729 1 6 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.687 -0.109 18518
3730 1 6 . 1 1 66 66 ILE C C 66 178.873 178.873 178.167 0.706 18518
3731 1 6 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.391 -0.231 18518
3732 1 6 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.847 0.786 18518
3733 1 6 . 1 1 66 66 ILE H H 66 7.901 7.901 8.303 -0.402 18518
3734 1 6 . 1 1 67 67 ILE N N 67 121.185 121.185 120.185 1.000 18518
3735 1 6 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.504 -0.058 18518
3736 1 6 . 1 1 67 67 ILE C C 67 177.150 177.150 177.936 -0.786 18518
3737 1 6 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.483 -1.677 18518
3738 1 6 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.184 -2.189 18518
3739 1 6 . 1 1 67 67 ILE H H 67 8.290 8.290 8.035 0.255 18518
3740 1 6 . 1 1 68 68 ARG N N 68 119.173 119.173 118.556 0.617 18518
3741 1 6 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.782 -0.851 18518
3742 1 6 . 1 1 68 68 ARG C C 68 178.496 178.496 178.729 -0.233 18518
3743 1 6 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.488 1.148 18518
3744 1 6 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.749 0.691 18518
3745 1 6 . 1 1 68 68 ARG H H 68 8.438 8.438 8.349 0.089 18518
3746 1 6 . 1 1 69 69 ARG N N 69 116.511 116.511 120.380 -3.869 18518
3747 1 6 . 1 1 69 69 ARG HA H 69 4.134 4.134 4.002 0.132 18518
3748 1 6 . 1 1 69 69 ARG C C 69 180.262 180.262 179.059 1.203 18518
3749 1 6 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.451 -0.744 18518
3750 1 6 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.154 -0.201 18518
3751 1 6 . 1 1 69 69 ARG H H 69 7.497 7.497 8.294 -0.797 18518
3752 1 6 . 1 1 70 70 ARG N N 70 123.297 123.297 119.581 3.716 18518
3753 1 6 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.092 -0.076 18518
3754 1 6 . 1 1 70 70 ARG C C 70 178.700 178.700 178.292 0.408 18518
3755 1 6 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.720 0.740 18518
3756 1 6 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.730 0.582 18518
3757 1 6 . 1 1 70 70 ARG H H 70 8.075 8.075 7.901 0.174 18518
3758 1 6 . 1 1 71 71 LEU N N 71 116.829 116.829 118.967 -2.138 18518
3759 1 6 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.259 -0.194 18518
3760 1 6 . 1 1 71 71 LEU C C 71 174.956 174.956 175.859 -0.903 18518
3761 1 6 . 1 1 71 71 LEU CA C 71 55.126 55.126 54.738 0.388 18518
3762 1 6 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.385 0.862 18518
3763 1 6 . 1 1 71 71 LEU H H 71 7.719 7.719 7.936 -0.217 18518
3764 1 6 . 1 1 72 72 GLN N N 72 114.991 114.991 115.829 -0.838 18518
3765 1 6 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.876 -0.040 18518
3766 1 6 . 1 1 72 72 GLN C C 72 175.683 175.683 175.231 0.452 18518
3767 1 6 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.295 0.030 18518
3768 1 6 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.640 0.364 18518
3769 1 6 . 1 1 72 72 GLN H H 72 7.744 7.744 7.418 0.326 18518
3770 1 6 . 1 1 73 73 LEU N N 73 115.045 115.045 119.194 -4.149 18518
3771 1 6 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.017 0.219 18518
3772 1 6 . 1 1 73 73 LEU C C 73 178.762 178.762 177.240 1.522 18518
3773 1 6 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.333 -0.947 18518
3774 1 6 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.534 0.557 18518
3775 1 6 . 1 1 73 73 LEU H H 73 7.500 7.500 7.632 -0.132 18518
3776 1 6 . 1 1 74 74 ASN N N 74 121.700 121.700 122.485 -0.785 18518
3777 1 6 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.605 0.085 18518
3778 1 6 . 1 1 74 74 ASN C C 74 176.617 176.617 175.387 1.230 18518
3779 1 6 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.494 -0.809 18518
3780 1 6 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.602 -0.004 18518
3781 1 6 . 1 1 74 74 ASN H H 74 9.045 9.045 8.399 0.646 18518
3782 1 6 . 1 1 75 75 ALA N N 75 123.952 123.952 121.323 2.629 18518
3783 1 6 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.368 -0.404 18518
3784 1 6 . 1 1 75 75 ALA C C 75 178.131 178.131 177.306 0.825 18518
3785 1 6 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.637 1.231 18518
3786 1 6 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.450 -0.732 18518
3787 1 6 . 1 1 75 75 ALA H H 75 8.784 8.784 8.463 0.321 18518
3788 1 6 . 1 1 76 76 ASN N N 76 112.295 112.295 115.570 -3.275 18518
3789 1 6 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.639 -0.059 18518
3790 1 6 . 1 1 76 76 ASN C C 76 175.448 175.448 175.370 0.078 18518
3791 1 6 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.505 -0.291 18518
3792 1 6 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.465 -0.145 18518
3793 1 6 . 1 1 76 76 ASN H H 76 8.391 8.391 8.312 0.079 18518
3794 1 6 . 1 1 77 77 GLN N N 77 120.577 120.577 118.904 1.673 18518
3795 1 6 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.510 -0.237 18518
3796 1 6 . 1 1 77 77 GLN C C 77 175.045 175.045 174.110 0.935 18518
3797 1 6 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.897 0.908 18518
3798 1 6 . 1 1 77 77 GLN CB C 77 30.157 30.157 30.160 -0.003 18518
3799 1 6 . 1 1 77 77 GLN H H 77 7.552 7.552 7.687 -0.135 18518
3800 1 6 . 1 1 78 78 ALA N N 78 130.670 130.670 125.302 5.368 18518
3801 1 6 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.491 -0.320 18518
3802 1 6 . 1 1 78 78 ALA C C 78 176.512 176.512 175.746 0.766 18518
3803 1 6 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.414 1.428 18518
3804 1 6 . 1 1 78 78 ALA CB C 78 20.060 20.060 20.806 -0.746 18518
3805 1 6 . 1 1 78 78 ALA H H 78 8.799 8.799 8.366 0.433 18518
3806 1 6 . 1 1 79 79 PHE N N 79 119.325 119.325 116.982 2.343 18518
3807 1 6 . 1 1 79 79 PHE HA H 79 4.434 4.434 4.798 -0.364 18518
3808 1 6 . 1 1 79 79 PHE C C 79 171.726 171.726 172.818 -1.092 18518
3809 1 6 . 1 1 79 79 PHE CA C 79 59.145 59.145 55.691 3.454 18518
3810 1 6 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.078 1.093 18518
3811 1 6 . 1 1 79 79 PHE H H 79 7.664 7.664 8.049 -0.385 18518
3812 1 6 . 1 1 80 80 PHE N N 80 126.314 126.314 117.548 8.766 18518
3813 1 6 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.336 0.056 18518
3814 1 6 . 1 1 80 80 PHE C C 80 177.169 177.169 173.129 4.040 18518
3815 1 6 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.389 0.264 18518
3816 1 6 . 1 1 80 80 PHE CB C 80 41.933 41.933 43.021 -1.088 18518
3817 1 6 . 1 1 80 80 PHE H H 80 8.508 8.508 8.939 -0.431 18518
3818 1 6 . 1 1 81 81 LEU N N 81 121.426 121.426 122.908 -1.482 18518
3819 1 6 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.112 -0.261 18518
3820 1 6 . 1 1 81 81 LEU C C 81 174.488 174.488 175.089 -0.601 18518
3821 1 6 . 1 1 81 81 LEU CA C 81 53.197 53.197 54.074 -0.877 18518
3822 1 6 . 1 1 81 81 LEU CB C 81 45.100 45.100 44.010 1.090 18518
3823 1 6 . 1 1 81 81 LEU H H 81 8.229 8.229 8.349 -0.120 18518
3824 1 6 . 1 1 82 82 LEU N N 82 125.155 125.155 126.987 -1.832 18518
3825 1 6 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.595 0.238 18518
3826 1 6 . 1 1 82 82 LEU C C 82 177.166 177.166 175.334 1.832 18518
3827 1 6 . 1 1 82 82 LEU CA C 82 54.197 54.197 53.567 0.630 18518
3828 1 6 . 1 1 82 82 LEU CB C 82 43.442 43.442 44.592 -1.150 18518
3829 1 6 . 1 1 82 82 LEU H H 82 9.400 9.400 9.023 0.377 18518
3830 1 6 . 1 1 83 83 VAL N N 83 123.886 123.886 122.054 1.832 18518
3831 1 6 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.375 0.004 18518
3832 1 6 . 1 1 83 83 VAL C C 83 175.810 175.810 176.938 -1.128 18518
3833 1 6 . 1 1 83 83 VAL CA C 83 61.677 61.677 62.192 -0.515 18518
3834 1 6 . 1 1 83 83 VAL CB C 83 33.758 33.758 31.611 2.147 18518
3835 1 6 . 1 1 83 83 VAL H H 83 8.721 8.721 8.244 0.477 18518
3836 1 6 . 1 1 84 84 ASN N N 84 126.474 126.474 127.833 -1.359 18518
3837 1 6 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.513 -0.117 18518
3838 1 6 . 1 1 84 84 ASN C C 84 175.164 175.164 175.188 -0.024 18518
3839 1 6 . 1 1 84 84 ASN CA C 84 54.738 54.738 55.194 -0.457 18518
3840 1 6 . 1 1 84 84 ASN CB C 84 37.950 37.950 38.197 -0.247 18518
3841 1 6 . 1 1 84 84 ASN H H 84 9.707 9.707 9.577 0.130 18518
3842 1 6 . 1 1 85 85 GLY N N 85 101.296 101.296 105.165 -3.869 18518
3843 1 6 . 1 1 85 85 GLY C C 85 173.680 173.680 172.806 0.874 18518
3844 1 6 . 1 1 85 85 GLY CA C 85 45.603 45.603 45.159 0.444 18518
3845 1 6 . 1 1 85 85 GLY H H 85 8.644 8.644 8.521 0.123 18518
3846 1 6 . 1 1 86 86 HIS N N 86 117.238 117.238 114.830 2.408 18518
3847 1 6 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.960 0.057 18518
3848 1 6 . 1 1 86 86 HIS C C 86 173.841 173.841 173.400 0.441 18518
3849 1 6 . 1 1 86 86 HIS CA C 86 53.796 53.796 53.234 0.562 18518
3850 1 6 . 1 1 86 86 HIS CB C 86 31.280 31.280 32.669 -1.389 18518
3851 1 6 . 1 1 86 86 HIS H H 86 7.918 7.918 8.178 -0.260 18518
3852 1 6 . 1 1 87 87 SER N N 87 118.179 118.179 119.053 -0.874 18518
3853 1 6 . 1 1 87 87 SER HA H 87 4.699 4.699 4.577 0.122 18518
3854 1 6 . 1 1 87 87 SER C C 87 175.904 175.904 174.400 1.504 18518
3855 1 6 . 1 1 87 87 SER CA C 87 58.271 58.271 57.625 0.646 18518
3856 1 6 . 1 1 87 87 SER CB C 87 63.735 63.735 62.525 1.210 18518
3857 1 6 . 1 1 87 87 SER H H 87 8.977 8.977 8.867 0.110 18518
3858 1 6 . 1 1 88 88 MET N N 88 125.472 125.472 122.544 2.928 18518
3859 1 6 . 1 1 88 88 MET HA H 88 4.830 4.830 4.661 0.169 18518
3860 1 6 . 1 1 88 88 MET C C 88 176.419 176.419 175.591 0.828 18518
3861 1 6 . 1 1 88 88 MET CA C 88 54.899 54.899 56.176 -1.278 18518
3862 1 6 . 1 1 88 88 MET CB C 88 33.336 33.336 33.427 -0.091 18518
3863 1 6 . 1 1 88 88 MET H H 88 9.184 9.184 7.778 1.406 18518
3864 1 6 . 1 1 89 89 VAL N N 89 120.747 120.747 121.519 -0.772 18518
3865 1 6 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.316 -0.084 18518
3866 1 6 . 1 1 89 89 VAL C C 89 175.958 175.958 176.209 -0.251 18518
3867 1 6 . 1 1 89 89 VAL CA C 89 63.154 63.154 60.727 2.427 18518
3868 1 6 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.671 -1.793 18518
3869 1 6 . 1 1 89 89 VAL H H 89 8.233 8.233 7.386 0.847 18518
3870 1 6 . 1 1 90 90 SER N N 90 117.362 117.362 118.501 -1.139 18518
3871 1 6 . 1 1 90 90 SER HA H 90 4.590 4.590 4.398 0.192 18518
3872 1 6 . 1 1 90 90 SER C C 90 175.741 175.741 175.624 0.117 18518
3873 1 6 . 1 1 90 90 SER CA C 90 57.717 57.717 58.524 -0.807 18518
3874 1 6 . 1 1 90 90 SER CB C 90 63.223 63.223 63.507 -0.284 18518
3875 1 6 . 1 1 90 90 SER H H 90 8.482 8.482 8.490 -0.008 18518
3876 1 6 . 1 1 91 91 VAL N N 91 120.466 120.466 115.432 5.034 18518
3877 1 6 . 1 1 91 91 VAL HA H 91 4.047 4.047 4.286 -0.239 18518
3878 1 6 . 1 1 91 91 VAL C C 91 176.329 176.329 175.023 1.306 18518
3879 1 6 . 1 1 91 91 VAL CA C 91 63.492 63.492 63.375 0.117 18518
3880 1 6 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.802 0.766 18518
3881 1 6 . 1 1 91 91 VAL H H 91 8.188 8.188 8.410 -0.222 18518
3882 1 6 . 1 1 92 92 SER N N 92 116.398 116.398 113.358 3.040 18518
3883 1 6 . 1 1 92 92 SER HA H 92 4.636 4.636 4.701 -0.065 18518
3884 1 6 . 1 1 92 92 SER C C 92 174.159 174.159 174.467 -0.308 18518
3885 1 6 . 1 1 92 92 SER CA C 92 57.805 57.805 57.145 0.659 18518
3886 1 6 . 1 1 92 92 SER CB C 92 63.046 63.046 63.921 -0.875 18518
3887 1 6 . 1 1 92 92 SER H H 92 8.370 8.370 7.898 0.472 18518
3888 1 6 . 1 1 93 93 THR N N 93 119.211 119.211 119.550 -0.339 18518
3889 1 6 . 1 1 93 93 THR HA H 93 4.484 4.484 4.628 -0.144 18518
3890 1 6 . 1 1 93 93 THR CA C 93 60.884 60.884 61.061 -0.177 18518
3891 1 6 . 1 1 93 93 THR CB C 93 70.609 70.609 68.987 1.622 18518
3892 1 6 . 1 1 93 93 THR H H 93 7.416 7.416 7.786 -0.370 18518
3893 1 6 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.701 -0.261 18518
3894 1 6 . 1 1 94 94 PRO C C 94 178.775 178.775 177.200 1.575 18518
3895 1 6 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.099 0.844 18518
3896 1 6 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.990 -0.341 18518
3897 1 6 . 1 1 95 95 ILE N N 95 124.174 124.174 121.281 2.893 18518
3898 1 6 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.818 0.131 18518
3899 1 6 . 1 1 95 95 ILE C C 95 176.498 176.498 176.840 -0.342 18518
3900 1 6 . 1 1 95 95 ILE CA C 95 63.904 63.904 63.362 0.542 18518
3901 1 6 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.247 -0.065 18518
3902 1 6 . 1 1 95 95 ILE H H 95 9.305 9.305 8.511 0.794 18518
3903 1 6 . 1 1 96 96 SER N N 96 116.920 116.920 116.405 0.515 18518
3904 1 6 . 1 1 96 96 SER HA H 96 4.029 4.029 4.079 -0.050 18518
3905 1 6 . 1 1 96 96 SER C C 96 176.574 176.574 176.223 0.351 18518
3906 1 6 . 1 1 96 96 SER CA C 96 61.356 61.356 62.044 -0.688 18518
3907 1 6 . 1 1 96 96 SER CB C 96 61.723 61.723 62.443 -0.720 18518
3908 1 6 . 1 1 96 96 SER H H 96 8.335 8.335 8.646 -0.311 18518
3909 1 6 . 1 1 97 97 GLU N N 97 123.255 123.255 122.623 0.632 18518
3910 1 6 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.187 0.091 18518
3911 1 6 . 1 1 97 97 GLU C C 97 179.716 179.716 178.803 0.913 18518
3912 1 6 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.737 0.055 18518
3913 1 6 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.191 0.371 18518
3914 1 6 . 1 1 97 97 GLU H H 97 7.376 7.376 7.899 -0.523 18518
3915 1 6 . 1 1 98 98 VAL N N 98 121.137 121.137 120.534 0.603 18518
3916 1 6 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.678 0.124 18518
3917 1 6 . 1 1 98 98 VAL C C 98 177.637 177.637 177.919 -0.282 18518
3918 1 6 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.610 -0.786 18518
3919 1 6 . 1 1 98 98 VAL CB C 98 32.154 32.154 31.182 0.972 18518
3920 1 6 . 1 1 98 98 VAL H H 98 7.387 7.387 7.829 -0.442 18518
3921 1 6 . 1 1 99 99 TYR N N 99 118.927 118.927 122.075 -3.148 18518
3922 1 6 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.042 -0.052 18518
3923 1 6 . 1 1 99 99 TYR C C 99 176.081 176.081 176.811 -0.730 18518
3924 1 6 . 1 1 99 99 TYR CA C 99 62.223 62.223 62.002 0.221 18518
3925 1 6 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.530 0.452 18518
3926 1 6 . 1 1 99 99 TYR H H 99 9.048 9.048 8.350 0.698 18518
3927 1 6 . 1 1 100 100 GLU N N 100 113.894 113.894 116.183 -2.289 18518
3928 1 6 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.775 0.071 18518
3929 1 6 . 1 1 100 100 GLU C C 100 177.989 177.989 178.268 -0.279 18518
3930 1 6 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.365 0.722 18518
3931 1 6 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.935 0.447 18518
3932 1 6 . 1 1 100 100 GLU H H 100 7.422 7.422 8.077 -0.655 18518
3933 1 6 . 1 1 101 101 SER N N 101 108.991 108.991 114.036 -5.045 18518
3934 1 6 . 1 1 101 101 SER HA H 101 4.524 4.524 4.384 0.140 18518
3935 1 6 . 1 1 101 101 SER C C 101 176.628 176.628 175.918 0.710 18518
3936 1 6 . 1 1 101 101 SER CA C 101 60.349 60.349 59.956 0.392 18518
3937 1 6 . 1 1 101 101 SER CB C 101 64.741 64.741 63.960 0.781 18518
3938 1 6 . 1 1 101 101 SER H H 101 7.424 7.424 7.777 -0.353 18518
3939 1 6 . 1 1 102 102 GLU N N 102 116.533 116.533 119.194 -2.661 18518
3940 1 6 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.604 0.140 18518
3941 1 6 . 1 1 102 102 GLU C C 102 176.774 176.774 176.057 0.717 18518
3942 1 6 . 1 1 102 102 GLU CA C 102 55.581 55.581 54.847 0.734 18518
3943 1 6 . 1 1 102 102 GLU CB C 102 30.697 30.697 30.818 -0.121 18518
3944 1 6 . 1 1 102 102 GLU H H 102 8.487 8.487 8.178 0.309 18518
3945 1 6 . 1 1 103 103 LYS N N 103 118.370 118.370 119.375 -1.005 18518
3946 1 6 . 1 1 103 103 LYS HA H 103 4.178 4.178 3.951 0.227 18518
3947 1 6 . 1 1 103 103 LYS C C 103 175.018 175.018 176.607 -1.589 18518
3948 1 6 . 1 1 103 103 LYS CA C 103 57.329 57.329 56.661 0.668 18518
3949 1 6 . 1 1 103 103 LYS CB C 103 32.186 32.186 31.521 0.665 18518
3950 1 6 . 1 1 103 103 LYS H H 103 7.831 7.831 7.567 0.264 18518
3951 1 6 . 1 1 104 104 ASP N N 104 123.500 123.500 125.744 -2.244 18518
3952 1 6 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.681 0.074 18518
3953 1 6 . 1 1 104 104 ASP C C 104 177.383 177.383 177.690 -0.307 18518
3954 1 6 . 1 1 104 104 ASP CA C 104 53.846 53.846 54.418 -0.572 18518
3955 1 6 . 1 1 104 104 ASP CB C 104 43.411 43.411 42.427 0.984 18518
3956 1 6 . 1 1 104 104 ASP H H 104 9.041 9.041 8.421 0.620 18518
3957 1 6 . 1 1 105 105 GLU N N 105 125.448 125.448 120.647 4.801 18518
3958 1 6 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.117 0.063 18518
3959 1 6 . 1 1 105 105 GLU C C 105 177.519 177.519 176.624 0.895 18518
3960 1 6 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.922 0.607 18518
3961 1 6 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.770 0.275 18518
3962 1 6 . 1 1 105 105 GLU H H 105 8.906 8.906 8.891 0.015 18518
3963 1 6 . 1 1 106 106 ASP N N 106 118.824 118.824 116.977 1.847 18518
3964 1 6 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.362 -0.183 18518
3965 1 6 . 1 1 106 106 ASP C C 106 176.223 176.223 176.324 -0.101 18518
3966 1 6 . 1 1 106 106 ASP CA C 106 54.756 54.756 55.272 -0.516 18518
3967 1 6 . 1 1 106 106 ASP CB C 106 39.999 39.999 41.018 -1.019 18518
3968 1 6 . 1 1 106 106 ASP H H 106 10.036 10.036 8.308 1.728 18518
3969 1 6 . 1 1 107 107 GLY N N 107 105.866 105.866 105.396 0.470 18518
3970 1 6 . 1 1 107 107 GLY C C 107 175.136 175.136 173.566 1.570 18518
3971 1 6 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.110 0.112 18518
3972 1 6 . 1 1 107 107 GLY H H 107 8.001 8.001 8.060 -0.059 18518
3973 1 6 . 1 1 108 108 PHE N N 108 123.820 123.820 119.149 4.671 18518
3974 1 6 . 1 1 108 108 PHE HA H 108 4.662 4.662 5.255 -0.593 18518
3975 1 6 . 1 1 108 108 PHE C C 108 174.899 174.899 174.796 0.103 18518
3976 1 6 . 1 1 108 108 PHE CA C 108 60.238 60.238 57.774 2.464 18518
3977 1 6 . 1 1 108 108 PHE CB C 108 40.365 40.365 40.995 -0.630 18518
3978 1 6 . 1 1 108 108 PHE H H 108 9.912 9.912 7.856 2.055 18518
3979 1 6 . 1 1 109 109 LEU N N 109 120.130 120.130 120.440 -0.310 18518
3980 1 6 . 1 1 109 109 LEU HA H 109 5.030 5.030 5.065 -0.035 18518
3981 1 6 . 1 1 109 109 LEU C C 109 173.916 173.916 174.828 -0.912 18518
3982 1 6 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.598 -0.174 18518
3983 1 6 . 1 1 109 109 LEU CB C 109 45.203 45.203 45.360 -0.157 18518
3984 1 6 . 1 1 109 109 LEU H H 109 7.997 7.997 8.688 -0.691 18518
3985 1 6 . 1 1 110 110 TYR N N 110 126.579 126.579 126.301 0.278 18518
3986 1 6 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.801 0.202 18518
3987 1 6 . 1 1 110 110 TYR C C 110 176.671 176.671 175.542 1.129 18518
3988 1 6 . 1 1 110 110 TYR CA C 110 59.058 59.058 57.907 1.151 18518
3989 1 6 . 1 1 110 110 TYR CB C 110 39.556 39.556 39.257 0.299 18518
3990 1 6 . 1 1 110 110 TYR H H 110 9.377 9.377 9.103 0.274 18518
3991 1 6 . 1 1 111 111 MET N N 111 119.240 119.240 123.224 -3.984 18518
3992 1 6 . 1 1 111 111 MET HA H 111 5.486 5.486 5.131 0.355 18518
3993 1 6 . 1 1 111 111 MET C C 111 175.695 175.695 174.478 1.217 18518
3994 1 6 . 1 1 111 111 MET CA C 111 54.124 54.124 54.961 -0.837 18518
3995 1 6 . 1 1 111 111 MET CB C 111 36.960 36.960 36.908 0.052 18518
3996 1 6 . 1 1 111 111 MET H H 111 9.658 9.658 9.151 0.507 18518
3997 1 6 . 1 1 112 112 VAL N N 112 119.865 119.865 121.475 -1.610 18518
3998 1 6 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.395 0.568 18518
3999 1 6 . 1 1 112 112 VAL C C 112 175.058 175.058 174.708 0.350 18518
4000 1 6 . 1 1 112 112 VAL CA C 112 58.911 58.911 60.233 -1.321 18518
4001 1 6 . 1 1 112 112 VAL CB C 112 36.051 36.051 34.950 1.101 18518
4002 1 6 . 1 1 112 112 VAL H H 112 8.794 8.794 9.175 -0.381 18518
4003 1 6 . 1 1 113 113 TYR N N 113 119.664 119.664 122.313 -2.649 18518
4004 1 6 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.675 0.443 18518
4005 1 6 . 1 1 113 113 TYR C C 113 173.375 173.375 173.704 -0.329 18518
4006 1 6 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.053 -0.901 18518
4007 1 6 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.714 1.598 18518
4008 1 6 . 1 1 113 113 TYR H H 113 8.315 8.315 8.609 -0.294 18518
4009 1 6 . 1 1 114 114 ALA N N 114 119.763 119.763 123.933 -4.170 18518
4010 1 6 . 1 1 114 114 ALA HA H 114 4.800 4.800 4.994 -0.194 18518
4011 1 6 . 1 1 114 114 ALA C C 114 176.216 176.216 175.258 0.958 18518
4012 1 6 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.728 -0.596 18518
4013 1 6 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.483 2.113 18518
4014 1 6 . 1 1 114 114 ALA H H 114 8.465 8.465 8.943 -0.478 18518
4015 1 6 . 1 1 115 115 SER N N 115 114.763 114.763 115.871 -1.108 18518
4016 1 6 . 1 1 115 115 SER HA H 115 4.496 4.496 4.920 -0.424 18518
4017 1 6 . 1 1 115 115 SER C C 115 172.671 172.671 173.705 -1.034 18518
4018 1 6 . 1 1 115 115 SER CA C 115 58.651 58.651 57.320 1.331 18518
4019 1 6 . 1 1 115 115 SER CB C 115 63.526 63.526 61.357 2.169 18518
4020 1 6 . 1 1 115 115 SER H H 115 9.915 9.915 9.002 0.913 18518
4021 1 6 . 1 1 116 116 GLN N N 116 116.611 116.611 123.448 -6.837 18518
4022 1 6 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.425 0.059 18518
4023 1 6 . 1 1 116 116 GLN C C 116 172.733 172.733 173.647 -0.914 18518
4024 1 6 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.829 -1.903 18518
4025 1 6 . 1 1 116 116 GLN CB C 116 32.358 32.358 31.280 1.078 18518
4026 1 6 . 1 1 116 116 GLN H H 116 7.219 7.219 7.833 -0.614 18518
4027 1 6 . 1 1 117 117 GLU N N 117 117.623 117.623 120.281 -2.658 18518
4028 1 6 . 1 1 117 117 GLU HA H 117 3.287 3.287 3.263 0.024 18518
4029 1 6 . 1 1 117 117 GLU C C 117 175.168 175.168 175.574 -0.406 18518
4030 1 6 . 1 1 117 117 GLU CA C 117 56.882 56.882 56.834 0.048 18518
4031 1 6 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.386 1.136 18518
4032 1 6 . 1 1 117 117 GLU H H 117 7.882 7.882 8.272 -0.390 18518
4033 1 6 . 1 1 118 118 THR N N 118 109.820 109.820 111.226 -1.406 18518
4034 1 6 . 1 1 118 118 THR HA H 118 4.066 4.066 4.325 -0.259 18518
4035 1 6 . 1 1 118 118 THR C C 118 172.355 172.355 173.753 -1.398 18518
4036 1 6 . 1 1 118 118 THR CA C 118 60.029 60.029 60.867 -0.839 18518
4037 1 6 . 1 1 118 118 THR CB C 118 70.480 70.480 69.323 1.157 18518
4038 1 6 . 1 1 118 118 THR H H 118 6.992 6.992 7.296 -0.304 18518
4039 1 7 . 1 1 2 2 ALA HA H 2 4.336 4.336 4.665 -0.329 18518
4040 1 7 . 1 1 2 2 ALA C C 2 177.974 177.974 176.693 1.281 18518
4041 1 7 . 1 1 2 2 ALA CA C 2 52.785 52.785 52.234 0.551 18518
4042 1 7 . 1 1 2 2 ALA CB C 2 19.444 19.444 19.198 0.246 18518
4043 1 7 . 1 1 3 3 MET N N 3 119.311 119.311 122.932 -3.621 18518
4044 1 7 . 1 1 3 3 MET HA H 3 4.451 4.451 4.596 -0.145 18518
4045 1 7 . 1 1 3 3 MET C C 3 176.913 176.913 175.577 1.336 18518
4046 1 7 . 1 1 3 3 MET CA C 3 55.679 55.679 55.142 0.537 18518
4047 1 7 . 1 1 3 3 MET CB C 3 32.590 32.590 35.402 -2.812 18518
4048 1 7 . 1 1 3 3 MET H H 3 8.638 8.638 8.443 0.195 18518
4049 1 7 . 1 1 4 4 GLY N N 4 110.281 110.281 110.396 -0.115 18518
4050 1 7 . 1 1 4 4 GLY C C 4 174.180 174.180 173.785 0.395 18518
4051 1 7 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.842 0.653 18518
4052 1 7 . 1 1 4 4 GLY H H 4 8.552 8.552 8.563 -0.011 18518
4053 1 7 . 1 1 5 5 LYS N N 5 120.818 120.818 125.710 -4.892 18518
4054 1 7 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.779 -0.270 18518
4055 1 7 . 1 1 5 5 LYS C C 5 177.605 177.605 176.646 0.959 18518
4056 1 7 . 1 1 5 5 LYS CA C 5 56.134 56.134 54.584 1.550 18518
4057 1 7 . 1 1 5 5 LYS CB C 5 34.813 34.813 31.841 2.972 18518
4058 1 7 . 1 1 5 5 LYS H H 5 8.133 8.133 8.289 -0.156 18518
4059 1 7 . 1 1 6 6 THR N N 6 114.781 114.781 119.599 -4.818 18518
4060 1 7 . 1 1 6 6 THR HA H 6 4.421 4.421 4.337 0.084 18518
4061 1 7 . 1 1 6 6 THR C C 6 175.524 175.524 175.874 -0.350 18518
4062 1 7 . 1 1 6 6 THR CA C 6 61.127 61.127 62.697 -1.570 18518
4063 1 7 . 1 1 6 6 THR CB C 6 69.926 69.926 69.987 -0.061 18518
4064 1 7 . 1 1 6 6 THR H H 6 8.483 8.483 8.334 0.149 18518
4065 1 7 . 1 1 7 7 PHE N N 7 125.552 125.552 122.496 3.056 18518
4066 1 7 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.061 -0.056 18518
4067 1 7 . 1 1 7 7 PHE C C 7 177.397 177.397 176.813 0.584 18518
4068 1 7 . 1 1 7 7 PHE CA C 7 63.393 63.393 61.904 1.489 18518
4069 1 7 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.059 1.508 18518
4070 1 7 . 1 1 7 7 PHE H H 7 10.245 10.245 9.240 1.005 18518
4071 1 7 . 1 1 8 8 LYS N N 8 114.053 114.053 117.162 -3.109 18518
4072 1 7 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.817 0.018 18518
4073 1 7 . 1 1 8 8 LYS C C 8 175.520 175.520 178.123 -2.603 18518
4074 1 7 . 1 1 8 8 LYS CA C 8 59.993 59.993 57.937 2.056 18518
4075 1 7 . 1 1 8 8 LYS CB C 8 33.689 33.689 30.868 2.821 18518
4076 1 7 . 1 1 8 8 LYS H H 8 8.775 8.775 6.873 1.902 18518
4077 1 7 . 1 1 9 9 GLN N N 9 113.516 113.516 118.199 -4.683 18518
4078 1 7 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.064 0.085 18518
4079 1 7 . 1 1 9 9 GLN C C 9 177.615 177.615 177.764 -0.149 18518
4080 1 7 . 1 1 9 9 GLN CA C 9 56.819 56.819 58.088 -1.269 18518
4081 1 7 . 1 1 9 9 GLN CB C 9 30.019 30.019 28.977 1.042 18518
4082 1 7 . 1 1 9 9 GLN H H 9 7.355 7.355 7.710 -0.355 18518
4083 1 7 . 1 1 10 10 ARG N N 10 118.294 118.294 116.304 1.990 18518
4084 1 7 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.210 0.092 18518
4085 1 7 . 1 1 10 10 ARG C C 10 179.380 179.380 177.356 2.024 18518
4086 1 7 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.126 0.142 18518
4087 1 7 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.696 0.946 18518
4088 1 7 . 1 1 10 10 ARG H H 10 7.936 7.936 7.696 0.240 18518
4089 1 7 . 1 1 11 11 ARG N N 11 121.137 121.137 119.603 1.534 18518
4090 1 7 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.646 0.034 18518
4091 1 7 . 1 1 11 11 ARG CA C 11 53.453 53.453 55.042 -1.589 18518
4092 1 7 . 1 1 11 11 ARG CB C 11 32.938 32.938 31.919 1.019 18518
4093 1 7 . 1 1 11 11 ARG H H 11 7.390 7.390 7.646 -0.256 18518
4094 1 7 . 1 1 12 12 THR N N 12 116.819 116.819 119.075 -2.256 18518
4095 1 7 . 1 1 12 12 THR HA H 12 4.359 4.359 4.213 0.146 18518
4096 1 7 . 1 1 12 12 THR C C 12 174.989 174.989 176.166 -1.177 18518
4097 1 7 . 1 1 12 12 THR CA C 12 61.748 61.748 63.002 -1.254 18518
4098 1 7 . 1 1 12 12 THR CB C 12 71.068 71.068 70.031 1.036 18518
4099 1 7 . 1 1 12 12 THR H H 12 8.953 8.953 8.519 0.434 18518
4100 1 7 . 1 1 13 13 PHE N N 13 123.200 123.200 121.811 1.389 18518
4101 1 7 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.205 -0.177 18518
4102 1 7 . 1 1 13 13 PHE C C 13 176.029 176.029 176.961 -0.932 18518
4103 1 7 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.636 0.228 18518
4104 1 7 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.305 0.255 18518
4105 1 7 . 1 1 13 13 PHE H H 13 9.284 9.284 9.016 0.268 18518
4106 1 7 . 1 1 14 14 GLU N N 14 115.414 115.414 117.984 -2.570 18518
4107 1 7 . 1 1 14 14 GLU HA H 14 3.794 3.794 3.983 -0.189 18518
4108 1 7 . 1 1 14 14 GLU C C 14 180.081 180.081 179.049 1.032 18518
4109 1 7 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.940 0.679 18518
4110 1 7 . 1 1 14 14 GLU CB C 14 28.852 28.852 28.437 0.415 18518
4111 1 7 . 1 1 14 14 GLU H H 14 8.973 8.973 8.799 0.174 18518
4112 1 7 . 1 1 15 15 GLN N N 15 119.276 119.276 119.103 0.173 18518
4113 1 7 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.126 -0.126 18518
4114 1 7 . 1 1 15 15 GLN C C 15 177.978 177.978 178.855 -0.877 18518
4115 1 7 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.531 0.304 18518
4116 1 7 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.094 1.276 18518
4117 1 7 . 1 1 15 15 GLN H H 15 7.756 7.756 8.602 -0.846 18518
4118 1 7 . 1 1 16 16 ARG N N 16 121.336 121.336 120.346 0.990 18518
4119 1 7 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.198 0.072 18518
4120 1 7 . 1 1 16 16 ARG C C 16 177.416 177.416 178.679 -1.263 18518
4121 1 7 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.730 1.645 18518
4122 1 7 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.323 0.282 18518
4123 1 7 . 1 1 16 16 ARG H H 16 8.645 8.645 8.051 0.594 18518
4124 1 7 . 1 1 17 17 VAL N N 17 117.630 117.630 121.151 -3.521 18518
4125 1 7 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.504 0.353 18518
4126 1 7 . 1 1 17 17 VAL C C 17 179.748 179.748 177.264 2.484 18518
4127 1 7 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.938 -0.212 18518
4128 1 7 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.769 0.425 18518
4129 1 7 . 1 1 17 17 VAL H H 17 8.373 8.373 8.274 0.099 18518
4130 1 7 . 1 1 18 18 GLU N N 18 120.864 120.864 119.401 1.463 18518
4131 1 7 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.918 0.384 18518
4132 1 7 . 1 1 18 18 GLU C C 18 177.728 177.728 178.884 -1.156 18518
4133 1 7 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.945 -1.459 18518
4134 1 7 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.266 0.116 18518
4135 1 7 . 1 1 18 18 GLU H H 18 7.368 7.368 8.414 -1.046 18518
4136 1 7 . 1 1 19 19 ASP N N 19 121.425 121.425 120.000 1.425 18518
4137 1 7 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.450 -0.016 18518
4138 1 7 . 1 1 19 19 ASP C C 19 179.978 179.978 178.416 1.562 18518
4139 1 7 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.219 0.203 18518
4140 1 7 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.445 0.842 18518
4141 1 7 . 1 1 19 19 ASP H H 19 8.671 8.671 8.094 0.577 18518
4142 1 7 . 1 1 20 20 VAL N N 20 119.730 119.730 119.799 -0.069 18518
4143 1 7 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.343 -0.138 18518
4144 1 7 . 1 1 20 20 VAL C C 20 176.284 176.284 177.629 -1.345 18518
4145 1 7 . 1 1 20 20 VAL CA C 20 66.315 66.315 66.305 0.010 18518
4146 1 7 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.005 0.102 18518
4147 1 7 . 1 1 20 20 VAL H H 20 7.999 7.999 7.972 0.027 18518
4148 1 7 . 1 1 21 21 ARG N N 21 121.455 121.455 119.414 2.041 18518
4149 1 7 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.951 -0.137 18518
4150 1 7 . 1 1 21 21 ARG C C 21 180.120 180.120 178.576 1.544 18518
4151 1 7 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.826 1.004 18518
4152 1 7 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.153 0.793 18518
4153 1 7 . 1 1 21 21 ARG H H 21 8.098 8.098 7.955 0.143 18518
4154 1 7 . 1 1 22 22 LEU N N 22 117.826 117.826 120.910 -3.084 18518
4155 1 7 . 1 1 22 22 LEU HA H 22 4.049 4.049 3.975 0.074 18518
4156 1 7 . 1 1 22 22 LEU C C 22 180.115 180.115 178.644 1.471 18518
4157 1 7 . 1 1 22 22 LEU CA C 22 57.790 57.790 58.262 -0.472 18518
4158 1 7 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.877 0.265 18518
4159 1 7 . 1 1 22 22 LEU H H 22 8.207 8.207 7.989 0.218 18518
4160 1 7 . 1 1 23 23 ILE N N 23 121.450 121.450 119.136 2.314 18518
4161 1 7 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.659 0.354 18518
4162 1 7 . 1 1 23 23 ILE C C 23 178.149 178.149 178.056 0.093 18518
4163 1 7 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.703 -2.532 18518
4164 1 7 . 1 1 23 23 ILE CB C 23 38.106 38.106 37.663 0.443 18518
4165 1 7 . 1 1 23 23 ILE H H 23 8.105 8.105 8.027 0.078 18518
4166 1 7 . 1 1 24 24 ARG N N 24 121.139 121.139 119.309 1.830 18518
4167 1 7 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.063 -0.076 18518
4168 1 7 . 1 1 24 24 ARG C C 24 178.702 178.702 178.836 -0.134 18518
4169 1 7 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.853 -1.135 18518
4170 1 7 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.761 -0.992 18518
4171 1 7 . 1 1 24 24 ARG H H 24 8.601 8.601 8.264 0.337 18518
4172 1 7 . 1 1 25 25 GLU N N 25 118.054 118.054 118.398 -0.344 18518
4173 1 7 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.162 -0.136 18518
4174 1 7 . 1 1 25 25 GLU C C 25 178.492 178.492 178.342 0.150 18518
4175 1 7 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.257 0.523 18518
4176 1 7 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.583 0.418 18518
4177 1 7 . 1 1 25 25 GLU H H 25 7.423 7.423 7.795 -0.372 18518
4178 1 7 . 1 1 26 26 GLN N N 26 116.350 116.350 116.579 -0.229 18518
4179 1 7 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.052 -0.116 18518
4180 1 7 . 1 1 26 26 GLN C C 26 176.305 176.305 176.819 -0.514 18518
4181 1 7 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.347 0.156 18518
4182 1 7 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.527 0.680 18518
4183 1 7 . 1 1 26 26 GLN H H 26 7.524 7.524 7.724 -0.200 18518
4184 1 7 . 1 1 27 27 HIS N N 27 116.017 116.017 118.430 -2.413 18518
4185 1 7 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.128 -0.198 18518
4186 1 7 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.983 0.070 18518
4187 1 7 . 1 1 27 27 HIS CB C 27 30.747 30.747 29.576 1.171 18518
4188 1 7 . 1 1 27 27 HIS H H 27 8.284 8.284 8.089 0.195 18518
4189 1 7 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.565 0.016 18518
4190 1 7 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.535 0.384 18518
4191 1 7 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.214 0.241 18518
4192 1 7 . 1 1 29 29 THR N N 29 107.011 107.011 105.867 1.144 18518
4193 1 7 . 1 1 29 29 THR HA H 29 4.599 4.599 4.338 0.261 18518
4194 1 7 . 1 1 29 29 THR C C 29 172.884 172.884 174.051 -1.167 18518
4195 1 7 . 1 1 29 29 THR CA C 29 60.810 60.810 61.892 -1.082 18518
4196 1 7 . 1 1 29 29 THR CB C 29 68.531 68.531 68.404 0.127 18518
4197 1 7 . 1 1 29 29 THR H H 29 7.890 7.890 8.181 -0.291 18518
4198 1 7 . 1 1 30 30 LYS N N 30 117.679 117.679 120.613 -2.934 18518
4199 1 7 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.998 -0.140 18518
4200 1 7 . 1 1 30 30 LYS C C 30 174.310 174.310 174.522 -0.212 18518
4201 1 7 . 1 1 30 30 LYS CA C 30 53.751 53.751 53.858 -0.107 18518
4202 1 7 . 1 1 30 30 LYS CB C 30 35.804 35.804 36.298 -0.494 18518
4203 1 7 . 1 1 30 30 LYS H H 30 7.441 7.441 7.661 -0.220 18518
4204 1 7 . 1 1 31 31 ILE N N 31 122.849 122.849 121.853 0.996 18518
4205 1 7 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.278 -0.173 18518
4206 1 7 . 1 1 31 31 ILE CA C 31 54.801 54.801 55.981 -1.180 18518
4207 1 7 . 1 1 31 31 ILE CB C 31 38.265 38.265 38.479 -0.214 18518
4208 1 7 . 1 1 31 31 ILE H H 31 9.304 9.304 8.830 0.474 18518
4209 1 7 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.935 0.224 18518
4210 1 7 . 1 1 32 32 PRO C C 32 174.164 174.164 175.768 -1.604 18518
4211 1 7 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.065 -0.562 18518
4212 1 7 . 1 1 32 32 PRO CB C 32 31.145 31.145 31.021 0.124 18518
4213 1 7 . 1 1 33 33 VAL N N 33 125.606 125.606 126.240 -0.634 18518
4214 1 7 . 1 1 33 33 VAL HA H 33 5.213 5.213 4.843 0.370 18518
4215 1 7 . 1 1 33 33 VAL C C 33 173.654 173.654 173.818 -0.164 18518
4216 1 7 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.667 0.377 18518
4217 1 7 . 1 1 33 33 VAL CB C 33 35.604 35.604 36.010 -0.406 18518
4218 1 7 . 1 1 33 33 VAL H H 33 9.424 9.424 8.513 0.911 18518
4219 1 7 . 1 1 34 34 ILE N N 34 128.241 128.241 128.509 -0.268 18518
4220 1 7 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.691 0.142 18518
4221 1 7 . 1 1 34 34 ILE C C 34 175.605 175.605 174.626 0.979 18518
4222 1 7 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.307 -1.542 18518
4223 1 7 . 1 1 34 34 ILE CB C 34 36.799 36.799 37.957 -1.158 18518
4224 1 7 . 1 1 34 34 ILE H H 34 8.721 8.721 8.925 -0.204 18518
4225 1 7 . 1 1 35 35 ILE N N 35 125.650 125.650 128.772 -3.122 18518
4226 1 7 . 1 1 35 35 ILE HA H 35 4.836 4.836 5.033 -0.197 18518
4227 1 7 . 1 1 35 35 ILE C C 35 174.887 174.887 174.486 0.401 18518
4228 1 7 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.123 0.822 18518
4229 1 7 . 1 1 35 35 ILE CB C 35 39.210 39.210 40.698 -1.488 18518
4230 1 7 . 1 1 35 35 ILE H H 35 9.034 9.034 9.108 -0.074 18518
4231 1 7 . 1 1 36 36 GLU N N 36 122.657 122.657 125.258 -2.601 18518
4232 1 7 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.925 -0.064 18518
4233 1 7 . 1 1 36 36 GLU C C 36 173.848 173.848 174.597 -0.749 18518
4234 1 7 . 1 1 36 36 GLU CA C 36 53.932 53.932 53.971 -0.040 18518
4235 1 7 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.651 0.631 18518
4236 1 7 . 1 1 36 36 GLU H H 36 8.303 8.303 8.401 -0.098 18518
4237 1 7 . 1 1 37 37 ARG N N 37 123.228 123.228 122.894 0.334 18518
4238 1 7 . 1 1 37 37 ARG HA H 37 2.726 2.726 4.188 -1.462 18518
4239 1 7 . 1 1 37 37 ARG C C 37 176.359 176.359 176.079 0.280 18518
4240 1 7 . 1 1 37 37 ARG CA C 37 56.359 56.359 55.868 0.491 18518
4241 1 7 . 1 1 37 37 ARG CB C 37 31.341 31.341 31.303 0.038 18518
4242 1 7 . 1 1 37 37 ARG H H 37 8.856 8.856 8.636 0.220 18518
4243 1 7 . 1 1 38 38 TYR N N 38 128.981 128.981 126.964 2.017 18518
4244 1 7 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.168 0.184 18518
4245 1 7 . 1 1 38 38 TYR C C 38 177.316 177.316 176.484 0.832 18518
4246 1 7 . 1 1 38 38 TYR CA C 38 57.712 57.712 58.388 -0.676 18518
4247 1 7 . 1 1 38 38 TYR CB C 38 39.472 39.472 39.870 -0.398 18518
4248 1 7 . 1 1 38 38 TYR H H 38 8.628 8.628 8.103 0.525 18518
4249 1 7 . 1 1 39 39 LYS N N 39 130.635 130.635 126.282 4.353 18518
4250 1 7 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.749 0.073 18518
4251 1 7 . 1 1 39 39 LYS CA C 39 58.887 58.887 58.235 0.652 18518
4252 1 7 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.947 -0.176 18518
4253 1 7 . 1 1 39 39 LYS H H 39 8.594 8.594 8.055 0.539 18518
4254 1 7 . 1 1 40 40 GLY C C 40 173.447 173.447 174.380 -0.933 18518
4255 1 7 . 1 1 40 40 GLY CA C 40 44.663 44.663 43.854 0.809 18518
4256 1 7 . 1 1 40 40 GLY H H 40 5.188 5.188 6.144 -0.956 18518
4257 1 7 . 1 1 41 41 GLU N N 41 122.836 122.836 121.294 1.542 18518
4258 1 7 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.286 -0.029 18518
4259 1 7 . 1 1 41 41 GLU C C 41 176.524 176.524 176.097 0.427 18518
4260 1 7 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.173 0.352 18518
4261 1 7 . 1 1 41 41 GLU CB C 41 30.985 30.985 30.151 0.835 18518
4262 1 7 . 1 1 41 41 GLU H H 41 7.380 7.380 7.380 -0.000 18518
4263 1 7 . 1 1 42 42 LYS N N 42 124.040 124.040 124.307 -0.267 18518
4264 1 7 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.443 0.232 18518
4265 1 7 . 1 1 42 42 LYS C C 42 177.538 177.538 176.916 0.622 18518
4266 1 7 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.675 -0.835 18518
4267 1 7 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.170 1.809 18518
4268 1 7 . 1 1 42 42 LYS H H 42 9.034 9.034 8.433 0.601 18518
4269 1 7 . 1 1 43 43 GLN N N 43 119.259 119.259 119.069 0.190 18518
4270 1 7 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.475 0.067 18518
4271 1 7 . 1 1 43 43 GLN C C 43 177.336 177.336 176.252 1.084 18518
4272 1 7 . 1 1 43 43 GLN CA C 43 57.673 57.673 56.983 0.691 18518
4273 1 7 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.370 0.412 18518
4274 1 7 . 1 1 43 43 GLN H H 43 8.435 8.435 8.845 -0.410 18518
4275 1 7 . 1 1 44 44 LEU N N 44 120.760 120.760 123.068 -2.308 18518
4276 1 7 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.802 -0.107 18518
4277 1 7 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.530 0.715 18518
4278 1 7 . 1 1 44 44 LEU CB C 44 43.596 43.596 42.814 0.782 18518
4279 1 7 . 1 1 44 44 LEU H H 44 9.126 9.126 8.394 0.732 18518
4280 1 7 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.619 0.098 18518
4281 1 7 . 1 1 45 45 PRO C C 45 175.797 175.797 176.168 -0.371 18518
4282 1 7 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.260 -0.149 18518
4283 1 7 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.475 0.117 18518
4284 1 7 . 1 1 46 46 VAL N N 46 119.052 119.052 120.517 -1.465 18518
4285 1 7 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.799 -0.932 18518
4286 1 7 . 1 1 46 46 VAL C C 46 175.640 175.640 176.609 -0.969 18518
4287 1 7 . 1 1 46 46 VAL CA C 46 62.944 62.944 61.368 1.576 18518
4288 1 7 . 1 1 46 46 VAL CB C 46 32.799 32.799 33.635 -0.836 18518
4289 1 7 . 1 1 46 46 VAL H H 46 8.543 8.543 8.226 0.317 18518
4290 1 7 . 1 1 47 47 LEU N N 47 130.203 130.203 126.104 4.099 18518
4291 1 7 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.546 -0.237 18518
4292 1 7 . 1 1 47 47 LEU C C 47 176.198 176.198 177.394 -1.196 18518
4293 1 7 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.219 -0.213 18518
4294 1 7 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.448 1.384 18518
4295 1 7 . 1 1 47 47 LEU H H 47 7.799 7.799 8.566 -0.767 18518
4296 1 7 . 1 1 48 48 ASP N N 48 122.403 122.403 119.583 2.820 18518
4297 1 7 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.695 -0.432 18518
4298 1 7 . 1 1 48 48 ASP C C 48 175.294 175.294 175.894 -0.600 18518
4299 1 7 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.438 0.395 18518
4300 1 7 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.431 -1.247 18518
4301 1 7 . 1 1 48 48 ASP H H 48 8.780 8.780 8.419 0.361 18518
4302 1 7 . 1 1 49 49 LYS N N 49 119.569 119.569 116.875 2.694 18518
4303 1 7 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.518 0.067 18518
4304 1 7 . 1 1 49 49 LYS C C 49 174.678 174.678 175.773 -1.095 18518
4305 1 7 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.298 -1.646 18518
4306 1 7 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.267 1.678 18518
4307 1 7 . 1 1 49 49 LYS H H 49 7.280 7.280 7.536 -0.256 18518
4308 1 7 . 1 1 50 50 THR N N 50 110.862 110.862 109.503 1.359 18518
4309 1 7 . 1 1 50 50 THR HA H 50 4.811 4.811 4.863 -0.052 18518
4310 1 7 . 1 1 50 50 THR C C 50 172.425 172.425 174.589 -2.164 18518
4311 1 7 . 1 1 50 50 THR CA C 50 62.645 62.645 62.903 -0.258 18518
4312 1 7 . 1 1 50 50 THR CB C 50 71.648 71.648 70.291 1.357 18518
4313 1 7 . 1 1 50 50 THR H H 50 8.042 8.042 8.335 -0.293 18518
4314 1 7 . 1 1 51 51 LYS N N 51 120.008 120.008 122.351 -2.343 18518
4315 1 7 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.575 0.050 18518
4316 1 7 . 1 1 51 51 LYS C C 51 175.082 175.082 175.818 -0.736 18518
4317 1 7 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.720 -2.016 18518
4318 1 7 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.315 -0.939 18518
4319 1 7 . 1 1 51 51 LYS H H 51 7.119 7.119 7.638 -0.519 18518
4320 1 7 . 1 1 52 52 PHE N N 52 122.640 122.640 123.230 -0.590 18518
4321 1 7 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.763 0.574 18518
4322 1 7 . 1 1 52 52 PHE C C 52 174.213 174.213 173.932 0.281 18518
4323 1 7 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.875 -0.264 18518
4324 1 7 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.480 -0.340 18518
4325 1 7 . 1 1 52 52 PHE H H 52 9.709 9.709 9.170 0.539 18518
4326 1 7 . 1 1 53 53 LEU N N 53 122.157 122.157 122.924 -0.767 18518
4327 1 7 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.959 -0.012 18518
4328 1 7 . 1 1 53 53 LEU C C 53 175.769 175.769 175.644 0.125 18518
4329 1 7 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.949 -0.992 18518
4330 1 7 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.774 0.641 18518
4331 1 7 . 1 1 53 53 LEU H H 53 8.959 8.959 8.540 0.419 18518
4332 1 7 . 1 1 54 54 VAL N N 54 124.919 124.919 124.821 0.098 18518
4333 1 7 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.581 -0.022 18518
4334 1 7 . 1 1 54 54 VAL CA C 54 59.130 59.130 59.048 0.082 18518
4335 1 7 . 1 1 54 54 VAL CB C 54 34.968 34.968 34.330 0.638 18518
4336 1 7 . 1 1 54 54 VAL H H 54 8.922 8.922 8.454 0.468 18518
4337 1 7 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.833 -0.392 18518
4338 1 7 . 1 1 55 55 PRO C C 55 176.594 176.594 178.169 -1.575 18518
4339 1 7 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.190 2.126 18518
4340 1 7 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.016 0.649 18518
4341 1 7 . 1 1 56 56 ASP N N 56 120.522 120.522 123.218 -2.696 18518
4342 1 7 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.199 -0.337 18518
4343 1 7 . 1 1 56 56 ASP C C 56 175.809 175.809 176.558 -0.749 18518
4344 1 7 . 1 1 56 56 ASP CA C 56 56.749 56.749 57.447 -0.698 18518
4345 1 7 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.587 -0.077 18518
4346 1 7 . 1 1 56 56 ASP H H 56 8.347 8.347 8.444 -0.097 18518
4347 1 7 . 1 1 57 57 HIS N N 57 113.482 113.482 115.093 -1.611 18518
4348 1 7 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.543 0.177 18518
4349 1 7 . 1 1 57 57 HIS C C 57 176.507 176.507 174.472 2.035 18518
4350 1 7 . 1 1 57 57 HIS CA C 57 55.589 55.589 56.053 -0.464 18518
4351 1 7 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.719 0.924 18518
4352 1 7 . 1 1 57 57 HIS H H 57 7.557 7.557 8.325 -0.768 18518
4353 1 7 . 1 1 58 58 VAL N N 58 123.279 123.279 122.015 1.264 18518
4354 1 7 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.011 -0.175 18518
4355 1 7 . 1 1 58 58 VAL C C 58 175.019 175.019 174.421 0.598 18518
4356 1 7 . 1 1 58 58 VAL CA C 58 62.823 62.823 60.979 1.844 18518
4357 1 7 . 1 1 58 58 VAL CB C 58 32.310 32.310 33.929 -1.619 18518
4358 1 7 . 1 1 58 58 VAL H H 58 7.345 7.345 7.479 -0.134 18518
4359 1 7 . 1 1 59 59 ASN N N 59 123.781 123.781 124.197 -0.416 18518
4360 1 7 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.111 0.015 18518
4361 1 7 . 1 1 59 59 ASN C C 59 176.558 176.558 176.600 -0.042 18518
4362 1 7 . 1 1 59 59 ASN CA C 59 51.485 51.485 52.109 -0.624 18518
4363 1 7 . 1 1 59 59 ASN CB C 59 40.107 40.107 39.809 0.297 18518
4364 1 7 . 1 1 59 59 ASN H H 59 8.735 8.735 8.551 0.184 18518
4365 1 7 . 1 1 60 60 MET N N 60 117.453 117.453 118.935 -1.482 18518
4366 1 7 . 1 1 60 60 MET HA H 60 4.395 4.395 4.097 0.298 18518
4367 1 7 . 1 1 60 60 MET C C 60 178.144 178.144 178.228 -0.084 18518
4368 1 7 . 1 1 60 60 MET CA C 60 57.097 57.097 56.206 0.891 18518
4369 1 7 . 1 1 60 60 MET CB C 60 30.140 30.140 30.389 -0.249 18518
4370 1 7 . 1 1 60 60 MET H H 60 8.227 8.227 8.577 -0.350 18518
4371 1 7 . 1 1 61 61 SER N N 61 114.216 114.216 115.714 -1.498 18518
4372 1 7 . 1 1 61 61 SER HA H 61 4.111 4.111 4.027 0.084 18518
4373 1 7 . 1 1 61 61 SER C C 61 177.335 177.335 176.418 0.917 18518
4374 1 7 . 1 1 61 61 SER CA C 61 61.590 61.590 62.382 -0.792 18518
4375 1 7 . 1 1 61 61 SER CB C 61 62.402 62.402 62.885 -0.483 18518
4376 1 7 . 1 1 61 61 SER H H 61 8.464 8.464 8.532 -0.068 18518
4377 1 7 . 1 1 62 62 GLU N N 62 123.004 123.004 121.430 1.574 18518
4378 1 7 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.084 -0.037 18518
4379 1 7 . 1 1 62 62 GLU C C 62 178.686 178.686 178.552 0.134 18518
4380 1 7 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.816 -0.191 18518
4381 1 7 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.001 0.653 18518
4382 1 7 . 1 1 62 62 GLU H H 62 7.994 7.994 7.731 0.263 18518
4383 1 7 . 1 1 63 63 LEU N N 63 120.818 120.818 122.005 -1.187 18518
4384 1 7 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.981 -0.016 18518
4385 1 7 . 1 1 63 63 LEU C C 63 178.046 178.046 178.526 -0.480 18518
4386 1 7 . 1 1 63 63 LEU CA C 63 57.920 57.920 58.025 -0.105 18518
4387 1 7 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.632 -0.008 18518
4388 1 7 . 1 1 63 63 LEU H H 63 8.130 8.130 7.792 0.338 18518
4389 1 7 . 1 1 64 64 ILE N N 64 118.528 118.528 119.100 -0.572 18518
4390 1 7 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.511 -0.142 18518
4391 1 7 . 1 1 64 64 ILE C C 64 177.127 177.127 177.753 -0.626 18518
4392 1 7 . 1 1 64 64 ILE CA C 64 66.678 66.678 66.042 0.636 18518
4393 1 7 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.553 0.890 18518
4394 1 7 . 1 1 64 64 ILE H H 64 8.488 8.488 8.568 -0.080 18518
4395 1 7 . 1 1 65 65 LYS N N 65 118.336 118.336 120.621 -2.285 18518
4396 1 7 . 1 1 65 65 LYS HA H 65 3.701 3.701 3.915 -0.214 18518
4397 1 7 . 1 1 65 65 LYS C C 65 179.291 179.291 179.208 0.083 18518
4398 1 7 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.955 0.485 18518
4399 1 7 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.288 0.083 18518
4400 1 7 . 1 1 65 65 LYS H H 65 7.347 7.347 7.654 -0.307 18518
4401 1 7 . 1 1 66 66 ILE N N 66 120.171 120.171 119.924 0.247 18518
4402 1 7 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.672 -0.094 18518
4403 1 7 . 1 1 66 66 ILE C C 66 178.873 178.873 178.180 0.693 18518
4404 1 7 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.184 -0.024 18518
4405 1 7 . 1 1 66 66 ILE CB C 66 38.633 38.633 38.032 0.601 18518
4406 1 7 . 1 1 66 66 ILE H H 66 7.901 7.901 7.956 -0.055 18518
4407 1 7 . 1 1 67 67 ILE N N 67 121.185 121.185 120.698 0.487 18518
4408 1 7 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.602 -0.156 18518
4409 1 7 . 1 1 67 67 ILE C C 67 177.150 177.150 177.854 -0.704 18518
4410 1 7 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.368 -1.562 18518
4411 1 7 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.331 -2.337 18518
4412 1 7 . 1 1 67 67 ILE H H 67 8.290 8.290 8.147 0.143 18518
4413 1 7 . 1 1 68 68 ARG N N 68 119.173 119.173 118.683 0.490 18518
4414 1 7 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.709 -0.778 18518
4415 1 7 . 1 1 68 68 ARG C C 68 178.496 178.496 178.549 -0.053 18518
4416 1 7 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.364 1.272 18518
4417 1 7 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.663 0.777 18518
4418 1 7 . 1 1 68 68 ARG H H 68 8.438 8.438 8.292 0.146 18518
4419 1 7 . 1 1 69 69 ARG N N 69 116.511 116.511 119.743 -3.232 18518
4420 1 7 . 1 1 69 69 ARG HA H 69 4.134 4.134 3.992 0.142 18518
4421 1 7 . 1 1 69 69 ARG C C 69 180.262 180.262 179.093 1.169 18518
4422 1 7 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.084 -0.377 18518
4423 1 7 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.108 -0.155 18518
4424 1 7 . 1 1 69 69 ARG H H 69 7.497 7.497 7.931 -0.434 18518
4425 1 7 . 1 1 70 70 ARG N N 70 123.297 123.297 119.406 3.891 18518
4426 1 7 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.135 -0.119 18518
4427 1 7 . 1 1 70 70 ARG C C 70 178.700 178.700 178.211 0.489 18518
4428 1 7 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.611 0.849 18518
4429 1 7 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.615 0.697 18518
4430 1 7 . 1 1 70 70 ARG H H 70 8.075 8.075 7.880 0.195 18518
4431 1 7 . 1 1 71 71 LEU N N 71 116.829 116.829 119.293 -2.464 18518
4432 1 7 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.194 -0.129 18518
4433 1 7 . 1 1 71 71 LEU C C 71 174.956 174.956 175.781 -0.825 18518
4434 1 7 . 1 1 71 71 LEU CA C 71 55.126 55.126 55.506 -0.380 18518
4435 1 7 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.635 0.611 18518
4436 1 7 . 1 1 71 71 LEU H H 71 7.719 7.719 8.014 -0.295 18518
4437 1 7 . 1 1 72 72 GLN N N 72 114.991 114.991 114.269 0.722 18518
4438 1 7 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.837 -0.001 18518
4439 1 7 . 1 1 72 72 GLN C C 72 175.683 175.683 175.546 0.137 18518
4440 1 7 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.162 0.163 18518
4441 1 7 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.710 0.294 18518
4442 1 7 . 1 1 72 72 GLN H H 72 7.744 7.744 7.371 0.373 18518
4443 1 7 . 1 1 73 73 LEU N N 73 115.045 115.045 116.098 -1.053 18518
4444 1 7 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.185 0.051 18518
4445 1 7 . 1 1 73 73 LEU C C 73 178.762 178.762 176.420 2.342 18518
4446 1 7 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.101 -0.715 18518
4447 1 7 . 1 1 73 73 LEU CB C 73 42.091 42.091 42.402 -0.311 18518
4448 1 7 . 1 1 73 73 LEU H H 73 7.500 7.500 7.186 0.314 18518
4449 1 7 . 1 1 74 74 ASN N N 74 121.700 121.700 119.288 2.412 18518
4450 1 7 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.658 0.032 18518
4451 1 7 . 1 1 74 74 ASN C C 74 176.617 176.617 176.064 0.553 18518
4452 1 7 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.210 -0.525 18518
4453 1 7 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.335 0.263 18518
4454 1 7 . 1 1 74 74 ASN H H 74 9.045 9.045 8.385 0.660 18518
4455 1 7 . 1 1 75 75 ALA N N 75 123.952 123.952 121.797 2.155 18518
4456 1 7 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.314 -0.350 18518
4457 1 7 . 1 1 75 75 ALA C C 75 178.131 178.131 177.560 0.571 18518
4458 1 7 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.883 0.985 18518
4459 1 7 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.363 -0.645 18518
4460 1 7 . 1 1 75 75 ALA H H 75 8.784 8.784 8.460 0.324 18518
4461 1 7 . 1 1 76 76 ASN N N 76 112.295 112.295 116.272 -3.977 18518
4462 1 7 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.652 -0.072 18518
4463 1 7 . 1 1 76 76 ASN C C 76 175.448 175.448 175.158 0.290 18518
4464 1 7 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.470 -0.256 18518
4465 1 7 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.497 -0.177 18518
4466 1 7 . 1 1 76 76 ASN H H 76 8.391 8.391 8.455 -0.064 18518
4467 1 7 . 1 1 77 77 GLN N N 77 120.577 120.577 117.197 3.380 18518
4468 1 7 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.576 -0.303 18518
4469 1 7 . 1 1 77 77 GLN C C 77 175.045 175.045 173.690 1.355 18518
4470 1 7 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.635 1.170 18518
4471 1 7 . 1 1 77 77 GLN CB C 77 30.157 30.157 31.503 -1.346 18518
4472 1 7 . 1 1 77 77 GLN H H 77 7.552 7.552 7.556 -0.004 18518
4473 1 7 . 1 1 78 78 ALA N N 78 130.670 130.670 123.120 7.550 18518
4474 1 7 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.502 -0.331 18518
4475 1 7 . 1 1 78 78 ALA C C 78 176.512 176.512 175.921 0.591 18518
4476 1 7 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.376 1.466 18518
4477 1 7 . 1 1 78 78 ALA CB C 78 20.060 20.060 20.829 -0.769 18518
4478 1 7 . 1 1 78 78 ALA H H 78 8.799 8.799 8.516 0.283 18518
4479 1 7 . 1 1 79 79 PHE N N 79 119.325 119.325 117.389 1.936 18518
4480 1 7 . 1 1 79 79 PHE HA H 79 4.434 4.434 5.148 -0.714 18518
4481 1 7 . 1 1 79 79 PHE C C 79 171.726 171.726 172.841 -1.115 18518
4482 1 7 . 1 1 79 79 PHE CA C 79 59.145 59.145 55.516 3.629 18518
4483 1 7 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.920 0.251 18518
4484 1 7 . 1 1 79 79 PHE H H 79 7.664 7.664 8.156 -0.492 18518
4485 1 7 . 1 1 80 80 PHE N N 80 126.314 126.314 118.035 8.279 18518
4486 1 7 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.659 -0.267 18518
4487 1 7 . 1 1 80 80 PHE C C 80 177.169 177.169 173.480 3.689 18518
4488 1 7 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.131 0.522 18518
4489 1 7 . 1 1 80 80 PHE CB C 80 41.933 41.933 42.958 -1.025 18518
4490 1 7 . 1 1 80 80 PHE H H 80 8.508 8.508 8.821 -0.313 18518
4491 1 7 . 1 1 81 81 LEU N N 81 121.426 121.426 123.112 -1.686 18518
4492 1 7 . 1 1 81 81 LEU HA H 81 4.851 4.851 4.994 -0.143 18518
4493 1 7 . 1 1 81 81 LEU C C 81 174.488 174.488 174.922 -0.434 18518
4494 1 7 . 1 1 81 81 LEU CA C 81 53.197 53.197 53.823 -0.626 18518
4495 1 7 . 1 1 81 81 LEU CB C 81 45.100 45.100 43.449 1.651 18518
4496 1 7 . 1 1 81 81 LEU H H 81 8.229 8.229 8.628 -0.399 18518
4497 1 7 . 1 1 82 82 LEU N N 82 125.155 125.155 127.735 -2.580 18518
4498 1 7 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.522 0.311 18518
4499 1 7 . 1 1 82 82 LEU C C 82 177.166 177.166 175.453 1.713 18518
4500 1 7 . 1 1 82 82 LEU CA C 82 54.197 54.197 54.282 -0.085 18518
4501 1 7 . 1 1 82 82 LEU CB C 82 43.442 43.442 43.842 -0.400 18518
4502 1 7 . 1 1 82 82 LEU H H 82 9.400 9.400 8.978 0.422 18518
4503 1 7 . 1 1 83 83 VAL N N 83 123.886 123.886 120.951 2.935 18518
4504 1 7 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.462 -0.083 18518
4505 1 7 . 1 1 83 83 VAL C C 83 175.810 175.810 176.638 -0.828 18518
4506 1 7 . 1 1 83 83 VAL CA C 83 61.677 61.677 61.124 0.553 18518
4507 1 7 . 1 1 83 83 VAL CB C 83 33.758 33.758 32.486 1.272 18518
4508 1 7 . 1 1 83 83 VAL H H 83 8.721 8.721 8.742 -0.021 18518
4509 1 7 . 1 1 84 84 ASN N N 84 126.474 126.474 126.802 -0.328 18518
4510 1 7 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.439 -0.043 18518
4511 1 7 . 1 1 84 84 ASN C C 84 175.164 175.164 175.074 0.090 18518
4512 1 7 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.942 -0.204 18518
4513 1 7 . 1 1 84 84 ASN CB C 84 37.950 37.950 37.721 0.229 18518
4514 1 7 . 1 1 84 84 ASN H H 84 9.707 9.707 9.629 0.078 18518
4515 1 7 . 1 1 85 85 GLY N N 85 101.296 101.296 104.280 -2.984 18518
4516 1 7 . 1 1 85 85 GLY C C 85 173.680 173.680 172.948 0.732 18518
4517 1 7 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.730 0.873 18518
4518 1 7 . 1 1 85 85 GLY H H 85 8.644 8.644 8.320 0.324 18518
4519 1 7 . 1 1 86 86 HIS N N 86 117.238 117.238 118.831 -1.593 18518
4520 1 7 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.753 0.264 18518
4521 1 7 . 1 1 86 86 HIS C C 86 173.841 173.841 173.963 -0.122 18518
4522 1 7 . 1 1 86 86 HIS CA C 86 53.796 53.796 54.129 -0.333 18518
4523 1 7 . 1 1 86 86 HIS CB C 86 31.280 31.280 32.560 -1.280 18518
4524 1 7 . 1 1 86 86 HIS H H 86 7.918 7.918 8.177 -0.259 18518
4525 1 7 . 1 1 87 87 SER N N 87 118.179 118.179 121.291 -3.112 18518
4526 1 7 . 1 1 87 87 SER HA H 87 4.699 4.699 4.476 0.223 18518
4527 1 7 . 1 1 87 87 SER C C 87 175.904 175.904 174.344 1.560 18518
4528 1 7 . 1 1 87 87 SER CA C 87 58.271 58.271 58.817 -0.546 18518
4529 1 7 . 1 1 87 87 SER CB C 87 63.735 63.735 62.110 1.625 18518
4530 1 7 . 1 1 87 87 SER H H 87 8.977 8.977 8.790 0.187 18518
4531 1 7 . 1 1 88 88 MET N N 88 125.472 125.472 122.301 3.171 18518
4532 1 7 . 1 1 88 88 MET HA H 88 4.830 4.830 4.736 0.094 18518
4533 1 7 . 1 1 88 88 MET C C 88 176.419 176.419 174.534 1.885 18518
4534 1 7 . 1 1 88 88 MET CA C 88 54.899 54.899 54.571 0.328 18518
4535 1 7 . 1 1 88 88 MET CB C 88 33.336 33.336 33.505 -0.169 18518
4536 1 7 . 1 1 88 88 MET H H 88 9.184 9.184 8.107 1.077 18518
4537 1 7 . 1 1 89 89 VAL N N 89 120.747 120.747 123.216 -2.469 18518
4538 1 7 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.178 0.054 18518
4539 1 7 . 1 1 89 89 VAL C C 89 175.958 175.958 176.073 -0.115 18518
4540 1 7 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.919 1.235 18518
4541 1 7 . 1 1 89 89 VAL CB C 89 31.878 31.878 31.402 0.476 18518
4542 1 7 . 1 1 89 89 VAL H H 89 8.233 8.233 7.875 0.358 18518
4543 1 7 . 1 1 90 90 SER N N 90 117.362 117.362 122.462 -5.100 18518
4544 1 7 . 1 1 90 90 SER HA H 90 4.590 4.590 4.455 0.135 18518
4545 1 7 . 1 1 90 90 SER C C 90 175.741 175.741 175.863 -0.122 18518
4546 1 7 . 1 1 90 90 SER CA C 90 57.717 57.717 58.029 -0.312 18518
4547 1 7 . 1 1 90 90 SER CB C 90 63.223 63.223 64.241 -1.018 18518
4548 1 7 . 1 1 90 90 SER H H 90 8.482 8.482 8.483 -0.001 18518
4549 1 7 . 1 1 91 91 VAL N N 91 120.466 120.466 123.112 -2.646 18518
4550 1 7 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.809 0.238 18518
4551 1 7 . 1 1 91 91 VAL C C 91 176.329 176.329 176.305 0.024 18518
4552 1 7 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.936 -1.444 18518
4553 1 7 . 1 1 91 91 VAL CB C 91 32.568 32.568 32.169 0.399 18518
4554 1 7 . 1 1 91 91 VAL H H 91 8.188 8.188 8.745 -0.557 18518
4555 1 7 . 1 1 92 92 SER N N 92 116.398 116.398 112.776 3.622 18518
4556 1 7 . 1 1 92 92 SER HA H 92 4.636 4.636 4.404 0.232 18518
4557 1 7 . 1 1 92 92 SER C C 92 174.159 174.159 174.667 -0.508 18518
4558 1 7 . 1 1 92 92 SER CA C 92 57.805 57.805 59.384 -1.579 18518
4559 1 7 . 1 1 92 92 SER CB C 92 63.046 63.046 63.068 -0.022 18518
4560 1 7 . 1 1 92 92 SER H H 92 8.370 8.370 8.262 0.108 18518
4561 1 7 . 1 1 93 93 THR N N 93 119.211 119.211 120.719 -1.508 18518
4562 1 7 . 1 1 93 93 THR HA H 93 4.484 4.484 4.384 0.100 18518
4563 1 7 . 1 1 93 93 THR CA C 93 60.884 60.884 62.356 -1.472 18518
4564 1 7 . 1 1 93 93 THR CB C 93 70.609 70.609 68.980 1.629 18518
4565 1 7 . 1 1 93 93 THR H H 93 7.416 7.416 7.392 0.024 18518
4566 1 7 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.661 -0.221 18518
4567 1 7 . 1 1 94 94 PRO C C 94 178.775 178.775 177.311 1.464 18518
4568 1 7 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.321 0.622 18518
4569 1 7 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.706 -0.057 18518
4570 1 7 . 1 1 95 95 ILE N N 95 124.174 124.174 123.602 0.572 18518
4571 1 7 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.793 0.156 18518
4572 1 7 . 1 1 95 95 ILE C C 95 176.498 176.498 177.079 -0.581 18518
4573 1 7 . 1 1 95 95 ILE CA C 95 63.904 63.904 63.664 0.240 18518
4574 1 7 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.170 0.012 18518
4575 1 7 . 1 1 95 95 ILE H H 95 9.305 9.305 8.127 1.178 18518
4576 1 7 . 1 1 96 96 SER N N 96 116.920 116.920 116.929 -0.009 18518
4577 1 7 . 1 1 96 96 SER HA H 96 4.029 4.029 4.065 -0.036 18518
4578 1 7 . 1 1 96 96 SER C C 96 176.574 176.574 176.254 0.320 18518
4579 1 7 . 1 1 96 96 SER CA C 96 61.356 61.356 62.140 -0.784 18518
4580 1 7 . 1 1 96 96 SER CB C 96 61.723 61.723 62.518 -0.795 18518
4581 1 7 . 1 1 96 96 SER H H 96 8.335 8.335 7.908 0.427 18518
4582 1 7 . 1 1 97 97 GLU N N 97 123.255 123.255 123.158 0.097 18518
4583 1 7 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.177 0.101 18518
4584 1 7 . 1 1 97 97 GLU C C 97 179.716 179.716 179.134 0.582 18518
4585 1 7 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.712 0.080 18518
4586 1 7 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.163 0.399 18518
4587 1 7 . 1 1 97 97 GLU H H 97 7.376 7.376 7.778 -0.402 18518
4588 1 7 . 1 1 98 98 VAL N N 98 121.137 121.137 122.173 -1.036 18518
4589 1 7 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.773 0.029 18518
4590 1 7 . 1 1 98 98 VAL C C 98 177.637 177.637 178.282 -0.645 18518
4591 1 7 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.781 -0.957 18518
4592 1 7 . 1 1 98 98 VAL CB C 98 32.154 32.154 31.232 0.922 18518
4593 1 7 . 1 1 98 98 VAL H H 98 7.387 7.387 7.875 -0.487 18518
4594 1 7 . 1 1 99 99 TYR N N 99 118.927 118.927 121.560 -2.633 18518
4595 1 7 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.024 -0.034 18518
4596 1 7 . 1 1 99 99 TYR C C 99 176.081 176.081 177.159 -1.078 18518
4597 1 7 . 1 1 99 99 TYR CA C 99 62.223 62.223 61.784 0.439 18518
4598 1 7 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.516 0.466 18518
4599 1 7 . 1 1 99 99 TYR H H 99 9.048 9.048 8.564 0.484 18518
4600 1 7 . 1 1 100 100 GLU N N 100 113.894 113.894 116.235 -2.341 18518
4601 1 7 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.903 -0.057 18518
4602 1 7 . 1 1 100 100 GLU C C 100 177.989 177.989 178.498 -0.509 18518
4603 1 7 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.817 0.270 18518
4604 1 7 . 1 1 100 100 GLU CB C 100 29.382 29.382 29.350 0.032 18518
4605 1 7 . 1 1 100 100 GLU H H 100 7.422 7.422 8.171 -0.749 18518
4606 1 7 . 1 1 101 101 SER N N 101 108.991 108.991 113.536 -4.545 18518
4607 1 7 . 1 1 101 101 SER HA H 101 4.524 4.524 4.462 0.062 18518
4608 1 7 . 1 1 101 101 SER C C 101 176.628 176.628 175.553 1.075 18518
4609 1 7 . 1 1 101 101 SER CA C 101 60.349 60.349 60.206 0.143 18518
4610 1 7 . 1 1 101 101 SER CB C 101 64.741 64.741 64.495 0.246 18518
4611 1 7 . 1 1 101 101 SER H H 101 7.424 7.424 7.904 -0.480 18518
4612 1 7 . 1 1 102 102 GLU N N 102 116.533 116.533 120.941 -4.408 18518
4613 1 7 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.663 0.081 18518
4614 1 7 . 1 1 102 102 GLU C C 102 176.774 176.774 175.589 1.185 18518
4615 1 7 . 1 1 102 102 GLU CA C 102 55.581 55.581 55.963 -0.382 18518
4616 1 7 . 1 1 102 102 GLU CB C 102 30.697 30.697 31.017 -0.320 18518
4617 1 7 . 1 1 102 102 GLU H H 102 8.487 8.487 8.139 0.348 18518
4618 1 7 . 1 1 103 103 LYS N N 103 118.370 118.370 119.879 -1.509 18518
4619 1 7 . 1 1 103 103 LYS HA H 103 4.178 4.178 3.944 0.234 18518
4620 1 7 . 1 1 103 103 LYS C C 103 175.018 175.018 176.708 -1.690 18518
4621 1 7 . 1 1 103 103 LYS CA C 103 57.329 57.329 57.020 0.309 18518
4622 1 7 . 1 1 103 103 LYS CB C 103 32.186 32.186 32.023 0.163 18518
4623 1 7 . 1 1 103 103 LYS H H 103 7.831 7.831 7.675 0.156 18518
4624 1 7 . 1 1 104 104 ASP N N 104 123.500 123.500 123.531 -0.031 18518
4625 1 7 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.819 -0.064 18518
4626 1 7 . 1 1 104 104 ASP C C 104 177.383 177.383 177.585 -0.202 18518
4627 1 7 . 1 1 104 104 ASP CA C 104 53.846 53.846 53.757 0.090 18518
4628 1 7 . 1 1 104 104 ASP CB C 104 43.411 43.411 42.559 0.852 18518
4629 1 7 . 1 1 104 104 ASP H H 104 9.041 9.041 8.172 0.869 18518
4630 1 7 . 1 1 105 105 GLU N N 105 125.448 125.448 120.628 4.820 18518
4631 1 7 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.138 0.042 18518
4632 1 7 . 1 1 105 105 GLU C C 105 177.519 177.519 176.610 0.909 18518
4633 1 7 . 1 1 105 105 GLU CA C 105 59.529 59.529 59.095 0.434 18518
4634 1 7 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.730 0.314 18518
4635 1 7 . 1 1 105 105 GLU H H 105 8.906 8.906 8.949 -0.043 18518
4636 1 7 . 1 1 106 106 ASP N N 106 118.824 118.824 114.685 4.139 18518
4637 1 7 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.572 -0.393 18518
4638 1 7 . 1 1 106 106 ASP C C 106 176.223 176.223 177.147 -0.924 18518
4639 1 7 . 1 1 106 106 ASP CA C 106 54.756 54.756 53.579 1.177 18518
4640 1 7 . 1 1 106 106 ASP CB C 106 39.999 39.999 39.927 0.072 18518
4641 1 7 . 1 1 106 106 ASP H H 106 10.036 10.036 8.136 1.900 18518
4642 1 7 . 1 1 107 107 GLY N N 107 105.866 105.866 107.179 -1.313 18518
4643 1 7 . 1 1 107 107 GLY C C 107 175.136 175.136 173.966 1.170 18518
4644 1 7 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.474 -0.252 18518
4645 1 7 . 1 1 107 107 GLY H H 107 8.001 8.001 7.800 0.201 18518
4646 1 7 . 1 1 108 108 PHE N N 108 123.820 123.820 120.115 3.705 18518
4647 1 7 . 1 1 108 108 PHE HA H 108 4.662 4.662 5.195 -0.533 18518
4648 1 7 . 1 1 108 108 PHE C C 108 174.899 174.899 174.463 0.436 18518
4649 1 7 . 1 1 108 108 PHE CA C 108 60.238 60.238 58.348 1.890 18518
4650 1 7 . 1 1 108 108 PHE CB C 108 40.365 40.365 41.175 -0.810 18518
4651 1 7 . 1 1 108 108 PHE H H 108 9.912 9.912 8.541 1.371 18518
4652 1 7 . 1 1 109 109 LEU N N 109 120.130 120.130 121.603 -1.473 18518
4653 1 7 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.810 0.220 18518
4654 1 7 . 1 1 109 109 LEU C C 109 173.916 173.916 174.934 -1.018 18518
4655 1 7 . 1 1 109 109 LEU CA C 109 53.424 53.424 54.053 -0.629 18518
4656 1 7 . 1 1 109 109 LEU CB C 109 45.203 45.203 44.230 0.973 18518
4657 1 7 . 1 1 109 109 LEU H H 109 7.997 7.997 8.578 -0.581 18518
4658 1 7 . 1 1 110 110 TYR N N 110 126.579 126.579 128.418 -1.839 18518
4659 1 7 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.668 0.335 18518
4660 1 7 . 1 1 110 110 TYR C C 110 176.671 176.671 175.052 1.619 18518
4661 1 7 . 1 1 110 110 TYR CA C 110 59.058 59.058 59.004 0.054 18518
4662 1 7 . 1 1 110 110 TYR CB C 110 39.556 39.556 39.075 0.481 18518
4663 1 7 . 1 1 110 110 TYR H H 110 9.377 9.377 8.464 0.913 18518
4664 1 7 . 1 1 111 111 MET N N 111 119.240 119.240 123.202 -3.962 18518
4665 1 7 . 1 1 111 111 MET HA H 111 5.486 5.486 5.339 0.147 18518
4666 1 7 . 1 1 111 111 MET C C 111 175.695 175.695 174.459 1.236 18518
4667 1 7 . 1 1 111 111 MET CA C 111 54.124 54.124 54.518 -0.394 18518
4668 1 7 . 1 1 111 111 MET CB C 111 36.960 36.960 37.678 -0.718 18518
4669 1 7 . 1 1 111 111 MET H H 111 9.658 9.658 9.177 0.481 18518
4670 1 7 . 1 1 112 112 VAL N N 112 119.865 119.865 115.912 3.953 18518
4671 1 7 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.552 0.411 18518
4672 1 7 . 1 1 112 112 VAL C C 112 175.058 175.058 174.010 1.048 18518
4673 1 7 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.341 -0.430 18518
4674 1 7 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.600 0.451 18518
4675 1 7 . 1 1 112 112 VAL H H 112 8.794 8.794 8.901 -0.107 18518
4676 1 7 . 1 1 113 113 TYR N N 113 119.664 119.664 119.902 -0.238 18518
4677 1 7 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.638 0.480 18518
4678 1 7 . 1 1 113 113 TYR C C 113 173.375 173.375 173.413 -0.038 18518
4679 1 7 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.153 -1.000 18518
4680 1 7 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.438 1.874 18518
4681 1 7 . 1 1 113 113 TYR H H 113 8.315 8.315 8.438 -0.123 18518
4682 1 7 . 1 1 114 114 ALA N N 114 119.763 119.763 123.758 -3.995 18518
4683 1 7 . 1 1 114 114 ALA HA H 114 4.800 4.800 4.612 0.188 18518
4684 1 7 . 1 1 114 114 ALA C C 114 176.216 176.216 175.078 1.138 18518
4685 1 7 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.548 -0.416 18518
4686 1 7 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.184 2.412 18518
4687 1 7 . 1 1 114 114 ALA H H 114 8.465 8.465 8.594 -0.129 18518
4688 1 7 . 1 1 115 115 SER N N 115 114.763 114.763 116.666 -1.903 18518
4689 1 7 . 1 1 115 115 SER HA H 115 4.496 4.496 4.943 -0.447 18518
4690 1 7 . 1 1 115 115 SER C C 115 172.671 172.671 173.361 -0.690 18518
4691 1 7 . 1 1 115 115 SER CA C 115 58.651 58.651 57.365 1.286 18518
4692 1 7 . 1 1 115 115 SER CB C 115 63.526 63.526 61.431 2.095 18518
4693 1 7 . 1 1 115 115 SER H H 115 9.915 9.915 8.920 0.995 18518
4694 1 7 . 1 1 116 116 GLN N N 116 116.611 116.611 123.355 -6.744 18518
4695 1 7 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.426 0.058 18518
4696 1 7 . 1 1 116 116 GLN C C 116 172.733 172.733 172.859 -0.126 18518
4697 1 7 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.315 -1.389 18518
4698 1 7 . 1 1 116 116 GLN CB C 116 32.358 32.358 29.941 2.417 18518
4699 1 7 . 1 1 116 116 GLN H H 116 7.219 7.219 7.733 -0.514 18518
4700 1 7 . 1 1 117 117 GLU N N 117 117.623 117.623 119.267 -1.644 18518
4701 1 7 . 1 1 117 117 GLU HA H 117 3.287 3.287 3.103 0.184 18518
4702 1 7 . 1 1 117 117 GLU C C 117 175.168 175.168 175.135 0.033 18518
4703 1 7 . 1 1 117 117 GLU CA C 117 56.882 56.882 56.439 0.443 18518
4704 1 7 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.733 0.789 18518
4705 1 7 . 1 1 117 117 GLU H H 117 7.882 7.882 8.465 -0.583 18518
4706 1 7 . 1 1 118 118 THR N N 118 109.820 109.820 109.326 0.494 18518
4707 1 7 . 1 1 118 118 THR HA H 118 4.066 4.066 4.338 -0.272 18518
4708 1 7 . 1 1 118 118 THR C C 118 172.355 172.355 174.095 -1.740 18518
4709 1 7 . 1 1 118 118 THR CA C 118 60.029 60.029 60.474 -0.445 18518
4710 1 7 . 1 1 118 118 THR CB C 118 70.480 70.480 69.930 0.550 18518
4711 1 7 . 1 1 118 118 THR H H 118 6.992 6.992 7.184 -0.192 18518
4712 1 8 . 1 1 2 2 ALA HA H 2 4.336 4.336 5.332 -0.996 18518
4713 1 8 . 1 1 2 2 ALA C C 2 177.974 177.974 176.699 1.275 18518
4714 1 8 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.566 1.220 18518
4715 1 8 . 1 1 2 2 ALA CB C 2 19.444 19.444 21.370 -1.926 18518
4716 1 8 . 1 1 3 3 MET N N 3 119.311 119.311 119.526 -0.215 18518
4717 1 8 . 1 1 3 3 MET HA H 3 4.451 4.451 4.693 -0.242 18518
4718 1 8 . 1 1 3 3 MET C C 3 176.913 176.913 174.655 2.258 18518
4719 1 8 . 1 1 3 3 MET CA C 3 55.679 55.679 55.298 0.381 18518
4720 1 8 . 1 1 3 3 MET CB C 3 32.590 32.590 34.984 -2.394 18518
4721 1 8 . 1 1 3 3 MET H H 3 8.638 8.638 8.602 0.036 18518
4722 1 8 . 1 1 4 4 GLY N N 4 110.281 110.281 110.245 0.036 18518
4723 1 8 . 1 1 4 4 GLY C C 4 174.180 174.180 173.828 0.352 18518
4724 1 8 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.731 0.764 18518
4725 1 8 . 1 1 4 4 GLY H H 4 8.552 8.552 8.548 0.004 18518
4726 1 8 . 1 1 5 5 LYS N N 5 120.818 120.818 125.748 -4.930 18518
4727 1 8 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.462 0.047 18518
4728 1 8 . 1 1 5 5 LYS C C 5 177.605 177.605 176.472 1.133 18518
4729 1 8 . 1 1 5 5 LYS CA C 5 56.134 56.134 54.661 1.473 18518
4730 1 8 . 1 1 5 5 LYS CB C 5 34.813 34.813 32.927 1.886 18518
4731 1 8 . 1 1 5 5 LYS H H 5 8.133 8.133 8.270 -0.137 18518
4732 1 8 . 1 1 6 6 THR N N 6 114.781 114.781 118.375 -3.594 18518
4733 1 8 . 1 1 6 6 THR HA H 6 4.421 4.421 4.293 0.128 18518
4734 1 8 . 1 1 6 6 THR C C 6 175.524 175.524 176.001 -0.477 18518
4735 1 8 . 1 1 6 6 THR CA C 6 61.127 61.127 62.590 -1.463 18518
4736 1 8 . 1 1 6 6 THR CB C 6 69.926 69.926 69.690 0.236 18518
4737 1 8 . 1 1 6 6 THR H H 6 8.483 8.483 8.533 -0.050 18518
4738 1 8 . 1 1 7 7 PHE N N 7 125.552 125.552 122.307 3.245 18518
4739 1 8 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.119 -0.114 18518
4740 1 8 . 1 1 7 7 PHE C C 7 177.397 177.397 177.030 0.367 18518
4741 1 8 . 1 1 7 7 PHE CA C 7 63.393 63.393 61.615 1.778 18518
4742 1 8 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.503 1.064 18518
4743 1 8 . 1 1 7 7 PHE H H 7 10.245 10.245 9.107 1.138 18518
4744 1 8 . 1 1 8 8 LYS N N 8 114.053 114.053 117.432 -3.379 18518
4745 1 8 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.635 0.200 18518
4746 1 8 . 1 1 8 8 LYS C C 8 175.520 175.520 178.035 -2.515 18518
4747 1 8 . 1 1 8 8 LYS CA C 8 59.993 59.993 57.919 2.074 18518
4748 1 8 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.577 2.112 18518
4749 1 8 . 1 1 8 8 LYS H H 8 8.775 8.775 7.184 1.591 18518
4750 1 8 . 1 1 9 9 GLN N N 9 113.516 113.516 117.542 -4.026 18518
4751 1 8 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.098 0.051 18518
4752 1 8 . 1 1 9 9 GLN C C 9 177.615 177.615 177.302 0.313 18518
4753 1 8 . 1 1 9 9 GLN CA C 9 56.819 56.819 57.951 -1.132 18518
4754 1 8 . 1 1 9 9 GLN CB C 9 30.019 30.019 29.383 0.636 18518
4755 1 8 . 1 1 9 9 GLN H H 9 7.355 7.355 7.597 -0.242 18518
4756 1 8 . 1 1 10 10 ARG N N 10 118.294 118.294 115.803 2.491 18518
4757 1 8 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.197 0.105 18518
4758 1 8 . 1 1 10 10 ARG C C 10 179.380 179.380 176.707 2.673 18518
4759 1 8 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.028 0.240 18518
4760 1 8 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.575 1.067 18518
4761 1 8 . 1 1 10 10 ARG H H 10 7.936 7.936 7.776 0.160 18518
4762 1 8 . 1 1 11 11 ARG N N 11 121.137 121.137 119.311 1.826 18518
4763 1 8 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.551 0.129 18518
4764 1 8 . 1 1 11 11 ARG CA C 11 53.453 53.453 55.243 -1.790 18518
4765 1 8 . 1 1 11 11 ARG CB C 11 32.938 32.938 32.545 0.393 18518
4766 1 8 . 1 1 11 11 ARG H H 11 7.390 7.390 7.470 -0.080 18518
4767 1 8 . 1 1 12 12 THR N N 12 116.819 116.819 120.232 -3.413 18518
4768 1 8 . 1 1 12 12 THR HA H 12 4.359 4.359 4.305 0.054 18518
4769 1 8 . 1 1 12 12 THR C C 12 174.989 174.989 176.544 -1.555 18518
4770 1 8 . 1 1 12 12 THR CA C 12 61.748 61.748 62.418 -0.670 18518
4771 1 8 . 1 1 12 12 THR CB C 12 71.068 71.068 69.914 1.154 18518
4772 1 8 . 1 1 12 12 THR H H 12 8.953 8.953 8.333 0.620 18518
4773 1 8 . 1 1 13 13 PHE N N 13 123.200 123.200 123.384 -0.184 18518
4774 1 8 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.180 -0.152 18518
4775 1 8 . 1 1 13 13 PHE C C 13 176.029 176.029 176.893 -0.864 18518
4776 1 8 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.487 0.377 18518
4777 1 8 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.175 0.385 18518
4778 1 8 . 1 1 13 13 PHE H H 13 9.284 9.284 8.933 0.351 18518
4779 1 8 . 1 1 14 14 GLU N N 14 115.414 115.414 117.505 -2.091 18518
4780 1 8 . 1 1 14 14 GLU HA H 14 3.794 3.794 4.030 -0.236 18518
4781 1 8 . 1 1 14 14 GLU C C 14 180.081 180.081 179.136 0.945 18518
4782 1 8 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.763 0.856 18518
4783 1 8 . 1 1 14 14 GLU CB C 14 28.852 28.852 29.068 -0.216 18518
4784 1 8 . 1 1 14 14 GLU H H 14 8.973 8.973 8.809 0.164 18518
4785 1 8 . 1 1 15 15 GLN N N 15 119.276 119.276 118.481 0.795 18518
4786 1 8 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.215 -0.215 18518
4787 1 8 . 1 1 15 15 GLN C C 15 177.978 177.978 178.494 -0.516 18518
4788 1 8 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.160 0.675 18518
4789 1 8 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.302 1.068 18518
4790 1 8 . 1 1 15 15 GLN H H 15 7.756 7.756 7.849 -0.094 18518
4791 1 8 . 1 1 16 16 ARG N N 16 121.336 121.336 121.331 0.005 18518
4792 1 8 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.157 0.113 18518
4793 1 8 . 1 1 16 16 ARG C C 16 177.416 177.416 178.755 -1.339 18518
4794 1 8 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.475 1.900 18518
4795 1 8 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.142 0.463 18518
4796 1 8 . 1 1 16 16 ARG H H 16 8.645 8.645 8.168 0.477 18518
4797 1 8 . 1 1 17 17 VAL N N 17 117.630 117.630 116.174 1.456 18518
4798 1 8 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.888 -0.031 18518
4799 1 8 . 1 1 17 17 VAL C C 17 179.748 179.748 177.507 2.241 18518
4800 1 8 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.531 0.195 18518
4801 1 8 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.510 0.684 18518
4802 1 8 . 1 1 17 17 VAL H H 17 8.373 8.373 8.402 -0.029 18518
4803 1 8 . 1 1 18 18 GLU N N 18 120.864 120.864 121.145 -0.281 18518
4804 1 8 . 1 1 18 18 GLU HA H 18 4.302 4.302 4.007 0.295 18518
4805 1 8 . 1 1 18 18 GLU C C 18 177.728 177.728 178.459 -0.731 18518
4806 1 8 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.652 -1.166 18518
4807 1 8 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.268 0.114 18518
4808 1 8 . 1 1 18 18 GLU H H 18 7.368 7.368 7.957 -0.589 18518
4809 1 8 . 1 1 19 19 ASP N N 19 121.425 121.425 120.282 1.143 18518
4810 1 8 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.460 -0.026 18518
4811 1 8 . 1 1 19 19 ASP C C 19 179.978 179.978 178.742 1.236 18518
4812 1 8 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.214 0.208 18518
4813 1 8 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.819 0.468 18518
4814 1 8 . 1 1 19 19 ASP H H 19 8.671 8.671 8.166 0.505 18518
4815 1 8 . 1 1 20 20 VAL N N 20 119.730 119.730 120.031 -0.301 18518
4816 1 8 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.410 -0.205 18518
4817 1 8 . 1 1 20 20 VAL C C 20 176.284 176.284 177.929 -1.645 18518
4818 1 8 . 1 1 20 20 VAL CA C 20 66.315 66.315 66.373 -0.058 18518
4819 1 8 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.249 -0.142 18518
4820 1 8 . 1 1 20 20 VAL H H 20 7.999 7.999 8.054 -0.055 18518
4821 1 8 . 1 1 21 21 ARG N N 21 121.455 121.455 119.918 1.537 18518
4822 1 8 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.953 -0.139 18518
4823 1 8 . 1 1 21 21 ARG C C 21 180.120 180.120 178.784 1.336 18518
4824 1 8 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.990 0.840 18518
4825 1 8 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.325 0.621 18518
4826 1 8 . 1 1 21 21 ARG H H 21 8.098 8.098 8.098 0.000 18518
4827 1 8 . 1 1 22 22 LEU N N 22 117.826 117.826 120.919 -3.093 18518
4828 1 8 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.010 0.039 18518
4829 1 8 . 1 1 22 22 LEU C C 22 180.115 180.115 178.241 1.874 18518
4830 1 8 . 1 1 22 22 LEU CA C 22 57.790 57.790 57.921 -0.131 18518
4831 1 8 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.778 0.364 18518
4832 1 8 . 1 1 22 22 LEU H H 22 8.207 8.207 8.117 0.090 18518
4833 1 8 . 1 1 23 23 ILE N N 23 121.450 121.450 119.760 1.690 18518
4834 1 8 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.594 0.419 18518
4835 1 8 . 1 1 23 23 ILE C C 23 178.149 178.149 177.566 0.583 18518
4836 1 8 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.325 -2.154 18518
4837 1 8 . 1 1 23 23 ILE CB C 23 38.106 38.106 37.600 0.506 18518
4838 1 8 . 1 1 23 23 ILE H H 23 8.105 8.105 7.897 0.208 18518
4839 1 8 . 1 1 24 24 ARG N N 24 121.139 121.139 118.368 2.771 18518
4840 1 8 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.160 -0.173 18518
4841 1 8 . 1 1 24 24 ARG C C 24 178.702 178.702 179.071 -0.369 18518
4842 1 8 . 1 1 24 24 ARG CA C 24 57.718 57.718 59.176 -1.458 18518
4843 1 8 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.618 -0.849 18518
4844 1 8 . 1 1 24 24 ARG H H 24 8.601 8.601 8.568 0.033 18518
4845 1 8 . 1 1 25 25 GLU N N 25 118.054 118.054 118.995 -0.941 18518
4846 1 8 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.159 -0.133 18518
4847 1 8 . 1 1 25 25 GLU C C 25 178.492 178.492 178.124 0.368 18518
4848 1 8 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.323 0.457 18518
4849 1 8 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.432 0.569 18518
4850 1 8 . 1 1 25 25 GLU H H 25 7.423 7.423 7.764 -0.341 18518
4851 1 8 . 1 1 26 26 GLN N N 26 116.350 116.350 117.517 -1.167 18518
4852 1 8 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.029 -0.093 18518
4853 1 8 . 1 1 26 26 GLN C C 26 176.305 176.305 177.090 -0.785 18518
4854 1 8 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.590 -0.088 18518
4855 1 8 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.159 1.048 18518
4856 1 8 . 1 1 26 26 GLN H H 26 7.524 7.524 7.641 -0.117 18518
4857 1 8 . 1 1 27 27 HIS N N 27 116.017 116.017 118.354 -2.337 18518
4858 1 8 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.043 -0.113 18518
4859 1 8 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.560 0.494 18518
4860 1 8 . 1 1 27 27 HIS CB C 27 30.747 30.747 29.646 1.101 18518
4861 1 8 . 1 1 27 27 HIS H H 27 8.284 8.284 8.199 0.085 18518
4862 1 8 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.612 -0.031 18518
4863 1 8 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.840 0.079 18518
4864 1 8 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.385 0.070 18518
4865 1 8 . 1 1 29 29 THR N N 29 107.011 107.011 106.175 0.836 18518
4866 1 8 . 1 1 29 29 THR HA H 29 4.599 4.599 4.420 0.178 18518
4867 1 8 . 1 1 29 29 THR C C 29 172.884 172.884 174.047 -1.163 18518
4868 1 8 . 1 1 29 29 THR CA C 29 60.810 60.810 61.200 -0.390 18518
4869 1 8 . 1 1 29 29 THR CB C 29 68.531 68.531 68.322 0.209 18518
4870 1 8 . 1 1 29 29 THR H H 29 7.890 7.890 8.088 -0.198 18518
4871 1 8 . 1 1 30 30 LYS N N 30 117.679 117.679 121.706 -4.027 18518
4872 1 8 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.861 -0.003 18518
4873 1 8 . 1 1 30 30 LYS C C 30 174.310 174.310 174.972 -0.662 18518
4874 1 8 . 1 1 30 30 LYS CA C 30 53.751 53.751 54.056 -0.305 18518
4875 1 8 . 1 1 30 30 LYS CB C 30 35.804 35.804 34.933 0.871 18518
4876 1 8 . 1 1 30 30 LYS H H 30 7.441 7.441 7.515 -0.074 18518
4877 1 8 . 1 1 31 31 ILE N N 31 122.849 122.849 123.502 -0.653 18518
4878 1 8 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.178 -0.073 18518
4879 1 8 . 1 1 31 31 ILE CA C 31 54.801 54.801 55.970 -1.169 18518
4880 1 8 . 1 1 31 31 ILE CB C 31 38.265 38.265 37.591 0.674 18518
4881 1 8 . 1 1 31 31 ILE H H 31 9.304 9.304 8.957 0.347 18518
4882 1 8 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.757 0.402 18518
4883 1 8 . 1 1 32 32 PRO C C 32 174.164 174.164 175.927 -1.763 18518
4884 1 8 . 1 1 32 32 PRO CA C 32 61.503 61.503 61.976 -0.473 18518
4885 1 8 . 1 1 32 32 PRO CB C 32 31.145 31.145 30.457 0.688 18518
4886 1 8 . 1 1 33 33 VAL N N 33 125.606 125.606 120.708 4.898 18518
4887 1 8 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.174 0.039 18518
4888 1 8 . 1 1 33 33 VAL C C 33 173.654 173.654 174.044 -0.390 18518
4889 1 8 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.063 0.981 18518
4890 1 8 . 1 1 33 33 VAL CB C 33 35.604 35.604 35.665 -0.061 18518
4891 1 8 . 1 1 33 33 VAL H H 33 9.424 9.424 8.599 0.825 18518
4892 1 8 . 1 1 34 34 ILE N N 34 128.241 128.241 123.398 4.843 18518
4893 1 8 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.841 -0.008 18518
4894 1 8 . 1 1 34 34 ILE C C 34 175.605 175.605 175.188 0.417 18518
4895 1 8 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.558 -1.793 18518
4896 1 8 . 1 1 34 34 ILE CB C 34 36.799 36.799 39.284 -2.485 18518
4897 1 8 . 1 1 34 34 ILE H H 34 8.721 8.721 9.092 -0.371 18518
4898 1 8 . 1 1 35 35 ILE N N 35 125.650 125.650 127.675 -2.025 18518
4899 1 8 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.906 -0.070 18518
4900 1 8 . 1 1 35 35 ILE C C 35 174.887 174.887 174.305 0.582 18518
4901 1 8 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.318 0.627 18518
4902 1 8 . 1 1 35 35 ILE CB C 35 39.210 39.210 39.930 -0.720 18518
4903 1 8 . 1 1 35 35 ILE H H 35 9.034 9.034 9.170 -0.136 18518
4904 1 8 . 1 1 36 36 GLU N N 36 122.657 122.657 126.920 -4.263 18518
4905 1 8 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.934 -0.073 18518
4906 1 8 . 1 1 36 36 GLU C C 36 173.848 173.848 174.788 -0.940 18518
4907 1 8 . 1 1 36 36 GLU CA C 36 53.932 53.932 53.934 -0.002 18518
4908 1 8 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.609 0.673 18518
4909 1 8 . 1 1 36 36 GLU H H 36 8.303 8.303 8.502 -0.199 18518
4910 1 8 . 1 1 37 37 ARG N N 37 123.228 123.228 127.041 -3.813 18518
4911 1 8 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.791 -1.065 18518
4912 1 8 . 1 1 37 37 ARG C C 37 176.359 176.359 175.943 0.416 18518
4913 1 8 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.122 0.237 18518
4914 1 8 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.889 0.452 18518
4915 1 8 . 1 1 37 37 ARG H H 37 8.856 8.856 8.752 0.104 18518
4916 1 8 . 1 1 38 38 TYR N N 38 128.981 128.981 127.630 1.351 18518
4917 1 8 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.259 0.093 18518
4918 1 8 . 1 1 38 38 TYR C C 38 177.316 177.316 176.702 0.614 18518
4919 1 8 . 1 1 38 38 TYR CA C 38 57.712 57.712 57.996 -0.284 18518
4920 1 8 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.026 -0.554 18518
4921 1 8 . 1 1 38 38 TYR H H 38 8.628 8.628 8.421 0.207 18518
4922 1 8 . 1 1 39 39 LYS N N 39 130.635 130.635 126.364 4.271 18518
4923 1 8 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.891 -0.069 18518
4924 1 8 . 1 1 39 39 LYS CA C 39 58.887 58.887 58.520 0.367 18518
4925 1 8 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.918 -0.147 18518
4926 1 8 . 1 1 39 39 LYS H H 39 8.594 8.594 8.326 0.268 18518
4927 1 8 . 1 1 40 40 GLY C C 40 173.447 173.447 173.798 -0.351 18518
4928 1 8 . 1 1 40 40 GLY CA C 40 44.663 44.663 44.170 0.493 18518
4929 1 8 . 1 1 40 40 GLY H H 40 5.188 5.188 6.885 -1.697 18518
4930 1 8 . 1 1 41 41 GLU N N 41 122.836 122.836 120.933 1.903 18518
4931 1 8 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.279 -0.022 18518
4932 1 8 . 1 1 41 41 GLU C C 41 176.524 176.524 176.114 0.410 18518
4933 1 8 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.801 -0.276 18518
4934 1 8 . 1 1 41 41 GLU CB C 41 30.985 30.985 29.877 1.108 18518
4935 1 8 . 1 1 41 41 GLU H H 41 7.380 7.380 7.494 -0.114 18518
4936 1 8 . 1 1 42 42 LYS N N 42 124.040 124.040 125.294 -1.254 18518
4937 1 8 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.460 0.215 18518
4938 1 8 . 1 1 42 42 LYS C C 42 177.538 177.538 176.825 0.713 18518
4939 1 8 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.665 -0.825 18518
4940 1 8 . 1 1 42 42 LYS CB C 42 34.979 34.979 32.937 2.042 18518
4941 1 8 . 1 1 42 42 LYS H H 42 9.034 9.034 8.392 0.642 18518
4942 1 8 . 1 1 43 43 GLN N N 43 119.259 119.259 119.395 -0.136 18518
4943 1 8 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.404 0.138 18518
4944 1 8 . 1 1 43 43 GLN C C 43 177.336 177.336 176.228 1.108 18518
4945 1 8 . 1 1 43 43 GLN CA C 43 57.673 57.673 57.275 0.398 18518
4946 1 8 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.146 0.636 18518
4947 1 8 . 1 1 43 43 GLN H H 43 8.435 8.435 8.810 -0.375 18518
4948 1 8 . 1 1 44 44 LEU N N 44 120.760 120.760 122.956 -2.196 18518
4949 1 8 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.727 -0.032 18518
4950 1 8 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.631 0.614 18518
4951 1 8 . 1 1 44 44 LEU CB C 44 43.596 43.596 42.017 1.579 18518
4952 1 8 . 1 1 44 44 LEU H H 44 9.126 9.126 8.373 0.753 18518
4953 1 8 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.527 0.190 18518
4954 1 8 . 1 1 45 45 PRO C C 45 175.797 175.797 176.185 -0.388 18518
4955 1 8 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.261 -0.150 18518
4956 1 8 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.415 0.177 18518
4957 1 8 . 1 1 46 46 VAL N N 46 119.052 119.052 119.997 -0.945 18518
4958 1 8 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.762 -0.895 18518
4959 1 8 . 1 1 46 46 VAL C C 46 175.640 175.640 176.074 -0.434 18518
4960 1 8 . 1 1 46 46 VAL CA C 46 62.944 62.944 60.702 2.242 18518
4961 1 8 . 1 1 46 46 VAL CB C 46 32.799 32.799 33.813 -1.014 18518
4962 1 8 . 1 1 46 46 VAL H H 46 8.543 8.543 8.107 0.436 18518
4963 1 8 . 1 1 47 47 LEU N N 47 130.203 130.203 125.470 4.733 18518
4964 1 8 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.592 -0.283 18518
4965 1 8 . 1 1 47 47 LEU C C 47 176.198 176.198 177.621 -1.423 18518
4966 1 8 . 1 1 47 47 LEU CA C 47 55.006 55.006 54.952 0.054 18518
4967 1 8 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.200 1.632 18518
4968 1 8 . 1 1 47 47 LEU H H 47 7.799 7.799 8.494 -0.695 18518
4969 1 8 . 1 1 48 48 ASP N N 48 122.403 122.403 121.506 0.897 18518
4970 1 8 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.499 -0.236 18518
4971 1 8 . 1 1 48 48 ASP C C 48 175.294 175.294 176.194 -0.900 18518
4972 1 8 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.628 0.204 18518
4973 1 8 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.615 -1.431 18518
4974 1 8 . 1 1 48 48 ASP H H 48 8.780 8.780 8.703 0.077 18518
4975 1 8 . 1 1 49 49 LYS N N 49 119.569 119.569 116.779 2.790 18518
4976 1 8 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.516 0.069 18518
4977 1 8 . 1 1 49 49 LYS C C 49 174.678 174.678 175.778 -1.100 18518
4978 1 8 . 1 1 49 49 LYS CA C 49 53.652 53.652 54.978 -1.327 18518
4979 1 8 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.324 1.621 18518
4980 1 8 . 1 1 49 49 LYS H H 49 7.280 7.280 7.502 -0.222 18518
4981 1 8 . 1 1 50 50 THR N N 50 110.862 110.862 113.942 -3.080 18518
4982 1 8 . 1 1 50 50 THR HA H 50 4.811 4.811 4.731 0.080 18518
4983 1 8 . 1 1 50 50 THR C C 50 172.425 172.425 173.935 -1.510 18518
4984 1 8 . 1 1 50 50 THR CA C 50 62.645 62.645 62.291 0.354 18518
4985 1 8 . 1 1 50 50 THR CB C 50 71.648 71.648 70.274 1.374 18518
4986 1 8 . 1 1 50 50 THR H H 50 8.042 8.042 8.137 -0.095 18518
4987 1 8 . 1 1 51 51 LYS N N 51 120.008 120.008 121.892 -1.884 18518
4988 1 8 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.787 -0.162 18518
4989 1 8 . 1 1 51 51 LYS C C 51 175.082 175.082 175.640 -0.558 18518
4990 1 8 . 1 1 51 51 LYS CA C 51 54.704 54.704 55.545 -0.841 18518
4991 1 8 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.944 -1.568 18518
4992 1 8 . 1 1 51 51 LYS H H 51 7.119 7.119 7.445 -0.326 18518
4993 1 8 . 1 1 52 52 PHE N N 52 122.640 122.640 121.890 0.750 18518
4994 1 8 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.700 0.637 18518
4995 1 8 . 1 1 52 52 PHE C C 52 174.213 174.213 173.946 0.267 18518
4996 1 8 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.812 -0.201 18518
4997 1 8 . 1 1 52 52 PHE CB C 52 43.140 43.140 42.929 0.210 18518
4998 1 8 . 1 1 52 52 PHE H H 52 9.709 9.709 9.158 0.551 18518
4999 1 8 . 1 1 53 53 LEU N N 53 122.157 122.157 123.669 -1.512 18518
5000 1 8 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.941 0.006 18518
5001 1 8 . 1 1 53 53 LEU C C 53 175.769 175.769 175.545 0.224 18518
5002 1 8 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.694 -0.737 18518
5003 1 8 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.815 0.600 18518
5004 1 8 . 1 1 53 53 LEU H H 53 8.959 8.959 8.427 0.532 18518
5005 1 8 . 1 1 54 54 VAL N N 54 124.919 124.919 120.983 3.936 18518
5006 1 8 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.758 -0.199 18518
5007 1 8 . 1 1 54 54 VAL CA C 54 59.130 59.130 57.487 1.643 18518
5008 1 8 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.864 1.105 18518
5009 1 8 . 1 1 54 54 VAL H H 54 8.922 8.922 8.528 0.394 18518
5010 1 8 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.691 -0.250 18518
5011 1 8 . 1 1 55 55 PRO C C 55 176.594 176.594 177.964 -1.370 18518
5012 1 8 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.383 1.932 18518
5013 1 8 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.243 0.422 18518
5014 1 8 . 1 1 56 56 ASP N N 56 120.522 120.522 121.241 -0.719 18518
5015 1 8 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.268 -0.406 18518
5016 1 8 . 1 1 56 56 ASP C C 56 175.809 175.809 176.484 -0.675 18518
5017 1 8 . 1 1 56 56 ASP CA C 56 56.749 56.749 56.433 0.316 18518
5018 1 8 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.302 0.208 18518
5019 1 8 . 1 1 56 56 ASP H H 56 8.347 8.347 8.742 -0.395 18518
5020 1 8 . 1 1 57 57 HIS N N 57 113.482 113.482 112.746 0.736 18518
5021 1 8 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.727 -0.007 18518
5022 1 8 . 1 1 57 57 HIS C C 57 176.507 176.507 175.257 1.250 18518
5023 1 8 . 1 1 57 57 HIS CA C 57 55.589 55.589 55.404 0.185 18518
5024 1 8 . 1 1 57 57 HIS CB C 57 30.643 30.643 30.129 0.514 18518
5025 1 8 . 1 1 57 57 HIS H H 57 7.557 7.557 7.755 -0.198 18518
5026 1 8 . 1 1 58 58 VAL N N 58 123.279 123.279 117.255 6.024 18518
5027 1 8 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.399 -0.563 18518
5028 1 8 . 1 1 58 58 VAL C C 58 175.019 175.019 174.862 0.157 18518
5029 1 8 . 1 1 58 58 VAL CA C 58 62.823 62.823 61.247 1.576 18518
5030 1 8 . 1 1 58 58 VAL CB C 58 32.310 32.310 33.279 -0.969 18518
5031 1 8 . 1 1 58 58 VAL H H 58 7.345 7.345 7.236 0.109 18518
5032 1 8 . 1 1 59 59 ASN N N 59 123.781 123.781 118.728 5.053 18518
5033 1 8 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.476 -0.350 18518
5034 1 8 . 1 1 59 59 ASN C C 59 176.558 176.558 176.976 -0.418 18518
5035 1 8 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.383 0.102 18518
5036 1 8 . 1 1 59 59 ASN CB C 59 40.107 40.107 41.272 -1.165 18518
5037 1 8 . 1 1 59 59 ASN H H 59 8.735 8.735 8.811 -0.076 18518
5038 1 8 . 1 1 60 60 MET N N 60 117.453 117.453 117.798 -0.345 18518
5039 1 8 . 1 1 60 60 MET HA H 60 4.395 4.395 4.094 0.301 18518
5040 1 8 . 1 1 60 60 MET C C 60 178.144 178.144 178.112 0.032 18518
5041 1 8 . 1 1 60 60 MET CA C 60 57.097 57.097 59.976 -2.879 18518
5042 1 8 . 1 1 60 60 MET CB C 60 30.140 30.140 32.187 -2.047 18518
5043 1 8 . 1 1 60 60 MET H H 60 8.227 8.227 8.344 -0.117 18518
5044 1 8 . 1 1 61 61 SER N N 61 114.216 114.216 115.226 -1.010 18518
5045 1 8 . 1 1 61 61 SER HA H 61 4.111 4.111 4.099 0.012 18518
5046 1 8 . 1 1 61 61 SER C C 61 177.335 177.335 176.407 0.928 18518
5047 1 8 . 1 1 61 61 SER CA C 61 61.590 61.590 62.720 -1.130 18518
5048 1 8 . 1 1 61 61 SER CB C 61 62.402 62.402 62.781 -0.379 18518
5049 1 8 . 1 1 61 61 SER H H 61 8.464 8.464 8.613 -0.149 18518
5050 1 8 . 1 1 62 62 GLU N N 62 123.004 123.004 121.639 1.365 18518
5051 1 8 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.120 -0.073 18518
5052 1 8 . 1 1 62 62 GLU C C 62 178.686 178.686 178.591 0.095 18518
5053 1 8 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.878 -0.253 18518
5054 1 8 . 1 1 62 62 GLU CB C 62 29.654 29.654 28.994 0.659 18518
5055 1 8 . 1 1 62 62 GLU H H 62 7.994 7.994 7.708 0.286 18518
5056 1 8 . 1 1 63 63 LEU N N 63 120.818 120.818 122.491 -1.673 18518
5057 1 8 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.957 0.008 18518
5058 1 8 . 1 1 63 63 LEU C C 63 178.046 178.046 178.722 -0.676 18518
5059 1 8 . 1 1 63 63 LEU CA C 63 57.920 57.920 58.027 -0.107 18518
5060 1 8 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.520 0.104 18518
5061 1 8 . 1 1 63 63 LEU H H 63 8.130 8.130 7.907 0.223 18518
5062 1 8 . 1 1 64 64 ILE N N 64 118.528 118.528 119.466 -0.938 18518
5063 1 8 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.530 -0.161 18518
5064 1 8 . 1 1 64 64 ILE C C 64 177.127 177.127 177.687 -0.560 18518
5065 1 8 . 1 1 64 64 ILE CA C 64 66.678 66.678 65.907 0.770 18518
5066 1 8 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.656 0.788 18518
5067 1 8 . 1 1 64 64 ILE H H 64 8.488 8.488 8.490 -0.002 18518
5068 1 8 . 1 1 65 65 LYS N N 65 118.336 118.336 120.820 -2.484 18518
5069 1 8 . 1 1 65 65 LYS HA H 65 3.701 3.701 3.951 -0.250 18518
5070 1 8 . 1 1 65 65 LYS C C 65 179.291 179.291 179.018 0.273 18518
5071 1 8 . 1 1 65 65 LYS CA C 65 60.440 60.440 60.094 0.346 18518
5072 1 8 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.366 0.005 18518
5073 1 8 . 1 1 65 65 LYS H H 65 7.347 7.347 7.912 -0.565 18518
5074 1 8 . 1 1 66 66 ILE N N 66 120.171 120.171 120.090 0.081 18518
5075 1 8 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.614 -0.036 18518
5076 1 8 . 1 1 66 66 ILE C C 66 178.873 178.873 178.235 0.638 18518
5077 1 8 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.344 -0.183 18518
5078 1 8 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.861 0.772 18518
5079 1 8 . 1 1 66 66 ILE H H 66 7.901 7.901 8.359 -0.458 18518
5080 1 8 . 1 1 67 67 ILE N N 67 121.185 121.185 120.239 0.946 18518
5081 1 8 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.534 -0.088 18518
5082 1 8 . 1 1 67 67 ILE C C 67 177.150 177.150 177.838 -0.688 18518
5083 1 8 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.052 -1.246 18518
5084 1 8 . 1 1 67 67 ILE CB C 67 34.995 34.995 36.977 -1.982 18518
5085 1 8 . 1 1 67 67 ILE H H 67 8.290 8.290 8.183 0.107 18518
5086 1 8 . 1 1 68 68 ARG N N 68 119.173 119.173 119.063 0.110 18518
5087 1 8 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.708 -0.777 18518
5088 1 8 . 1 1 68 68 ARG C C 68 178.496 178.496 178.685 -0.189 18518
5089 1 8 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.859 0.777 18518
5090 1 8 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.781 0.659 18518
5091 1 8 . 1 1 68 68 ARG H H 68 8.438 8.438 8.434 0.004 18518
5092 1 8 . 1 1 69 69 ARG N N 69 116.511 116.511 119.635 -3.124 18518
5093 1 8 . 1 1 69 69 ARG HA H 69 4.134 4.134 3.965 0.169 18518
5094 1 8 . 1 1 69 69 ARG C C 69 180.262 180.262 179.104 1.158 18518
5095 1 8 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.749 -1.042 18518
5096 1 8 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.266 -0.313 18518
5097 1 8 . 1 1 69 69 ARG H H 69 7.497 7.497 8.552 -1.055 18518
5098 1 8 . 1 1 70 70 ARG N N 70 123.297 123.297 119.661 3.636 18518
5099 1 8 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.128 -0.112 18518
5100 1 8 . 1 1 70 70 ARG C C 70 178.700 178.700 178.222 0.478 18518
5101 1 8 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.588 0.872 18518
5102 1 8 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.725 0.587 18518
5103 1 8 . 1 1 70 70 ARG H H 70 8.075 8.075 7.947 0.128 18518
5104 1 8 . 1 1 71 71 LEU N N 71 116.829 116.829 119.080 -2.251 18518
5105 1 8 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.284 -0.219 18518
5106 1 8 . 1 1 71 71 LEU C C 71 174.956 174.956 175.840 -0.884 18518
5107 1 8 . 1 1 71 71 LEU CA C 71 55.126 55.126 54.670 0.456 18518
5108 1 8 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.256 0.990 18518
5109 1 8 . 1 1 71 71 LEU H H 71 7.719 7.719 8.148 -0.429 18518
5110 1 8 . 1 1 72 72 GLN N N 72 114.991 114.991 114.817 0.174 18518
5111 1 8 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.900 -0.064 18518
5112 1 8 . 1 1 72 72 GLN C C 72 175.683 175.683 175.262 0.421 18518
5113 1 8 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.356 -0.031 18518
5114 1 8 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.710 0.294 18518
5115 1 8 . 1 1 72 72 GLN H H 72 7.744 7.744 7.429 0.315 18518
5116 1 8 . 1 1 73 73 LEU N N 73 115.045 115.045 119.503 -4.458 18518
5117 1 8 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.074 0.162 18518
5118 1 8 . 1 1 73 73 LEU C C 73 178.762 178.762 176.990 1.772 18518
5119 1 8 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.199 -0.813 18518
5120 1 8 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.758 0.333 18518
5121 1 8 . 1 1 73 73 LEU H H 73 7.500 7.500 7.830 -0.330 18518
5122 1 8 . 1 1 74 74 ASN N N 74 121.700 121.700 123.081 -1.381 18518
5123 1 8 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.515 0.175 18518
5124 1 8 . 1 1 74 74 ASN C C 74 176.617 176.617 176.214 0.403 18518
5125 1 8 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.898 -1.213 18518
5126 1 8 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.553 0.045 18518
5127 1 8 . 1 1 74 74 ASN H H 74 9.045 9.045 8.658 0.387 18518
5128 1 8 . 1 1 75 75 ALA N N 75 123.952 123.952 124.012 -0.060 18518
5129 1 8 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.261 -0.297 18518
5130 1 8 . 1 1 75 75 ALA C C 75 178.131 178.131 177.984 0.147 18518
5131 1 8 . 1 1 75 75 ALA CA C 75 54.868 54.868 54.029 0.840 18518
5132 1 8 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.122 -0.404 18518
5133 1 8 . 1 1 75 75 ALA H H 75 8.784 8.784 8.501 0.283 18518
5134 1 8 . 1 1 76 76 ASN N N 76 112.295 112.295 115.185 -2.890 18518
5135 1 8 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.643 -0.062 18518
5136 1 8 . 1 1 76 76 ASN C C 76 175.448 175.448 175.080 0.368 18518
5137 1 8 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.660 -0.446 18518
5138 1 8 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.578 -0.258 18518
5139 1 8 . 1 1 76 76 ASN H H 76 8.391 8.391 8.488 -0.097 18518
5140 1 8 . 1 1 77 77 GLN N N 77 120.577 120.577 118.294 2.283 18518
5141 1 8 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.614 -0.341 18518
5142 1 8 . 1 1 77 77 GLN C C 77 175.045 175.045 173.865 1.180 18518
5143 1 8 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.903 0.902 18518
5144 1 8 . 1 1 77 77 GLN CB C 77 30.157 30.157 31.162 -1.005 18518
5145 1 8 . 1 1 77 77 GLN H H 77 7.552 7.552 7.594 -0.042 18518
5146 1 8 . 1 1 78 78 ALA N N 78 130.670 130.670 124.002 6.668 18518
5147 1 8 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.473 -0.302 18518
5148 1 8 . 1 1 78 78 ALA C C 78 176.512 176.512 176.175 0.337 18518
5149 1 8 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.399 1.443 18518
5150 1 8 . 1 1 78 78 ALA CB C 78 20.060 20.060 20.590 -0.530 18518
5151 1 8 . 1 1 78 78 ALA H H 78 8.799 8.799 8.292 0.507 18518
5152 1 8 . 1 1 79 79 PHE N N 79 119.325 119.325 115.389 3.936 18518
5153 1 8 . 1 1 79 79 PHE HA H 79 4.434 4.434 4.635 -0.201 18518
5154 1 8 . 1 1 79 79 PHE C C 79 171.726 171.726 172.876 -1.150 18518
5155 1 8 . 1 1 79 79 PHE CA C 79 59.145 59.145 56.392 2.753 18518
5156 1 8 . 1 1 79 79 PHE CB C 79 42.171 42.171 40.808 1.363 18518
5157 1 8 . 1 1 79 79 PHE H H 79 7.664 7.664 7.925 -0.261 18518
5158 1 8 . 1 1 80 80 PHE N N 80 126.314 126.314 117.231 9.083 18518
5159 1 8 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.671 -0.279 18518
5160 1 8 . 1 1 80 80 PHE C C 80 177.169 177.169 173.316 3.853 18518
5161 1 8 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.392 0.261 18518
5162 1 8 . 1 1 80 80 PHE CB C 80 41.933 41.933 42.933 -1.000 18518
5163 1 8 . 1 1 80 80 PHE H H 80 8.508 8.508 9.063 -0.555 18518
5164 1 8 . 1 1 81 81 LEU N N 81 121.426 121.426 121.327 0.099 18518
5165 1 8 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.245 -0.394 18518
5166 1 8 . 1 1 81 81 LEU C C 81 174.488 174.488 175.074 -0.586 18518
5167 1 8 . 1 1 81 81 LEU CA C 81 53.197 53.197 53.796 -0.599 18518
5168 1 8 . 1 1 81 81 LEU CB C 81 45.100 45.100 45.157 -0.057 18518
5169 1 8 . 1 1 81 81 LEU H H 81 8.229 8.229 8.679 -0.450 18518
5170 1 8 . 1 1 82 82 LEU N N 82 125.155 125.155 127.591 -2.436 18518
5171 1 8 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.615 0.218 18518
5172 1 8 . 1 1 82 82 LEU C C 82 177.166 177.166 175.305 1.861 18518
5173 1 8 . 1 1 82 82 LEU CA C 82 54.197 54.197 54.141 0.056 18518
5174 1 8 . 1 1 82 82 LEU CB C 82 43.442 43.442 43.719 -0.277 18518
5175 1 8 . 1 1 82 82 LEU H H 82 9.400 9.400 9.264 0.136 18518
5176 1 8 . 1 1 83 83 VAL N N 83 123.886 123.886 123.358 0.528 18518
5177 1 8 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.286 0.093 18518
5178 1 8 . 1 1 83 83 VAL C C 83 175.810 175.810 176.894 -1.084 18518
5179 1 8 . 1 1 83 83 VAL CA C 83 61.677 61.677 62.375 -0.698 18518
5180 1 8 . 1 1 83 83 VAL CB C 83 33.758 33.758 31.305 2.453 18518
5181 1 8 . 1 1 83 83 VAL H H 83 8.721 8.721 8.644 0.077 18518
5182 1 8 . 1 1 84 84 ASN N N 84 126.474 126.474 126.645 -0.171 18518
5183 1 8 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.544 -0.148 18518
5184 1 8 . 1 1 84 84 ASN C C 84 175.164 175.164 174.972 0.192 18518
5185 1 8 . 1 1 84 84 ASN CA C 84 54.738 54.738 55.275 -0.537 18518
5186 1 8 . 1 1 84 84 ASN CB C 84 37.950 37.950 38.185 -0.235 18518
5187 1 8 . 1 1 84 84 ASN H H 84 9.707 9.707 9.720 -0.013 18518
5188 1 8 . 1 1 85 85 GLY N N 85 101.296 101.296 104.989 -3.693 18518
5189 1 8 . 1 1 85 85 GLY C C 85 173.680 173.680 173.216 0.464 18518
5190 1 8 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.726 0.877 18518
5191 1 8 . 1 1 85 85 GLY H H 85 8.644 8.644 8.229 0.415 18518
5192 1 8 . 1 1 86 86 HIS N N 86 117.238 117.238 119.367 -2.129 18518
5193 1 8 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.815 0.202 18518
5194 1 8 . 1 1 86 86 HIS C C 86 173.841 173.841 173.863 -0.022 18518
5195 1 8 . 1 1 86 86 HIS CA C 86 53.796 53.796 54.524 -0.728 18518
5196 1 8 . 1 1 86 86 HIS CB C 86 31.280 31.280 31.945 -0.665 18518
5197 1 8 . 1 1 86 86 HIS H H 86 7.918 7.918 8.320 -0.402 18518
5198 1 8 . 1 1 87 87 SER N N 87 118.179 118.179 120.163 -1.984 18518
5199 1 8 . 1 1 87 87 SER HA H 87 4.699 4.699 4.598 0.101 18518
5200 1 8 . 1 1 87 87 SER C C 87 175.904 175.904 174.514 1.390 18518
5201 1 8 . 1 1 87 87 SER CA C 87 58.271 58.271 58.149 0.122 18518
5202 1 8 . 1 1 87 87 SER CB C 87 63.735 63.735 62.079 1.656 18518
5203 1 8 . 1 1 87 87 SER H H 87 8.977 8.977 8.867 0.110 18518
5204 1 8 . 1 1 88 88 MET N N 88 125.472 125.472 122.512 2.960 18518
5205 1 8 . 1 1 88 88 MET HA H 88 4.830 4.830 4.657 0.173 18518
5206 1 8 . 1 1 88 88 MET C C 88 176.419 176.419 175.087 1.332 18518
5207 1 8 . 1 1 88 88 MET CA C 88 54.899 54.899 55.413 -0.513 18518
5208 1 8 . 1 1 88 88 MET CB C 88 33.336 33.336 33.457 -0.121 18518
5209 1 8 . 1 1 88 88 MET H H 88 9.184 9.184 8.188 0.996 18518
5210 1 8 . 1 1 89 89 VAL N N 89 120.747 120.747 120.760 -0.013 18518
5211 1 8 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.372 -0.140 18518
5212 1 8 . 1 1 89 89 VAL C C 89 175.958 175.958 175.659 0.299 18518
5213 1 8 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.346 1.808 18518
5214 1 8 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.321 -1.443 18518
5215 1 8 . 1 1 89 89 VAL H H 89 8.233 8.233 7.550 0.683 18518
5216 1 8 . 1 1 90 90 SER N N 90 117.362 117.362 121.265 -3.903 18518
5217 1 8 . 1 1 90 90 SER HA H 90 4.590 4.590 4.409 0.181 18518
5218 1 8 . 1 1 90 90 SER C C 90 175.741 175.741 174.880 0.861 18518
5219 1 8 . 1 1 90 90 SER CA C 90 57.717 57.717 58.895 -1.178 18518
5220 1 8 . 1 1 90 90 SER CB C 90 63.223 63.223 63.833 -0.610 18518
5221 1 8 . 1 1 90 90 SER H H 90 8.482 8.482 8.499 -0.017 18518
5222 1 8 . 1 1 91 91 VAL N N 91 120.466 120.466 121.021 -0.555 18518
5223 1 8 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.975 0.072 18518
5224 1 8 . 1 1 91 91 VAL C C 91 176.329 176.329 176.545 -0.216 18518
5225 1 8 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.187 -0.695 18518
5226 1 8 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.817 0.751 18518
5227 1 8 . 1 1 91 91 VAL H H 91 8.188 8.188 8.292 -0.104 18518
5228 1 8 . 1 1 92 92 SER N N 92 116.398 116.398 112.787 3.611 18518
5229 1 8 . 1 1 92 92 SER HA H 92 4.636 4.636 4.842 -0.206 18518
5230 1 8 . 1 1 92 92 SER C C 92 174.159 174.159 174.263 -0.104 18518
5231 1 8 . 1 1 92 92 SER CA C 92 57.805 57.805 57.922 -0.117 18518
5232 1 8 . 1 1 92 92 SER CB C 92 63.046 63.046 63.639 -0.593 18518
5233 1 8 . 1 1 92 92 SER H H 92 8.370 8.370 7.904 0.466 18518
5234 1 8 . 1 1 93 93 THR N N 93 119.211 119.211 120.153 -0.942 18518
5235 1 8 . 1 1 93 93 THR HA H 93 4.484 4.484 4.278 0.206 18518
5236 1 8 . 1 1 93 93 THR CA C 93 60.884 60.884 63.128 -2.244 18518
5237 1 8 . 1 1 93 93 THR CB C 93 70.609 70.609 68.952 1.657 18518
5238 1 8 . 1 1 93 93 THR H H 93 7.416 7.416 7.544 -0.128 18518
5239 1 8 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.609 -0.169 18518
5240 1 8 . 1 1 94 94 PRO C C 94 178.775 178.775 177.358 1.417 18518
5241 1 8 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.443 0.500 18518
5242 1 8 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.438 0.211 18518
5243 1 8 . 1 1 95 95 ILE N N 95 124.174 124.174 124.235 -0.061 18518
5244 1 8 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.848 0.101 18518
5245 1 8 . 1 1 95 95 ILE C C 95 176.498 176.498 177.147 -0.649 18518
5246 1 8 . 1 1 95 95 ILE CA C 95 63.904 63.904 62.197 1.707 18518
5247 1 8 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.164 0.018 18518
5248 1 8 . 1 1 95 95 ILE H H 95 9.305 9.305 8.652 0.653 18518
5249 1 8 . 1 1 96 96 SER N N 96 116.920 116.920 115.830 1.090 18518
5250 1 8 . 1 1 96 96 SER HA H 96 4.029 4.029 4.215 -0.186 18518
5251 1 8 . 1 1 96 96 SER C C 96 176.574 176.574 176.211 0.363 18518
5252 1 8 . 1 1 96 96 SER CA C 96 61.356 61.356 62.215 -0.859 18518
5253 1 8 . 1 1 96 96 SER CB C 96 61.723 61.723 62.985 -1.262 18518
5254 1 8 . 1 1 96 96 SER H H 96 8.335 8.335 8.409 -0.074 18518
5255 1 8 . 1 1 97 97 GLU N N 97 123.255 123.255 122.052 1.203 18518
5256 1 8 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.215 0.063 18518
5257 1 8 . 1 1 97 97 GLU C C 97 179.716 179.716 178.932 0.784 18518
5258 1 8 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.992 -0.200 18518
5259 1 8 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.095 0.467 18518
5260 1 8 . 1 1 97 97 GLU H H 97 7.376 7.376 7.760 -0.384 18518
5261 1 8 . 1 1 98 98 VAL N N 98 121.137 121.137 120.852 0.285 18518
5262 1 8 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.629 0.173 18518
5263 1 8 . 1 1 98 98 VAL C C 98 177.637 177.637 178.045 -0.408 18518
5264 1 8 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.701 -0.877 18518
5265 1 8 . 1 1 98 98 VAL CB C 98 32.154 32.154 31.696 0.458 18518
5266 1 8 . 1 1 98 98 VAL H H 98 7.387 7.387 7.776 -0.389 18518
5267 1 8 . 1 1 99 99 TYR N N 99 118.927 118.927 121.237 -2.310 18518
5268 1 8 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.052 -0.062 18518
5269 1 8 . 1 1 99 99 TYR C C 99 176.081 176.081 177.047 -0.966 18518
5270 1 8 . 1 1 99 99 TYR CA C 99 62.223 62.223 61.025 1.198 18518
5271 1 8 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.413 0.570 18518
5272 1 8 . 1 1 99 99 TYR H H 99 9.048 9.048 8.360 0.688 18518
5273 1 8 . 1 1 100 100 GLU N N 100 113.894 113.894 116.828 -2.934 18518
5274 1 8 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.739 0.107 18518
5275 1 8 . 1 1 100 100 GLU C C 100 177.989 177.989 178.575 -0.586 18518
5276 1 8 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.632 0.455 18518
5277 1 8 . 1 1 100 100 GLU CB C 100 29.382 29.382 29.025 0.357 18518
5278 1 8 . 1 1 100 100 GLU H H 100 7.422 7.422 8.100 -0.678 18518
5279 1 8 . 1 1 101 101 SER N N 101 108.991 108.991 113.300 -4.309 18518
5280 1 8 . 1 1 101 101 SER HA H 101 4.524 4.524 4.437 0.087 18518
5281 1 8 . 1 1 101 101 SER C C 101 176.628 176.628 175.558 1.070 18518
5282 1 8 . 1 1 101 101 SER CA C 101 60.349 60.349 59.885 0.464 18518
5283 1 8 . 1 1 101 101 SER CB C 101 64.741 64.741 63.781 0.960 18518
5284 1 8 . 1 1 101 101 SER H H 101 7.424 7.424 7.780 -0.356 18518
5285 1 8 . 1 1 102 102 GLU N N 102 116.533 116.533 119.351 -2.818 18518
5286 1 8 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.601 0.143 18518
5287 1 8 . 1 1 102 102 GLU C C 102 176.774 176.774 175.567 1.207 18518
5288 1 8 . 1 1 102 102 GLU CA C 102 55.581 55.581 56.007 -0.426 18518
5289 1 8 . 1 1 102 102 GLU CB C 102 30.697 30.697 31.056 -0.359 18518
5290 1 8 . 1 1 102 102 GLU H H 102 8.487 8.487 8.094 0.393 18518
5291 1 8 . 1 1 103 103 LYS N N 103 118.370 118.370 119.572 -1.202 18518
5292 1 8 . 1 1 103 103 LYS HA H 103 4.178 4.178 4.015 0.163 18518
5293 1 8 . 1 1 103 103 LYS C C 103 175.018 175.018 176.658 -1.640 18518
5294 1 8 . 1 1 103 103 LYS CA C 103 57.329 57.329 56.923 0.406 18518
5295 1 8 . 1 1 103 103 LYS CB C 103 32.186 32.186 32.039 0.147 18518
5296 1 8 . 1 1 103 103 LYS H H 103 7.831 7.831 7.655 0.176 18518
5297 1 8 . 1 1 104 104 ASP N N 104 123.500 123.500 123.711 -0.211 18518
5298 1 8 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.808 -0.053 18518
5299 1 8 . 1 1 104 104 ASP C C 104 177.383 177.383 177.852 -0.469 18518
5300 1 8 . 1 1 104 104 ASP CA C 104 53.846 53.846 52.709 1.137 18518
5301 1 8 . 1 1 104 104 ASP CB C 104 43.411 43.411 43.082 0.329 18518
5302 1 8 . 1 1 104 104 ASP H H 104 9.041 9.041 8.218 0.823 18518
5303 1 8 . 1 1 105 105 GLU N N 105 125.448 125.448 121.218 4.230 18518
5304 1 8 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.149 0.031 18518
5305 1 8 . 1 1 105 105 GLU C C 105 177.519 177.519 176.522 0.997 18518
5306 1 8 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.987 0.542 18518
5307 1 8 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.781 0.263 18518
5308 1 8 . 1 1 105 105 GLU H H 105 8.906 8.906 8.888 0.018 18518
5309 1 8 . 1 1 106 106 ASP N N 106 118.824 118.824 116.883 1.941 18518
5310 1 8 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.482 -0.303 18518
5311 1 8 . 1 1 106 106 ASP C C 106 176.223 176.223 176.874 -0.651 18518
5312 1 8 . 1 1 106 106 ASP CA C 106 54.756 54.756 54.247 0.509 18518
5313 1 8 . 1 1 106 106 ASP CB C 106 39.999 39.999 40.471 -0.472 18518
5314 1 8 . 1 1 106 106 ASP H H 106 10.036 10.036 8.136 1.900 18518
5315 1 8 . 1 1 107 107 GLY N N 107 105.866 105.866 106.236 -0.370 18518
5316 1 8 . 1 1 107 107 GLY C C 107 175.136 175.136 173.806 1.330 18518
5317 1 8 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.579 -0.357 18518
5318 1 8 . 1 1 107 107 GLY H H 107 8.001 8.001 7.791 0.210 18518
5319 1 8 . 1 1 108 108 PHE N N 108 123.820 123.820 120.310 3.510 18518
5320 1 8 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.982 -0.320 18518
5321 1 8 . 1 1 108 108 PHE C C 108 174.899 174.899 174.576 0.323 18518
5322 1 8 . 1 1 108 108 PHE CA C 108 60.238 60.238 57.789 2.449 18518
5323 1 8 . 1 1 108 108 PHE CB C 108 40.365 40.365 40.944 -0.579 18518
5324 1 8 . 1 1 108 108 PHE H H 108 9.912 9.912 7.785 2.127 18518
5325 1 8 . 1 1 109 109 LEU N N 109 120.130 120.130 122.711 -2.581 18518
5326 1 8 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.864 0.166 18518
5327 1 8 . 1 1 109 109 LEU C C 109 173.916 173.916 174.815 -0.899 18518
5328 1 8 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.757 -0.333 18518
5329 1 8 . 1 1 109 109 LEU CB C 109 45.203 45.203 43.983 1.220 18518
5330 1 8 . 1 1 109 109 LEU H H 109 7.997 7.997 8.663 -0.666 18518
5331 1 8 . 1 1 110 110 TYR N N 110 126.579 126.579 125.293 1.286 18518
5332 1 8 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.631 0.372 18518
5333 1 8 . 1 1 110 110 TYR C C 110 176.671 176.671 174.866 1.805 18518
5334 1 8 . 1 1 110 110 TYR CA C 110 59.058 59.058 58.737 0.321 18518
5335 1 8 . 1 1 110 110 TYR CB C 110 39.556 39.556 39.055 0.501 18518
5336 1 8 . 1 1 110 110 TYR H H 110 9.377 9.377 9.023 0.354 18518
5337 1 8 . 1 1 111 111 MET N N 111 119.240 119.240 122.806 -3.566 18518
5338 1 8 . 1 1 111 111 MET HA H 111 5.486 5.486 5.209 0.277 18518
5339 1 8 . 1 1 111 111 MET C C 111 175.695 175.695 174.522 1.173 18518
5340 1 8 . 1 1 111 111 MET CA C 111 54.124 54.124 54.657 -0.533 18518
5341 1 8 . 1 1 111 111 MET CB C 111 36.960 36.960 36.979 -0.019 18518
5342 1 8 . 1 1 111 111 MET H H 111 9.658 9.658 8.870 0.788 18518
5343 1 8 . 1 1 112 112 VAL N N 112 119.865 119.865 119.279 0.586 18518
5344 1 8 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.607 0.356 18518
5345 1 8 . 1 1 112 112 VAL C C 112 175.058 175.058 174.348 0.710 18518
5346 1 8 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.439 -0.528 18518
5347 1 8 . 1 1 112 112 VAL CB C 112 36.051 36.051 34.518 1.533 18518
5348 1 8 . 1 1 112 112 VAL H H 112 8.794 8.794 9.118 -0.324 18518
5349 1 8 . 1 1 113 113 TYR N N 113 119.664 119.664 121.055 -1.391 18518
5350 1 8 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.664 0.454 18518
5351 1 8 . 1 1 113 113 TYR C C 113 173.375 173.375 173.517 -0.142 18518
5352 1 8 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.315 -1.162 18518
5353 1 8 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.975 1.337 18518
5354 1 8 . 1 1 113 113 TYR H H 113 8.315 8.315 8.699 -0.384 18518
5355 1 8 . 1 1 114 114 ALA N N 114 119.763 119.763 122.173 -2.410 18518
5356 1 8 . 1 1 114 114 ALA HA H 114 4.800 4.800 4.835 -0.035 18518
5357 1 8 . 1 1 114 114 ALA C C 114 176.216 176.216 175.157 1.059 18518
5358 1 8 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.880 -0.748 18518
5359 1 8 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.217 2.379 18518
5360 1 8 . 1 1 114 114 ALA H H 114 8.465 8.465 8.933 -0.468 18518
5361 1 8 . 1 1 115 115 SER N N 115 114.763 114.763 115.932 -1.169 18518
5362 1 8 . 1 1 115 115 SER HA H 115 4.496 4.496 4.895 -0.399 18518
5363 1 8 . 1 1 115 115 SER C C 115 172.671 172.671 173.679 -1.008 18518
5364 1 8 . 1 1 115 115 SER CA C 115 58.651 58.651 57.445 1.206 18518
5365 1 8 . 1 1 115 115 SER CB C 115 63.526 63.526 61.629 1.897 18518
5366 1 8 . 1 1 115 115 SER H H 115 9.915 9.915 8.934 0.981 18518
5367 1 8 . 1 1 116 116 GLN N N 116 116.611 116.611 124.750 -8.139 18518
5368 1 8 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.551 -0.067 18518
5369 1 8 . 1 1 116 116 GLN C C 116 172.733 172.733 173.975 -1.242 18518
5370 1 8 . 1 1 116 116 GLN CA C 116 53.926 53.926 56.053 -2.127 18518
5371 1 8 . 1 1 116 116 GLN CB C 116 32.358 32.358 31.444 0.914 18518
5372 1 8 . 1 1 116 116 GLN H H 116 7.219 7.219 7.842 -0.623 18518
5373 1 8 . 1 1 117 117 GLU N N 117 117.623 117.623 123.068 -5.445 18518
5374 1 8 . 1 1 117 117 GLU HA H 117 3.287 3.287 2.961 0.326 18518
5375 1 8 . 1 1 117 117 GLU C C 117 175.168 175.168 175.406 -0.238 18518
5376 1 8 . 1 1 117 117 GLU CA C 117 56.882 56.882 57.328 -0.446 18518
5377 1 8 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.694 0.828 18518
5378 1 8 . 1 1 117 117 GLU H H 117 7.882 7.882 8.480 -0.598 18518
5379 1 8 . 1 1 118 118 THR N N 118 109.820 109.820 108.479 1.341 18518
5380 1 8 . 1 1 118 118 THR HA H 118 4.066 4.066 4.330 -0.264 18518
5381 1 8 . 1 1 118 118 THR C C 118 172.355 172.355 173.671 -1.316 18518
5382 1 8 . 1 1 118 118 THR CA C 118 60.029 60.029 60.674 -0.645 18518
5383 1 8 . 1 1 118 118 THR CB C 118 70.480 70.480 69.987 0.493 18518
5384 1 8 . 1 1 118 118 THR H H 118 6.992 6.992 7.270 -0.278 18518
5385 1 9 . 1 1 2 2 ALA HA H 2 4.336 4.336 4.894 -0.558 18518
5386 1 9 . 1 1 2 2 ALA C C 2 177.974 177.974 175.366 2.608 18518
5387 1 9 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.768 1.017 18518
5388 1 9 . 1 1 2 2 ALA CB C 2 19.444 19.444 20.426 -0.982 18518
5389 1 9 . 1 1 3 3 MET N N 3 119.311 119.311 119.355 -0.044 18518
5390 1 9 . 1 1 3 3 MET HA H 3 4.451 4.451 4.765 -0.314 18518
5391 1 9 . 1 1 3 3 MET C C 3 176.913 176.913 175.890 1.023 18518
5392 1 9 . 1 1 3 3 MET CA C 3 55.679 55.679 54.940 0.739 18518
5393 1 9 . 1 1 3 3 MET CB C 3 32.590 32.590 35.924 -3.334 18518
5394 1 9 . 1 1 3 3 MET H H 3 8.638 8.638 8.645 -0.007 18518
5395 1 9 . 1 1 4 4 GLY N N 4 110.281 110.281 110.036 0.245 18518
5396 1 9 . 1 1 4 4 GLY C C 4 174.180 174.180 173.930 0.250 18518
5397 1 9 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.936 0.559 18518
5398 1 9 . 1 1 4 4 GLY H H 4 8.552 8.552 8.482 0.070 18518
5399 1 9 . 1 1 5 5 LYS N N 5 120.818 120.818 124.648 -3.830 18518
5400 1 9 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.638 -0.129 18518
5401 1 9 . 1 1 5 5 LYS C C 5 177.605 177.605 176.470 1.135 18518
5402 1 9 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.425 0.709 18518
5403 1 9 . 1 1 5 5 LYS CB C 5 34.813 34.813 33.980 0.833 18518
5404 1 9 . 1 1 5 5 LYS H H 5 8.133 8.133 7.821 0.312 18518
5405 1 9 . 1 1 6 6 THR N N 6 114.781 114.781 111.724 3.057 18518
5406 1 9 . 1 1 6 6 THR HA H 6 4.421 4.421 4.534 -0.113 18518
5407 1 9 . 1 1 6 6 THR C C 6 175.524 175.524 176.026 -0.502 18518
5408 1 9 . 1 1 6 6 THR CA C 6 61.127 61.127 60.706 0.421 18518
5409 1 9 . 1 1 6 6 THR CB C 6 69.926 69.926 70.573 -0.647 18518
5410 1 9 . 1 1 6 6 THR H H 6 8.483 8.483 8.054 0.429 18518
5411 1 9 . 1 1 7 7 PHE N N 7 125.552 125.552 119.788 5.764 18518
5412 1 9 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.232 -0.227 18518
5413 1 9 . 1 1 7 7 PHE C C 7 177.397 177.397 177.054 0.343 18518
5414 1 9 . 1 1 7 7 PHE CA C 7 63.393 63.393 61.011 2.382 18518
5415 1 9 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.342 1.226 18518
5416 1 9 . 1 1 7 7 PHE H H 7 10.245 10.245 9.026 1.219 18518
5417 1 9 . 1 1 8 8 LYS N N 8 114.053 114.053 117.436 -3.383 18518
5418 1 9 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.714 0.121 18518
5419 1 9 . 1 1 8 8 LYS C C 8 175.520 175.520 178.779 -3.259 18518
5420 1 9 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.306 1.687 18518
5421 1 9 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.208 2.481 18518
5422 1 9 . 1 1 8 8 LYS H H 8 8.775 8.775 6.339 2.436 18518
5423 1 9 . 1 1 9 9 GLN N N 9 113.516 113.516 118.310 -4.794 18518
5424 1 9 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.071 0.078 18518
5425 1 9 . 1 1 9 9 GLN C C 9 177.615 177.615 178.174 -0.559 18518
5426 1 9 . 1 1 9 9 GLN CA C 9 56.819 56.819 58.336 -1.517 18518
5427 1 9 . 1 1 9 9 GLN CB C 9 30.019 30.019 28.660 1.359 18518
5428 1 9 . 1 1 9 9 GLN H H 9 7.355 7.355 7.707 -0.352 18518
5429 1 9 . 1 1 10 10 ARG N N 10 118.294 118.294 116.221 2.073 18518
5430 1 9 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.258 0.044 18518
5431 1 9 . 1 1 10 10 ARG C C 10 179.380 179.380 176.878 2.502 18518
5432 1 9 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.048 0.220 18518
5433 1 9 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.660 0.982 18518
5434 1 9 . 1 1 10 10 ARG H H 10 7.936 7.936 7.560 0.376 18518
5435 1 9 . 1 1 11 11 ARG N N 11 121.137 121.137 120.125 1.012 18518
5436 1 9 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.602 0.078 18518
5437 1 9 . 1 1 11 11 ARG CA C 11 53.453 53.453 54.712 -1.259 18518
5438 1 9 . 1 1 11 11 ARG CB C 11 32.938 32.938 32.211 0.727 18518
5439 1 9 . 1 1 11 11 ARG H H 11 7.390 7.390 7.365 0.025 18518
5440 1 9 . 1 1 12 12 THR N N 12 116.819 116.819 119.337 -2.518 18518
5441 1 9 . 1 1 12 12 THR HA H 12 4.359 4.359 4.251 0.108 18518
5442 1 9 . 1 1 12 12 THR C C 12 174.989 174.989 176.247 -1.258 18518
5443 1 9 . 1 1 12 12 THR CA C 12 61.748 61.748 63.223 -1.475 18518
5444 1 9 . 1 1 12 12 THR CB C 12 71.068 71.068 70.063 1.005 18518
5445 1 9 . 1 1 12 12 THR H H 12 8.953 8.953 8.638 0.315 18518
5446 1 9 . 1 1 13 13 PHE N N 13 123.200 123.200 123.611 -0.411 18518
5447 1 9 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.168 -0.140 18518
5448 1 9 . 1 1 13 13 PHE C C 13 176.029 176.029 176.991 -0.962 18518
5449 1 9 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.222 0.642 18518
5450 1 9 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.214 0.346 18518
5451 1 9 . 1 1 13 13 PHE H H 13 9.284 9.284 9.008 0.276 18518
5452 1 9 . 1 1 14 14 GLU N N 14 115.414 115.414 117.520 -2.106 18518
5453 1 9 . 1 1 14 14 GLU HA H 14 3.794 3.794 3.975 -0.181 18518
5454 1 9 . 1 1 14 14 GLU C C 14 180.081 180.081 178.918 1.163 18518
5455 1 9 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.731 0.888 18518
5456 1 9 . 1 1 14 14 GLU CB C 14 28.852 28.852 29.100 -0.248 18518
5457 1 9 . 1 1 14 14 GLU H H 14 8.973 8.973 8.738 0.235 18518
5458 1 9 . 1 1 15 15 GLN N N 15 119.276 119.276 118.664 0.612 18518
5459 1 9 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.101 -0.101 18518
5460 1 9 . 1 1 15 15 GLN C C 15 177.978 177.978 178.568 -0.590 18518
5461 1 9 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.494 0.341 18518
5462 1 9 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.003 1.367 18518
5463 1 9 . 1 1 15 15 GLN H H 15 7.756 7.756 8.070 -0.314 18518
5464 1 9 . 1 1 16 16 ARG N N 16 121.336 121.336 119.932 1.404 18518
5465 1 9 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.044 0.226 18518
5466 1 9 . 1 1 16 16 ARG C C 16 177.416 177.416 178.687 -1.271 18518
5467 1 9 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.397 1.978 18518
5468 1 9 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.003 0.602 18518
5469 1 9 . 1 1 16 16 ARG H H 16 8.645 8.645 7.803 0.842 18518
5470 1 9 . 1 1 17 17 VAL N N 17 117.630 117.630 120.714 -3.084 18518
5471 1 9 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.911 -0.054 18518
5472 1 9 . 1 1 17 17 VAL C C 17 179.748 179.748 177.267 2.481 18518
5473 1 9 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.350 0.376 18518
5474 1 9 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.951 0.243 18518
5475 1 9 . 1 1 17 17 VAL H H 17 8.373 8.373 7.915 0.458 18518
5476 1 9 . 1 1 18 18 GLU N N 18 120.864 120.864 119.565 1.299 18518
5477 1 9 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.910 0.392 18518
5478 1 9 . 1 1 18 18 GLU C C 18 177.728 177.728 178.261 -0.533 18518
5479 1 9 . 1 1 18 18 GLU CA C 18 58.486 58.486 60.000 -1.514 18518
5480 1 9 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.348 0.034 18518
5481 1 9 . 1 1 18 18 GLU H H 18 7.368 7.368 8.163 -0.795 18518
5482 1 9 . 1 1 19 19 ASP N N 19 121.425 121.425 119.830 1.595 18518
5483 1 9 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.386 0.048 18518
5484 1 9 . 1 1 19 19 ASP C C 19 179.978 179.978 178.531 1.447 18518
5485 1 9 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.223 0.199 18518
5486 1 9 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.964 0.323 18518
5487 1 9 . 1 1 19 19 ASP H H 19 8.671 8.671 7.776 0.895 18518
5488 1 9 . 1 1 20 20 VAL N N 20 119.730 119.730 120.347 -0.617 18518
5489 1 9 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.295 -0.090 18518
5490 1 9 . 1 1 20 20 VAL C C 20 176.284 176.284 177.858 -1.574 18518
5491 1 9 . 1 1 20 20 VAL CA C 20 66.315 66.315 66.311 0.004 18518
5492 1 9 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.599 -0.492 18518
5493 1 9 . 1 1 20 20 VAL H H 20 7.999 7.999 7.716 0.283 18518
5494 1 9 . 1 1 21 21 ARG N N 21 121.455 121.455 119.548 1.907 18518
5495 1 9 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.976 -0.162 18518
5496 1 9 . 1 1 21 21 ARG C C 21 180.120 180.120 178.656 1.464 18518
5497 1 9 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.809 1.021 18518
5498 1 9 . 1 1 21 21 ARG CB C 21 29.946 29.946 28.985 0.961 18518
5499 1 9 . 1 1 21 21 ARG H H 21 8.098 8.098 7.825 0.273 18518
5500 1 9 . 1 1 22 22 LEU N N 22 117.826 117.826 120.640 -2.814 18518
5501 1 9 . 1 1 22 22 LEU HA H 22 4.049 4.049 3.947 0.102 18518
5502 1 9 . 1 1 22 22 LEU C C 22 180.115 180.115 179.152 0.963 18518
5503 1 9 . 1 1 22 22 LEU CA C 22 57.790 57.790 58.082 -0.292 18518
5504 1 9 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.867 0.275 18518
5505 1 9 . 1 1 22 22 LEU H H 22 8.207 8.207 8.111 0.096 18518
5506 1 9 . 1 1 23 23 ILE N N 23 121.450 121.450 118.622 2.828 18518
5507 1 9 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.694 0.319 18518
5508 1 9 . 1 1 23 23 ILE C C 23 178.149 178.149 178.360 -0.211 18518
5509 1 9 . 1 1 23 23 ILE CA C 23 62.171 62.171 63.785 -1.614 18518
5510 1 9 . 1 1 23 23 ILE CB C 23 38.106 38.106 36.751 1.355 18518
5511 1 9 . 1 1 23 23 ILE H H 23 8.105 8.105 7.914 0.191 18518
5512 1 9 . 1 1 24 24 ARG N N 24 121.139 121.139 119.129 2.010 18518
5513 1 9 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.245 -0.258 18518
5514 1 9 . 1 1 24 24 ARG C C 24 178.702 178.702 178.872 -0.170 18518
5515 1 9 . 1 1 24 24 ARG CA C 24 57.718 57.718 59.185 -1.468 18518
5516 1 9 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.811 -1.042 18518
5517 1 9 . 1 1 24 24 ARG H H 24 8.601 8.601 8.577 0.024 18518
5518 1 9 . 1 1 25 25 GLU N N 25 118.054 118.054 119.446 -1.392 18518
5519 1 9 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.137 -0.111 18518
5520 1 9 . 1 1 25 25 GLU C C 25 178.492 178.492 178.180 0.312 18518
5521 1 9 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.573 0.207 18518
5522 1 9 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.557 0.444 18518
5523 1 9 . 1 1 25 25 GLU H H 25 7.423 7.423 7.851 -0.428 18518
5524 1 9 . 1 1 26 26 GLN N N 26 116.350 116.350 117.025 -0.675 18518
5525 1 9 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.056 -0.120 18518
5526 1 9 . 1 1 26 26 GLN C C 26 176.305 176.305 176.977 -0.672 18518
5527 1 9 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.445 0.058 18518
5528 1 9 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.278 0.929 18518
5529 1 9 . 1 1 26 26 GLN H H 26 7.524 7.524 7.630 -0.106 18518
5530 1 9 . 1 1 27 27 HIS N N 27 116.017 116.017 118.986 -2.969 18518
5531 1 9 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.068 -0.138 18518
5532 1 9 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.664 0.390 18518
5533 1 9 . 1 1 27 27 HIS CB C 27 30.747 30.747 29.491 1.256 18518
5534 1 9 . 1 1 27 27 HIS H H 27 8.284 8.284 8.147 0.137 18518
5535 1 9 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.644 -0.063 18518
5536 1 9 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.364 0.555 18518
5537 1 9 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.333 0.122 18518
5538 1 9 . 1 1 29 29 THR N N 29 107.011 107.011 105.199 1.812 18518
5539 1 9 . 1 1 29 29 THR HA H 29 4.599 4.599 4.423 0.176 18518
5540 1 9 . 1 1 29 29 THR C C 29 172.884 172.884 173.759 -0.875 18518
5541 1 9 . 1 1 29 29 THR CA C 29 60.810 60.810 61.522 -0.712 18518
5542 1 9 . 1 1 29 29 THR CB C 29 68.531 68.531 68.711 -0.180 18518
5543 1 9 . 1 1 29 29 THR H H 29 7.890 7.890 8.196 -0.306 18518
5544 1 9 . 1 1 30 30 LYS N N 30 117.679 117.679 121.294 -3.615 18518
5545 1 9 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.963 -0.105 18518
5546 1 9 . 1 1 30 30 LYS C C 30 174.310 174.310 175.021 -0.711 18518
5547 1 9 . 1 1 30 30 LYS CA C 30 53.751 53.751 54.099 -0.348 18518
5548 1 9 . 1 1 30 30 LYS CB C 30 35.804 35.804 35.779 0.025 18518
5549 1 9 . 1 1 30 30 LYS H H 30 7.441 7.441 7.537 -0.096 18518
5550 1 9 . 1 1 31 31 ILE N N 31 122.849 122.849 123.758 -0.909 18518
5551 1 9 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.308 -0.203 18518
5552 1 9 . 1 1 31 31 ILE CA C 31 54.801 54.801 57.892 -3.091 18518
5553 1 9 . 1 1 31 31 ILE CB C 31 38.265 38.265 39.279 -1.014 18518
5554 1 9 . 1 1 31 31 ILE H H 31 9.304 9.304 8.851 0.453 18518
5555 1 9 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.871 0.288 18518
5556 1 9 . 1 1 32 32 PRO C C 32 174.164 174.164 176.022 -1.858 18518
5557 1 9 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.468 -0.965 18518
5558 1 9 . 1 1 32 32 PRO CB C 32 31.145 31.145 31.157 -0.012 18518
5559 1 9 . 1 1 33 33 VAL N N 33 125.606 125.606 124.385 1.221 18518
5560 1 9 . 1 1 33 33 VAL HA H 33 5.213 5.213 4.978 0.235 18518
5561 1 9 . 1 1 33 33 VAL C C 33 173.654 173.654 173.522 0.132 18518
5562 1 9 . 1 1 33 33 VAL CA C 33 60.044 60.044 58.990 1.054 18518
5563 1 9 . 1 1 33 33 VAL CB C 33 35.604 35.604 36.024 -0.420 18518
5564 1 9 . 1 1 33 33 VAL H H 33 9.424 9.424 8.827 0.597 18518
5565 1 9 . 1 1 34 34 ILE N N 34 128.241 128.241 125.771 2.470 18518
5566 1 9 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.431 0.402 18518
5567 1 9 . 1 1 34 34 ILE C C 34 175.605 175.605 174.807 0.798 18518
5568 1 9 . 1 1 34 34 ILE CA C 34 56.765 56.765 57.848 -1.083 18518
5569 1 9 . 1 1 34 34 ILE CB C 34 36.799 36.799 38.163 -1.364 18518
5570 1 9 . 1 1 34 34 ILE H H 34 8.721 8.721 8.540 0.181 18518
5571 1 9 . 1 1 35 35 ILE N N 35 125.650 125.650 127.864 -2.214 18518
5572 1 9 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.397 0.439 18518
5573 1 9 . 1 1 35 35 ILE C C 35 174.887 174.887 174.262 0.625 18518
5574 1 9 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.191 0.754 18518
5575 1 9 . 1 1 35 35 ILE CB C 35 39.210 39.210 38.578 0.632 18518
5576 1 9 . 1 1 35 35 ILE H H 35 9.034 9.034 8.611 0.423 18518
5577 1 9 . 1 1 36 36 GLU N N 36 122.657 122.657 127.533 -4.876 18518
5578 1 9 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.872 -0.011 18518
5579 1 9 . 1 1 36 36 GLU C C 36 173.848 173.848 175.085 -1.237 18518
5580 1 9 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.075 -0.143 18518
5581 1 9 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.181 1.101 18518
5582 1 9 . 1 1 36 36 GLU H H 36 8.303 8.303 8.522 -0.219 18518
5583 1 9 . 1 1 37 37 ARG N N 37 123.228 123.228 127.641 -4.413 18518
5584 1 9 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.784 -1.058 18518
5585 1 9 . 1 1 37 37 ARG C C 37 176.359 176.359 175.730 0.629 18518
5586 1 9 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.866 -0.507 18518
5587 1 9 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.509 0.832 18518
5588 1 9 . 1 1 37 37 ARG H H 37 8.856 8.856 8.840 0.016 18518
5589 1 9 . 1 1 38 38 TYR N N 38 128.981 128.981 128.781 0.200 18518
5590 1 9 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.309 0.043 18518
5591 1 9 . 1 1 38 38 TYR C C 38 177.316 177.316 176.369 0.947 18518
5592 1 9 . 1 1 38 38 TYR CA C 38 57.712 57.712 57.907 -0.195 18518
5593 1 9 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.187 -0.715 18518
5594 1 9 . 1 1 38 38 TYR H H 38 8.628 8.628 8.100 0.528 18518
5595 1 9 . 1 1 39 39 LYS N N 39 130.635 130.635 125.146 5.489 18518
5596 1 9 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.761 0.061 18518
5597 1 9 . 1 1 39 39 LYS CA C 39 58.887 58.887 58.350 0.537 18518
5598 1 9 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.886 -0.115 18518
5599 1 9 . 1 1 39 39 LYS H H 39 8.594 8.594 8.164 0.430 18518
5600 1 9 . 1 1 40 40 GLY C C 40 173.447 173.447 173.502 -0.055 18518
5601 1 9 . 1 1 40 40 GLY CA C 40 44.663 44.663 43.854 0.809 18518
5602 1 9 . 1 1 40 40 GLY H H 40 5.188 5.188 6.475 -1.287 18518
5603 1 9 . 1 1 41 41 GLU N N 41 122.836 122.836 121.617 1.219 18518
5604 1 9 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.330 -0.073 18518
5605 1 9 . 1 1 41 41 GLU C C 41 176.524 176.524 176.015 0.509 18518
5606 1 9 . 1 1 41 41 GLU CA C 41 56.525 56.525 57.136 -0.611 18518
5607 1 9 . 1 1 41 41 GLU CB C 41 30.985 30.985 29.689 1.296 18518
5608 1 9 . 1 1 41 41 GLU H H 41 7.380 7.380 7.863 -0.483 18518
5609 1 9 . 1 1 42 42 LYS N N 42 124.040 124.040 125.377 -1.337 18518
5610 1 9 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.460 0.215 18518
5611 1 9 . 1 1 42 42 LYS C C 42 177.538 177.538 177.660 -0.122 18518
5612 1 9 . 1 1 42 42 LYS CA C 42 55.840 55.840 57.383 -1.543 18518
5613 1 9 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.793 1.186 18518
5614 1 9 . 1 1 42 42 LYS H H 42 9.034 9.034 8.778 0.256 18518
5615 1 9 . 1 1 43 43 GLN N N 43 119.259 119.259 119.667 -0.408 18518
5616 1 9 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.243 0.299 18518
5617 1 9 . 1 1 43 43 GLN C C 43 177.336 177.336 175.972 1.364 18518
5618 1 9 . 1 1 43 43 GLN CA C 43 57.673 57.673 57.485 0.188 18518
5619 1 9 . 1 1 43 43 GLN CB C 43 30.782 30.782 28.991 1.791 18518
5620 1 9 . 1 1 43 43 GLN H H 43 8.435 8.435 8.487 -0.052 18518
5621 1 9 . 1 1 44 44 LEU N N 44 120.760 120.760 122.903 -2.143 18518
5622 1 9 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.686 0.009 18518
5623 1 9 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.552 0.693 18518
5624 1 9 . 1 1 44 44 LEU CB C 44 43.596 43.596 41.699 1.897 18518
5625 1 9 . 1 1 44 44 LEU H H 44 9.126 9.126 7.661 1.465 18518
5626 1 9 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.592 0.125 18518
5627 1 9 . 1 1 45 45 PRO C C 45 175.797 175.797 176.230 -0.433 18518
5628 1 9 . 1 1 45 45 PRO CA C 45 62.111 62.111 61.993 0.118 18518
5629 1 9 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.387 0.205 18518
5630 1 9 . 1 1 46 46 VAL N N 46 119.052 119.052 120.790 -1.738 18518
5631 1 9 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.403 -0.536 18518
5632 1 9 . 1 1 46 46 VAL C C 46 175.640 175.640 177.119 -1.479 18518
5633 1 9 . 1 1 46 46 VAL CA C 46 62.944 62.944 62.088 0.856 18518
5634 1 9 . 1 1 46 46 VAL CB C 46 32.799 32.799 32.282 0.517 18518
5635 1 9 . 1 1 46 46 VAL H H 46 8.543 8.543 8.363 0.180 18518
5636 1 9 . 1 1 47 47 LEU N N 47 130.203 130.203 126.617 3.586 18518
5637 1 9 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.339 -0.030 18518
5638 1 9 . 1 1 47 47 LEU C C 47 176.198 176.198 177.245 -1.047 18518
5639 1 9 . 1 1 47 47 LEU CA C 47 55.006 55.006 54.988 0.018 18518
5640 1 9 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.647 1.185 18518
5641 1 9 . 1 1 47 47 LEU H H 47 7.799 7.799 8.348 -0.549 18518
5642 1 9 . 1 1 48 48 ASP N N 48 122.403 122.403 120.855 1.548 18518
5643 1 9 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.576 -0.313 18518
5644 1 9 . 1 1 48 48 ASP C C 48 175.294 175.294 176.140 -0.846 18518
5645 1 9 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.683 0.149 18518
5646 1 9 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.248 -1.064 18518
5647 1 9 . 1 1 48 48 ASP H H 48 8.780 8.780 8.506 0.274 18518
5648 1 9 . 1 1 49 49 LYS N N 49 119.569 119.569 116.490 3.079 18518
5649 1 9 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.545 0.040 18518
5650 1 9 . 1 1 49 49 LYS C C 49 174.678 174.678 174.891 -0.213 18518
5651 1 9 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.656 -2.004 18518
5652 1 9 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.087 1.858 18518
5653 1 9 . 1 1 49 49 LYS H H 49 7.280 7.280 7.519 -0.239 18518
5654 1 9 . 1 1 50 50 THR N N 50 110.862 110.862 112.668 -1.806 18518
5655 1 9 . 1 1 50 50 THR HA H 50 4.811 4.811 4.723 0.088 18518
5656 1 9 . 1 1 50 50 THR C C 50 172.425 172.425 173.968 -1.543 18518
5657 1 9 . 1 1 50 50 THR CA C 50 62.645 62.645 62.715 -0.070 18518
5658 1 9 . 1 1 50 50 THR CB C 50 71.648 71.648 70.381 1.267 18518
5659 1 9 . 1 1 50 50 THR H H 50 8.042 8.042 8.293 -0.251 18518
5660 1 9 . 1 1 51 51 LYS N N 51 120.008 120.008 122.959 -2.951 18518
5661 1 9 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.690 -0.065 18518
5662 1 9 . 1 1 51 51 LYS C C 51 175.082 175.082 176.092 -1.010 18518
5663 1 9 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.124 -1.420 18518
5664 1 9 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.058 -0.682 18518
5665 1 9 . 1 1 51 51 LYS H H 51 7.119 7.119 7.620 -0.501 18518
5666 1 9 . 1 1 52 52 PHE N N 52 122.640 122.640 123.854 -1.214 18518
5667 1 9 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.725 0.612 18518
5668 1 9 . 1 1 52 52 PHE C C 52 174.213 174.213 174.327 -0.114 18518
5669 1 9 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.581 0.030 18518
5670 1 9 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.289 -0.149 18518
5671 1 9 . 1 1 52 52 PHE H H 52 9.709 9.709 9.291 0.418 18518
5672 1 9 . 1 1 53 53 LEU N N 53 122.157 122.157 123.105 -0.948 18518
5673 1 9 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.770 0.177 18518
5674 1 9 . 1 1 53 53 LEU C C 53 175.769 175.769 175.518 0.251 18518
5675 1 9 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.793 -0.836 18518
5676 1 9 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.610 0.805 18518
5677 1 9 . 1 1 53 53 LEU H H 53 8.959 8.959 8.396 0.563 18518
5678 1 9 . 1 1 54 54 VAL N N 54 124.919 124.919 121.711 3.208 18518
5679 1 9 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.754 -0.195 18518
5680 1 9 . 1 1 54 54 VAL CA C 54 59.130 59.130 57.846 1.284 18518
5681 1 9 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.824 1.144 18518
5682 1 9 . 1 1 54 54 VAL H H 54 8.922 8.922 8.514 0.408 18518
5683 1 9 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.929 -0.488 18518
5684 1 9 . 1 1 55 55 PRO C C 55 176.594 176.594 178.281 -1.687 18518
5685 1 9 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.117 2.198 18518
5686 1 9 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.132 0.533 18518
5687 1 9 . 1 1 56 56 ASP N N 56 120.522 120.522 123.746 -3.224 18518
5688 1 9 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.197 -0.335 18518
5689 1 9 . 1 1 56 56 ASP C C 56 175.809 175.809 176.678 -0.869 18518
5690 1 9 . 1 1 56 56 ASP CA C 56 56.749 56.749 57.401 -0.652 18518
5691 1 9 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.648 -0.138 18518
5692 1 9 . 1 1 56 56 ASP H H 56 8.347 8.347 8.370 -0.023 18518
5693 1 9 . 1 1 57 57 HIS N N 57 113.482 113.482 114.892 -1.410 18518
5694 1 9 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.723 -0.003 18518
5695 1 9 . 1 1 57 57 HIS C C 57 176.507 176.507 175.288 1.219 18518
5696 1 9 . 1 1 57 57 HIS CA C 57 55.589 55.589 55.910 -0.321 18518
5697 1 9 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.687 0.956 18518
5698 1 9 . 1 1 57 57 HIS H H 57 7.557 7.557 8.052 -0.495 18518
5699 1 9 . 1 1 58 58 VAL N N 58 123.279 123.279 121.914 1.365 18518
5700 1 9 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.123 -0.287 18518
5701 1 9 . 1 1 58 58 VAL C C 58 175.019 175.019 174.906 0.113 18518
5702 1 9 . 1 1 58 58 VAL CA C 58 62.823 62.823 61.578 1.245 18518
5703 1 9 . 1 1 58 58 VAL CB C 58 32.310 32.310 33.238 -0.928 18518
5704 1 9 . 1 1 58 58 VAL H H 58 7.345 7.345 7.379 -0.034 18518
5705 1 9 . 1 1 59 59 ASN N N 59 123.781 123.781 122.629 1.152 18518
5706 1 9 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.058 0.068 18518
5707 1 9 . 1 1 59 59 ASN C C 59 176.558 176.558 176.482 0.076 18518
5708 1 9 . 1 1 59 59 ASN CA C 59 51.485 51.485 52.082 -0.597 18518
5709 1 9 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.259 -0.152 18518
5710 1 9 . 1 1 59 59 ASN H H 59 8.735 8.735 8.365 0.370 18518
5711 1 9 . 1 1 60 60 MET N N 60 117.453 117.453 118.714 -1.261 18518
5712 1 9 . 1 1 60 60 MET HA H 60 4.395 4.395 4.152 0.243 18518
5713 1 9 . 1 1 60 60 MET C C 60 178.144 178.144 178.491 -0.347 18518
5714 1 9 . 1 1 60 60 MET CA C 60 57.097 57.097 57.730 -0.633 18518
5715 1 9 . 1 1 60 60 MET CB C 60 30.140 30.140 30.902 -0.762 18518
5716 1 9 . 1 1 60 60 MET H H 60 8.227 8.227 8.643 -0.416 18518
5717 1 9 . 1 1 61 61 SER N N 61 114.216 114.216 115.787 -1.571 18518
5718 1 9 . 1 1 61 61 SER HA H 61 4.111 4.111 4.065 0.046 18518
5719 1 9 . 1 1 61 61 SER C C 61 177.335 177.335 176.701 0.634 18518
5720 1 9 . 1 1 61 61 SER CA C 61 61.590 61.590 62.279 -0.689 18518
5721 1 9 . 1 1 61 61 SER CB C 61 62.402 62.402 62.851 -0.449 18518
5722 1 9 . 1 1 61 61 SER H H 61 8.464 8.464 8.273 0.191 18518
5723 1 9 . 1 1 62 62 GLU N N 62 123.004 123.004 121.114 1.890 18518
5724 1 9 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.068 -0.021 18518
5725 1 9 . 1 1 62 62 GLU C C 62 178.686 178.686 178.883 -0.197 18518
5726 1 9 . 1 1 62 62 GLU CA C 62 58.625 58.625 59.032 -0.407 18518
5727 1 9 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.491 0.163 18518
5728 1 9 . 1 1 62 62 GLU H H 62 7.994 7.994 7.665 0.329 18518
5729 1 9 . 1 1 63 63 LEU N N 63 120.818 120.818 121.793 -0.975 18518
5730 1 9 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.988 -0.023 18518
5731 1 9 . 1 1 63 63 LEU C C 63 178.046 178.046 178.833 -0.787 18518
5732 1 9 . 1 1 63 63 LEU CA C 63 57.920 57.920 57.999 -0.079 18518
5733 1 9 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.733 -0.109 18518
5734 1 9 . 1 1 63 63 LEU H H 63 8.130 8.130 7.853 0.277 18518
5735 1 9 . 1 1 64 64 ILE N N 64 118.528 118.528 118.818 -0.290 18518
5736 1 9 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.550 -0.181 18518
5737 1 9 . 1 1 64 64 ILE C C 64 177.127 177.127 177.719 -0.592 18518
5738 1 9 . 1 1 64 64 ILE CA C 64 66.678 66.678 65.953 0.725 18518
5739 1 9 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.573 0.871 18518
5740 1 9 . 1 1 64 64 ILE H H 64 8.488 8.488 8.525 -0.037 18518
5741 1 9 . 1 1 65 65 LYS N N 65 118.336 118.336 121.007 -2.671 18518
5742 1 9 . 1 1 65 65 LYS HA H 65 3.701 3.701 4.004 -0.303 18518
5743 1 9 . 1 1 65 65 LYS C C 65 179.291 179.291 179.028 0.263 18518
5744 1 9 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.834 0.606 18518
5745 1 9 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.208 0.163 18518
5746 1 9 . 1 1 65 65 LYS H H 65 7.347 7.347 7.614 -0.267 18518
5747 1 9 . 1 1 66 66 ILE N N 66 120.171 120.171 120.157 0.014 18518
5748 1 9 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.665 -0.087 18518
5749 1 9 . 1 1 66 66 ILE C C 66 178.873 178.873 178.310 0.563 18518
5750 1 9 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.114 0.046 18518
5751 1 9 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.782 0.851 18518
5752 1 9 . 1 1 66 66 ILE H H 66 7.901 7.901 8.181 -0.280 18518
5753 1 9 . 1 1 67 67 ILE N N 67 121.185 121.185 120.705 0.480 18518
5754 1 9 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.567 -0.121 18518
5755 1 9 . 1 1 67 67 ILE C C 67 177.150 177.150 177.649 -0.499 18518
5756 1 9 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.939 -2.133 18518
5757 1 9 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.450 -2.455 18518
5758 1 9 . 1 1 67 67 ILE H H 67 8.290 8.290 7.971 0.319 18518
5759 1 9 . 1 1 68 68 ARG N N 68 119.173 119.173 118.680 0.493 18518
5760 1 9 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.765 -0.834 18518
5761 1 9 . 1 1 68 68 ARG C C 68 178.496 178.496 178.611 -0.115 18518
5762 1 9 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.716 0.920 18518
5763 1 9 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.779 0.661 18518
5764 1 9 . 1 1 68 68 ARG H H 68 8.438 8.438 8.302 0.136 18518
5765 1 9 . 1 1 69 69 ARG N N 69 116.511 116.511 120.218 -3.707 18518
5766 1 9 . 1 1 69 69 ARG HA H 69 4.134 4.134 3.975 0.159 18518
5767 1 9 . 1 1 69 69 ARG C C 69 180.262 180.262 179.008 1.254 18518
5768 1 9 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.717 -1.010 18518
5769 1 9 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.245 -0.292 18518
5770 1 9 . 1 1 69 69 ARG H H 69 7.497 7.497 8.380 -0.883 18518
5771 1 9 . 1 1 70 70 ARG N N 70 123.297 123.297 119.677 3.620 18518
5772 1 9 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.100 -0.084 18518
5773 1 9 . 1 1 70 70 ARG C C 70 178.700 178.700 178.248 0.452 18518
5774 1 9 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.709 0.751 18518
5775 1 9 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.785 0.527 18518
5776 1 9 . 1 1 70 70 ARG H H 70 8.075 8.075 7.890 0.185 18518
5777 1 9 . 1 1 71 71 LEU N N 71 116.829 116.829 119.641 -2.812 18518
5778 1 9 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.294 -0.229 18518
5779 1 9 . 1 1 71 71 LEU C C 71 174.956 174.956 175.651 -0.695 18518
5780 1 9 . 1 1 71 71 LEU CA C 71 55.126 55.126 54.450 0.676 18518
5781 1 9 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.036 1.210 18518
5782 1 9 . 1 1 71 71 LEU H H 71 7.719 7.719 8.101 -0.382 18518
5783 1 9 . 1 1 72 72 GLN N N 72 114.991 114.991 114.792 0.199 18518
5784 1 9 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.822 0.014 18518
5785 1 9 . 1 1 72 72 GLN C C 72 175.683 175.683 175.312 0.371 18518
5786 1 9 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.481 -0.156 18518
5787 1 9 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.631 0.373 18518
5788 1 9 . 1 1 72 72 GLN H H 72 7.744 7.744 7.409 0.335 18518
5789 1 9 . 1 1 73 73 LEU N N 73 115.045 115.045 119.847 -4.802 18518
5790 1 9 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.140 0.096 18518
5791 1 9 . 1 1 73 73 LEU C C 73 178.762 178.762 177.076 1.686 18518
5792 1 9 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.325 -0.939 18518
5793 1 9 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.861 0.230 18518
5794 1 9 . 1 1 73 73 LEU H H 73 7.500 7.500 7.774 -0.274 18518
5795 1 9 . 1 1 74 74 ASN N N 74 121.700 121.700 121.959 -0.259 18518
5796 1 9 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.592 0.098 18518
5797 1 9 . 1 1 74 74 ASN C C 74 176.617 176.617 175.683 0.934 18518
5798 1 9 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.675 -0.990 18518
5799 1 9 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.400 0.198 18518
5800 1 9 . 1 1 74 74 ASN H H 74 9.045 9.045 8.413 0.632 18518
5801 1 9 . 1 1 75 75 ALA N N 75 123.952 123.952 122.003 1.949 18518
5802 1 9 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.356 -0.393 18518
5803 1 9 . 1 1 75 75 ALA C C 75 178.131 178.131 177.335 0.796 18518
5804 1 9 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.224 1.644 18518
5805 1 9 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.285 -0.567 18518
5806 1 9 . 1 1 75 75 ALA H H 75 8.784 8.784 8.443 0.341 18518
5807 1 9 . 1 1 76 76 ASN N N 76 112.295 112.295 115.809 -3.514 18518
5808 1 9 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.635 -0.055 18518
5809 1 9 . 1 1 76 76 ASN C C 76 175.448 175.448 175.173 0.275 18518
5810 1 9 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.597 -0.383 18518
5811 1 9 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.603 -0.283 18518
5812 1 9 . 1 1 76 76 ASN H H 76 8.391 8.391 8.317 0.074 18518
5813 1 9 . 1 1 77 77 GLN N N 77 120.577 120.577 117.071 3.506 18518
5814 1 9 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.591 -0.318 18518
5815 1 9 . 1 1 77 77 GLN C C 77 175.045 175.045 173.745 1.300 18518
5816 1 9 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.617 1.188 18518
5817 1 9 . 1 1 77 77 GLN CB C 77 30.157 30.157 31.252 -1.095 18518
5818 1 9 . 1 1 77 77 GLN H H 77 7.552 7.552 7.475 0.077 18518
5819 1 9 . 1 1 78 78 ALA N N 78 130.670 130.670 122.834 7.836 18518
5820 1 9 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.687 -0.516 18518
5821 1 9 . 1 1 78 78 ALA C C 78 176.512 176.512 175.378 1.134 18518
5822 1 9 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.254 1.588 18518
5823 1 9 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.492 -1.432 18518
5824 1 9 . 1 1 78 78 ALA H H 78 8.799 8.799 8.795 0.004 18518
5825 1 9 . 1 1 79 79 PHE N N 79 119.325 119.325 116.778 2.547 18518
5826 1 9 . 1 1 79 79 PHE HA H 79 4.434 4.434 5.204 -0.769 18518
5827 1 9 . 1 1 79 79 PHE C C 79 171.726 171.726 172.922 -1.196 18518
5828 1 9 . 1 1 79 79 PHE CA C 79 59.145 59.145 55.330 3.815 18518
5829 1 9 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.989 0.182 18518
5830 1 9 . 1 1 79 79 PHE H H 79 7.664 7.664 8.204 -0.540 18518
5831 1 9 . 1 1 80 80 PHE N N 80 126.314 126.314 118.098 8.216 18518
5832 1 9 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.304 0.088 18518
5833 1 9 . 1 1 80 80 PHE C C 80 177.169 177.169 173.384 3.785 18518
5834 1 9 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.251 0.402 18518
5835 1 9 . 1 1 80 80 PHE CB C 80 41.933 41.933 42.777 -0.844 18518
5836 1 9 . 1 1 80 80 PHE H H 80 8.508 8.508 9.087 -0.579 18518
5837 1 9 . 1 1 81 81 LEU N N 81 121.426 121.426 123.680 -2.254 18518
5838 1 9 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.021 -0.170 18518
5839 1 9 . 1 1 81 81 LEU C C 81 174.488 174.488 175.299 -0.811 18518
5840 1 9 . 1 1 81 81 LEU CA C 81 53.197 53.197 54.339 -1.142 18518
5841 1 9 . 1 1 81 81 LEU CB C 81 45.100 45.100 43.153 1.947 18518
5842 1 9 . 1 1 81 81 LEU H H 81 8.229 8.229 8.378 -0.149 18518
5843 1 9 . 1 1 82 82 LEU N N 82 125.155 125.155 128.641 -3.486 18518
5844 1 9 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.508 0.325 18518
5845 1 9 . 1 1 82 82 LEU C C 82 177.166 177.166 175.599 1.567 18518
5846 1 9 . 1 1 82 82 LEU CA C 82 54.197 54.197 54.373 -0.176 18518
5847 1 9 . 1 1 82 82 LEU CB C 82 43.442 43.442 43.366 0.076 18518
5848 1 9 . 1 1 82 82 LEU H H 82 9.400 9.400 9.113 0.287 18518
5849 1 9 . 1 1 83 83 VAL N N 83 123.886 123.886 123.156 0.730 18518
5850 1 9 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.413 -0.034 18518
5851 1 9 . 1 1 83 83 VAL C C 83 175.810 175.810 176.849 -1.039 18518
5852 1 9 . 1 1 83 83 VAL CA C 83 61.677 61.677 62.077 -0.400 18518
5853 1 9 . 1 1 83 83 VAL CB C 83 33.758 33.758 31.705 2.053 18518
5854 1 9 . 1 1 83 83 VAL H H 83 8.721 8.721 8.705 0.016 18518
5855 1 9 . 1 1 84 84 ASN N N 84 126.474 126.474 126.151 0.323 18518
5856 1 9 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.406 -0.010 18518
5857 1 9 . 1 1 84 84 ASN C C 84 175.164 175.164 175.089 0.075 18518
5858 1 9 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.962 -0.224 18518
5859 1 9 . 1 1 84 84 ASN CB C 84 37.950 37.950 38.196 -0.246 18518
5860 1 9 . 1 1 84 84 ASN H H 84 9.707 9.707 9.351 0.356 18518
5861 1 9 . 1 1 85 85 GLY N N 85 101.296 101.296 104.645 -3.349 18518
5862 1 9 . 1 1 85 85 GLY C C 85 173.680 173.680 173.268 0.412 18518
5863 1 9 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.833 0.770 18518
5864 1 9 . 1 1 85 85 GLY H H 85 8.644 8.644 8.294 0.350 18518
5865 1 9 . 1 1 86 86 HIS N N 86 117.238 117.238 119.102 -1.864 18518
5866 1 9 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.758 0.259 18518
5867 1 9 . 1 1 86 86 HIS C C 86 173.841 173.841 173.902 -0.061 18518
5868 1 9 . 1 1 86 86 HIS CA C 86 53.796 53.796 53.505 0.291 18518
5869 1 9 . 1 1 86 86 HIS CB C 86 31.280 31.280 31.356 -0.076 18518
5870 1 9 . 1 1 86 86 HIS H H 86 7.918 7.918 8.106 -0.188 18518
5871 1 9 . 1 1 87 87 SER N N 87 118.179 118.179 121.319 -3.140 18518
5872 1 9 . 1 1 87 87 SER HA H 87 4.699 4.699 4.379 0.320 18518
5873 1 9 . 1 1 87 87 SER C C 87 175.904 175.904 174.718 1.186 18518
5874 1 9 . 1 1 87 87 SER CA C 87 58.271 58.271 58.393 -0.122 18518
5875 1 9 . 1 1 87 87 SER CB C 87 63.735 63.735 61.730 2.005 18518
5876 1 9 . 1 1 87 87 SER H H 87 8.977 8.977 8.803 0.174 18518
5877 1 9 . 1 1 88 88 MET N N 88 125.472 125.472 122.012 3.460 18518
5878 1 9 . 1 1 88 88 MET HA H 88 4.830 4.830 4.624 0.206 18518
5879 1 9 . 1 1 88 88 MET C C 88 176.419 176.419 175.152 1.267 18518
5880 1 9 . 1 1 88 88 MET CA C 88 54.899 54.899 55.291 -0.392 18518
5881 1 9 . 1 1 88 88 MET CB C 88 33.336 33.336 33.573 -0.237 18518
5882 1 9 . 1 1 88 88 MET H H 88 9.184 9.184 8.003 1.181 18518
5883 1 9 . 1 1 89 89 VAL N N 89 120.747 120.747 121.966 -1.219 18518
5884 1 9 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.295 -0.063 18518
5885 1 9 . 1 1 89 89 VAL C C 89 175.958 175.958 175.175 0.783 18518
5886 1 9 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.655 1.499 18518
5887 1 9 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.059 -1.181 18518
5888 1 9 . 1 1 89 89 VAL H H 89 8.233 8.233 7.762 0.471 18518
5889 1 9 . 1 1 90 90 SER N N 90 117.362 117.362 122.559 -5.197 18518
5890 1 9 . 1 1 90 90 SER HA H 90 4.590 4.590 4.508 0.082 18518
5891 1 9 . 1 1 90 90 SER C C 90 175.741 175.741 174.707 1.034 18518
5892 1 9 . 1 1 90 90 SER CA C 90 57.717 57.717 58.385 -0.668 18518
5893 1 9 . 1 1 90 90 SER CB C 90 63.223 63.223 64.094 -0.870 18518
5894 1 9 . 1 1 90 90 SER H H 90 8.482 8.482 8.495 -0.013 18518
5895 1 9 . 1 1 91 91 VAL N N 91 120.466 120.466 122.879 -2.413 18518
5896 1 9 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.827 0.220 18518
5897 1 9 . 1 1 91 91 VAL C C 91 176.329 176.329 177.460 -1.131 18518
5898 1 9 . 1 1 91 91 VAL CA C 91 63.492 63.492 65.185 -1.693 18518
5899 1 9 . 1 1 91 91 VAL CB C 91 32.568 32.568 32.076 0.492 18518
5900 1 9 . 1 1 91 91 VAL H H 91 8.188 8.188 8.420 -0.232 18518
5901 1 9 . 1 1 92 92 SER N N 92 116.398 116.398 112.731 3.667 18518
5902 1 9 . 1 1 92 92 SER HA H 92 4.636 4.636 4.395 0.241 18518
5903 1 9 . 1 1 92 92 SER C C 92 174.159 174.159 174.294 -0.135 18518
5904 1 9 . 1 1 92 92 SER CA C 92 57.805 57.805 59.739 -1.934 18518
5905 1 9 . 1 1 92 92 SER CB C 92 63.046 63.046 62.981 0.065 18518
5906 1 9 . 1 1 92 92 SER H H 92 8.370 8.370 8.183 0.187 18518
5907 1 9 . 1 1 93 93 THR N N 93 119.211 119.211 119.439 -0.228 18518
5908 1 9 . 1 1 93 93 THR HA H 93 4.484 4.484 4.463 0.021 18518
5909 1 9 . 1 1 93 93 THR CA C 93 60.884 60.884 61.387 -0.503 18518
5910 1 9 . 1 1 93 93 THR CB C 93 70.609 70.609 69.032 1.577 18518
5911 1 9 . 1 1 93 93 THR H H 93 7.416 7.416 7.564 -0.148 18518
5912 1 9 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.706 -0.266 18518
5913 1 9 . 1 1 94 94 PRO C C 94 178.775 178.775 177.573 1.202 18518
5914 1 9 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.437 0.506 18518
5915 1 9 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.546 0.103 18518
5916 1 9 . 1 1 95 95 ILE N N 95 124.174 124.174 124.122 0.052 18518
5917 1 9 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.808 0.141 18518
5918 1 9 . 1 1 95 95 ILE C C 95 176.498 176.498 177.219 -0.721 18518
5919 1 9 . 1 1 95 95 ILE CA C 95 63.904 63.904 61.848 2.056 18518
5920 1 9 . 1 1 95 95 ILE CB C 95 38.182 38.182 37.766 0.416 18518
5921 1 9 . 1 1 95 95 ILE H H 95 9.305 9.305 8.353 0.952 18518
5922 1 9 . 1 1 96 96 SER N N 96 116.920 116.920 116.815 0.105 18518
5923 1 9 . 1 1 96 96 SER HA H 96 4.029 4.029 4.199 -0.170 18518
5924 1 9 . 1 1 96 96 SER C C 96 176.574 176.574 176.031 0.543 18518
5925 1 9 . 1 1 96 96 SER CA C 96 61.356 61.356 62.470 -1.114 18518
5926 1 9 . 1 1 96 96 SER CB C 96 61.723 61.723 62.905 -1.182 18518
5927 1 9 . 1 1 96 96 SER H H 96 8.335 8.335 8.026 0.309 18518
5928 1 9 . 1 1 97 97 GLU N N 97 123.255 123.255 121.162 2.093 18518
5929 1 9 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.166 0.112 18518
5930 1 9 . 1 1 97 97 GLU C C 97 179.716 179.716 179.060 0.656 18518
5931 1 9 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.955 -0.163 18518
5932 1 9 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.147 0.415 18518
5933 1 9 . 1 1 97 97 GLU H H 97 7.376 7.376 7.848 -0.472 18518
5934 1 9 . 1 1 98 98 VAL N N 98 121.137 121.137 121.142 -0.005 18518
5935 1 9 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.610 0.192 18518
5936 1 9 . 1 1 98 98 VAL C C 98 177.637 177.637 178.016 -0.379 18518
5937 1 9 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.569 -0.744 18518
5938 1 9 . 1 1 98 98 VAL CB C 98 32.154 32.154 31.560 0.594 18518
5939 1 9 . 1 1 98 98 VAL H H 98 7.387 7.387 7.744 -0.357 18518
5940 1 9 . 1 1 99 99 TYR N N 99 118.927 118.927 121.052 -2.125 18518
5941 1 9 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.032 -0.042 18518
5942 1 9 . 1 1 99 99 TYR C C 99 176.081 176.081 177.131 -1.050 18518
5943 1 9 . 1 1 99 99 TYR CA C 99 62.223 62.223 60.746 1.477 18518
5944 1 9 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.405 0.577 18518
5945 1 9 . 1 1 99 99 TYR H H 99 9.048 9.048 8.443 0.605 18518
5946 1 9 . 1 1 100 100 GLU N N 100 113.894 113.894 116.427 -2.533 18518
5947 1 9 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.678 0.168 18518
5948 1 9 . 1 1 100 100 GLU C C 100 177.989 177.989 179.050 -1.061 18518
5949 1 9 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.626 0.461 18518
5950 1 9 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.918 0.464 18518
5951 1 9 . 1 1 100 100 GLU H H 100 7.422 7.422 8.030 -0.608 18518
5952 1 9 . 1 1 101 101 SER N N 101 108.991 108.991 114.261 -5.270 18518
5953 1 9 . 1 1 101 101 SER HA H 101 4.524 4.524 4.427 0.097 18518
5954 1 9 . 1 1 101 101 SER C C 101 176.628 176.628 175.326 1.302 18518
5955 1 9 . 1 1 101 101 SER CA C 101 60.349 60.349 60.700 -0.351 18518
5956 1 9 . 1 1 101 101 SER CB C 101 64.741 64.741 63.787 0.954 18518
5957 1 9 . 1 1 101 101 SER H H 101 7.424 7.424 7.955 -0.531 18518
5958 1 9 . 1 1 102 102 GLU N N 102 116.533 116.533 119.716 -3.183 18518
5959 1 9 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.544 0.200 18518
5960 1 9 . 1 1 102 102 GLU C C 102 176.774 176.774 176.160 0.614 18518
5961 1 9 . 1 1 102 102 GLU CA C 102 55.581 55.581 54.781 0.800 18518
5962 1 9 . 1 1 102 102 GLU CB C 102 30.697 30.697 30.633 0.064 18518
5963 1 9 . 1 1 102 102 GLU H H 102 8.487 8.487 7.891 0.596 18518
5964 1 9 . 1 1 103 103 LYS N N 103 118.370 118.370 120.395 -2.025 18518
5965 1 9 . 1 1 103 103 LYS HA H 103 4.178 4.178 4.054 0.124 18518
5966 1 9 . 1 1 103 103 LYS C C 103 175.018 175.018 176.660 -1.642 18518
5967 1 9 . 1 1 103 103 LYS CA C 103 57.329 57.329 57.908 -0.579 18518
5968 1 9 . 1 1 103 103 LYS CB C 103 32.186 32.186 32.291 -0.105 18518
5969 1 9 . 1 1 103 103 LYS H H 103 7.831 7.831 7.729 0.102 18518
5970 1 9 . 1 1 104 104 ASP N N 104 123.500 123.500 126.209 -2.709 18518
5971 1 9 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.706 0.049 18518
5972 1 9 . 1 1 104 104 ASP C C 104 177.383 177.383 177.372 0.011 18518
5973 1 9 . 1 1 104 104 ASP CA C 104 53.846 53.846 54.475 -0.629 18518
5974 1 9 . 1 1 104 104 ASP CB C 104 43.411 43.411 43.341 0.070 18518
5975 1 9 . 1 1 104 104 ASP H H 104 9.041 9.041 8.184 0.857 18518
5976 1 9 . 1 1 105 105 GLU N N 105 125.448 125.448 120.888 4.560 18518
5977 1 9 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.216 -0.036 18518
5978 1 9 . 1 1 105 105 GLU C C 105 177.519 177.519 177.149 0.370 18518
5979 1 9 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.568 0.961 18518
5980 1 9 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.692 0.352 18518
5981 1 9 . 1 1 105 105 GLU H H 105 8.906 8.906 8.810 0.096 18518
5982 1 9 . 1 1 106 106 ASP N N 106 118.824 118.824 119.077 -0.253 18518
5983 1 9 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.343 -0.164 18518
5984 1 9 . 1 1 106 106 ASP C C 106 176.223 176.223 176.596 -0.373 18518
5985 1 9 . 1 1 106 106 ASP CA C 106 54.756 54.756 56.584 -1.828 18518
5986 1 9 . 1 1 106 106 ASP CB C 106 39.999 39.999 41.648 -1.649 18518
5987 1 9 . 1 1 106 106 ASP H H 106 10.036 10.036 8.728 1.308 18518
5988 1 9 . 1 1 107 107 GLY N N 107 105.866 105.866 104.602 1.264 18518
5989 1 9 . 1 1 107 107 GLY C C 107 175.136 175.136 174.069 1.067 18518
5990 1 9 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.237 -0.015 18518
5991 1 9 . 1 1 107 107 GLY H H 107 8.001 8.001 7.869 0.132 18518
5992 1 9 . 1 1 108 108 PHE N N 108 123.820 123.820 121.917 1.903 18518
5993 1 9 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.618 0.044 18518
5994 1 9 . 1 1 108 108 PHE C C 108 174.899 174.899 174.423 0.476 18518
5995 1 9 . 1 1 108 108 PHE CA C 108 60.238 60.238 57.664 2.574 18518
5996 1 9 . 1 1 108 108 PHE CB C 108 40.365 40.365 40.165 0.200 18518
5997 1 9 . 1 1 108 108 PHE H H 108 9.912 9.912 7.643 2.269 18518
5998 1 9 . 1 1 109 109 LEU N N 109 120.130 120.130 122.795 -2.665 18518
5999 1 9 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.920 0.110 18518
6000 1 9 . 1 1 109 109 LEU C C 109 173.916 173.916 174.562 -0.646 18518
6001 1 9 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.938 -0.513 18518
6002 1 9 . 1 1 109 109 LEU CB C 109 45.203 45.203 44.844 0.359 18518
6003 1 9 . 1 1 109 109 LEU H H 109 7.997 7.997 8.617 -0.620 18518
6004 1 9 . 1 1 110 110 TYR N N 110 126.579 126.579 124.286 2.293 18518
6005 1 9 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.611 0.392 18518
6006 1 9 . 1 1 110 110 TYR C C 110 176.671 176.671 175.032 1.639 18518
6007 1 9 . 1 1 110 110 TYR CA C 110 59.058 59.058 57.946 1.112 18518
6008 1 9 . 1 1 110 110 TYR CB C 110 39.556 39.556 40.590 -1.034 18518
6009 1 9 . 1 1 110 110 TYR H H 110 9.377 9.377 8.939 0.438 18518
6010 1 9 . 1 1 111 111 MET N N 111 119.240 119.240 121.264 -2.024 18518
6011 1 9 . 1 1 111 111 MET HA H 111 5.486 5.486 5.349 0.137 18518
6012 1 9 . 1 1 111 111 MET C C 111 175.695 175.695 174.458 1.237 18518
6013 1 9 . 1 1 111 111 MET CA C 111 54.124 54.124 54.468 -0.344 18518
6014 1 9 . 1 1 111 111 MET CB C 111 36.960 36.960 37.658 -0.698 18518
6015 1 9 . 1 1 111 111 MET H H 111 9.658 9.658 8.750 0.908 18518
6016 1 9 . 1 1 112 112 VAL N N 112 119.865 119.865 116.714 3.151 18518
6017 1 9 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.590 0.373 18518
6018 1 9 . 1 1 112 112 VAL C C 112 175.058 175.058 174.156 0.902 18518
6019 1 9 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.895 -0.984 18518
6020 1 9 . 1 1 112 112 VAL CB C 112 36.051 36.051 34.978 1.073 18518
6021 1 9 . 1 1 112 112 VAL H H 112 8.794 8.794 9.140 -0.346 18518
6022 1 9 . 1 1 113 113 TYR N N 113 119.664 119.664 120.686 -1.022 18518
6023 1 9 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.819 0.299 18518
6024 1 9 . 1 1 113 113 TYR C C 113 173.375 173.375 173.757 -0.382 18518
6025 1 9 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.153 -1.000 18518
6026 1 9 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.745 1.567 18518
6027 1 9 . 1 1 113 113 TYR H H 113 8.315 8.315 8.588 -0.273 18518
6028 1 9 . 1 1 114 114 ALA N N 114 119.763 119.763 125.292 -5.529 18518
6029 1 9 . 1 1 114 114 ALA HA H 114 4.800 4.800 4.801 -0.001 18518
6030 1 9 . 1 1 114 114 ALA C C 114 176.216 176.216 175.120 1.096 18518
6031 1 9 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.723 -0.591 18518
6032 1 9 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.524 2.072 18518
6033 1 9 . 1 1 114 114 ALA H H 114 8.465 8.465 8.703 -0.238 18518
6034 1 9 . 1 1 115 115 SER N N 115 114.763 114.763 115.405 -0.642 18518
6035 1 9 . 1 1 115 115 SER HA H 115 4.496 4.496 4.772 -0.276 18518
6036 1 9 . 1 1 115 115 SER C C 115 172.671 172.671 174.127 -1.456 18518
6037 1 9 . 1 1 115 115 SER CA C 115 58.651 58.651 58.240 0.410 18518
6038 1 9 . 1 1 115 115 SER CB C 115 63.526 63.526 61.721 1.805 18518
6039 1 9 . 1 1 115 115 SER H H 115 9.915 9.915 8.765 1.150 18518
6040 1 9 . 1 1 116 116 GLN N N 116 116.611 116.611 123.643 -7.032 18518
6041 1 9 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.399 0.085 18518
6042 1 9 . 1 1 116 116 GLN C C 116 172.733 172.733 173.714 -0.981 18518
6043 1 9 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.732 -1.806 18518
6044 1 9 . 1 1 116 116 GLN CB C 116 32.358 32.358 31.453 0.905 18518
6045 1 9 . 1 1 116 116 GLN H H 116 7.219 7.219 7.962 -0.743 18518
6046 1 9 . 1 1 117 117 GLU N N 117 117.623 117.623 121.301 -3.678 18518
6047 1 9 . 1 1 117 117 GLU HA H 117 3.287 3.287 2.406 0.881 18518
6048 1 9 . 1 1 117 117 GLU C C 117 175.168 175.168 175.586 -0.418 18518
6049 1 9 . 1 1 117 117 GLU CA C 117 56.882 56.882 57.683 -0.801 18518
6050 1 9 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.769 0.753 18518
6051 1 9 . 1 1 117 117 GLU H H 117 7.882 7.882 8.341 -0.459 18518
6052 1 9 . 1 1 118 118 THR N N 118 109.820 109.820 109.301 0.519 18518
6053 1 9 . 1 1 118 118 THR HA H 118 4.066 4.066 4.148 -0.082 18518
6054 1 9 . 1 1 118 118 THR C C 118 172.355 172.355 173.243 -0.888 18518
6055 1 9 . 1 1 118 118 THR CA C 118 60.029 60.029 60.267 -0.238 18518
6056 1 9 . 1 1 118 118 THR CB C 118 70.480 70.480 69.626 0.854 18518
6057 1 9 . 1 1 118 118 THR H H 118 6.992 6.992 7.290 -0.298 18518
6058 1 10 . 1 1 2 2 ALA HA H 2 4.336 4.336 4.634 -0.298 18518
6059 1 10 . 1 1 2 2 ALA C C 2 177.974 177.974 176.504 1.470 18518
6060 1 10 . 1 1 2 2 ALA CA C 2 52.785 52.785 52.006 0.779 18518
6061 1 10 . 1 1 2 2 ALA CB C 2 19.444 19.444 19.371 0.073 18518
6062 1 10 . 1 1 3 3 MET N N 3 119.311 119.311 121.900 -2.589 18518
6063 1 10 . 1 1 3 3 MET HA H 3 4.451 4.451 4.490 -0.039 18518
6064 1 10 . 1 1 3 3 MET C C 3 176.913 176.913 175.475 1.438 18518
6065 1 10 . 1 1 3 3 MET CA C 3 55.679 55.679 55.209 0.470 18518
6066 1 10 . 1 1 3 3 MET CB C 3 32.590 32.590 34.663 -2.072 18518
6067 1 10 . 1 1 3 3 MET H H 3 8.638 8.638 8.361 0.277 18518
6068 1 10 . 1 1 4 4 GLY N N 4 110.281 110.281 110.968 -0.687 18518
6069 1 10 . 1 1 4 4 GLY C C 4 174.180 174.180 174.055 0.125 18518
6070 1 10 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.689 0.806 18518
6071 1 10 . 1 1 4 4 GLY H H 4 8.552 8.552 8.314 0.238 18518
6072 1 10 . 1 1 5 5 LYS N N 5 120.818 120.818 125.619 -4.801 18518
6073 1 10 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.266 0.243 18518
6074 1 10 . 1 1 5 5 LYS C C 5 177.605 177.605 177.219 0.386 18518
6075 1 10 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.831 0.303 18518
6076 1 10 . 1 1 5 5 LYS CB C 5 34.813 34.813 32.266 2.547 18518
6077 1 10 . 1 1 5 5 LYS H H 5 8.133 8.133 8.183 -0.050 18518
6078 1 10 . 1 1 6 6 THR N N 6 114.781 114.781 114.951 -0.170 18518
6079 1 10 . 1 1 6 6 THR HA H 6 4.421 4.421 4.307 0.114 18518
6080 1 10 . 1 1 6 6 THR C C 6 175.524 175.524 175.918 -0.394 18518
6081 1 10 . 1 1 6 6 THR CA C 6 61.127 61.127 61.753 -0.626 18518
6082 1 10 . 1 1 6 6 THR CB C 6 69.926 69.926 69.923 0.003 18518
6083 1 10 . 1 1 6 6 THR H H 6 8.483 8.483 8.189 0.294 18518
6084 1 10 . 1 1 7 7 PHE N N 7 125.552 125.552 120.071 5.481 18518
6085 1 10 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.105 -0.100 18518
6086 1 10 . 1 1 7 7 PHE C C 7 177.397 177.397 176.930 0.467 18518
6087 1 10 . 1 1 7 7 PHE CA C 7 63.393 63.393 60.935 2.458 18518
6088 1 10 . 1 1 7 7 PHE CB C 7 39.567 39.567 37.880 1.687 18518
6089 1 10 . 1 1 7 7 PHE H H 7 10.245 10.245 8.954 1.291 18518
6090 1 10 . 1 1 8 8 LYS N N 8 114.053 114.053 116.632 -2.579 18518
6091 1 10 . 1 1 8 8 LYS HA H 8 3.835 3.835 4.065 -0.230 18518
6092 1 10 . 1 1 8 8 LYS C C 8 175.520 175.520 178.452 -2.932 18518
6093 1 10 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.436 1.557 18518
6094 1 10 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.089 2.600 18518
6095 1 10 . 1 1 8 8 LYS H H 8 8.775 8.775 7.640 1.135 18518
6096 1 10 . 1 1 9 9 GLN N N 9 113.516 113.516 119.633 -6.117 18518
6097 1 10 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.215 -0.066 18518
6098 1 10 . 1 1 9 9 GLN C C 9 177.615 177.615 178.349 -0.734 18518
6099 1 10 . 1 1 9 9 GLN CA C 9 56.819 56.819 58.079 -1.260 18518
6100 1 10 . 1 1 9 9 GLN CB C 9 30.019 30.019 28.804 1.215 18518
6101 1 10 . 1 1 9 9 GLN H H 9 7.355 7.355 7.625 -0.270 18518
6102 1 10 . 1 1 10 10 ARG N N 10 118.294 118.294 117.761 0.533 18518
6103 1 10 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.241 0.061 18518
6104 1 10 . 1 1 10 10 ARG C C 10 179.380 179.380 176.965 2.415 18518
6105 1 10 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.269 -0.001 18518
6106 1 10 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.828 0.814 18518
6107 1 10 . 1 1 10 10 ARG H H 10 7.936 7.936 7.976 -0.040 18518
6108 1 10 . 1 1 11 11 ARG N N 11 121.137 121.137 119.385 1.752 18518
6109 1 10 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.628 0.052 18518
6110 1 10 . 1 1 11 11 ARG CA C 11 53.453 53.453 53.840 -0.388 18518
6111 1 10 . 1 1 11 11 ARG CB C 11 32.938 32.938 31.863 1.075 18518
6112 1 10 . 1 1 11 11 ARG H H 11 7.390 7.390 7.574 -0.184 18518
6113 1 10 . 1 1 12 12 THR N N 12 116.819 116.819 119.579 -2.760 18518
6114 1 10 . 1 1 12 12 THR HA H 12 4.359 4.359 4.291 0.068 18518
6115 1 10 . 1 1 12 12 THR C C 12 174.989 174.989 176.044 -1.055 18518
6116 1 10 . 1 1 12 12 THR CA C 12 61.748 61.748 63.018 -1.270 18518
6117 1 10 . 1 1 12 12 THR CB C 12 71.068 71.068 70.016 1.052 18518
6118 1 10 . 1 1 12 12 THR H H 12 8.953 8.953 8.691 0.262 18518
6119 1 10 . 1 1 13 13 PHE N N 13 123.200 123.200 123.232 -0.032 18518
6120 1 10 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.236 -0.208 18518
6121 1 10 . 1 1 13 13 PHE C C 13 176.029 176.029 177.135 -1.106 18518
6122 1 10 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.486 0.378 18518
6123 1 10 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.481 0.079 18518
6124 1 10 . 1 1 13 13 PHE H H 13 9.284 9.284 8.966 0.318 18518
6125 1 10 . 1 1 14 14 GLU N N 14 115.414 115.414 118.380 -2.966 18518
6126 1 10 . 1 1 14 14 GLU HA H 14 3.794 3.794 3.950 -0.156 18518
6127 1 10 . 1 1 14 14 GLU C C 14 180.081 180.081 178.593 1.488 18518
6128 1 10 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.613 1.006 18518
6129 1 10 . 1 1 14 14 GLU CB C 14 28.852 28.852 29.071 -0.219 18518
6130 1 10 . 1 1 14 14 GLU H H 14 8.973 8.973 8.687 0.286 18518
6131 1 10 . 1 1 15 15 GLN N N 15 119.276 119.276 118.753 0.523 18518
6132 1 10 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.231 -0.231 18518
6133 1 10 . 1 1 15 15 GLN C C 15 177.978 177.978 178.571 -0.593 18518
6134 1 10 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.636 0.198 18518
6135 1 10 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.008 1.362 18518
6136 1 10 . 1 1 15 15 GLN H H 15 7.756 7.756 8.609 -0.853 18518
6137 1 10 . 1 1 16 16 ARG N N 16 121.336 121.336 119.940 1.396 18518
6138 1 10 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.166 0.104 18518
6139 1 10 . 1 1 16 16 ARG C C 16 177.416 177.416 178.603 -1.187 18518
6140 1 10 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.552 1.823 18518
6141 1 10 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.277 0.328 18518
6142 1 10 . 1 1 16 16 ARG H H 16 8.645 8.645 7.750 0.895 18518
6143 1 10 . 1 1 17 17 VAL N N 17 117.630 117.630 121.510 -3.880 18518
6144 1 10 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.670 0.187 18518
6145 1 10 . 1 1 17 17 VAL C C 17 179.748 179.748 177.171 2.577 18518
6146 1 10 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.734 -0.008 18518
6147 1 10 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.757 0.437 18518
6148 1 10 . 1 1 17 17 VAL H H 17 8.373 8.373 7.911 0.462 18518
6149 1 10 . 1 1 18 18 GLU N N 18 120.864 120.864 119.355 1.509 18518
6150 1 10 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.940 0.362 18518
6151 1 10 . 1 1 18 18 GLU C C 18 177.728 177.728 178.719 -0.991 18518
6152 1 10 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.835 -1.349 18518
6153 1 10 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.219 0.163 18518
6154 1 10 . 1 1 18 18 GLU H H 18 7.368 7.368 8.531 -1.163 18518
6155 1 10 . 1 1 19 19 ASP N N 19 121.425 121.425 120.699 0.726 18518
6156 1 10 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.503 -0.069 18518
6157 1 10 . 1 1 19 19 ASP C C 19 179.978 179.978 178.208 1.770 18518
6158 1 10 . 1 1 19 19 ASP CA C 19 57.422 57.422 56.905 0.517 18518
6159 1 10 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.689 0.598 18518
6160 1 10 . 1 1 19 19 ASP H H 19 8.671 8.671 7.809 0.862 18518
6161 1 10 . 1 1 20 20 VAL N N 20 119.730 119.730 120.554 -0.824 18518
6162 1 10 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.301 -0.096 18518
6163 1 10 . 1 1 20 20 VAL C C 20 176.284 176.284 177.937 -1.653 18518
6164 1 10 . 1 1 20 20 VAL CA C 20 66.315 66.315 66.955 -0.640 18518
6165 1 10 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.605 -0.498 18518
6166 1 10 . 1 1 20 20 VAL H H 20 7.999 7.999 8.067 -0.068 18518
6167 1 10 . 1 1 21 21 ARG N N 21 121.455 121.455 119.643 1.812 18518
6168 1 10 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.953 -0.139 18518
6169 1 10 . 1 1 21 21 ARG C C 21 180.120 180.120 178.431 1.689 18518
6170 1 10 . 1 1 21 21 ARG CA C 21 59.830 59.830 59.031 0.799 18518
6171 1 10 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.291 0.654 18518
6172 1 10 . 1 1 21 21 ARG H H 21 8.098 8.098 8.379 -0.281 18518
6173 1 10 . 1 1 22 22 LEU N N 22 117.826 117.826 121.576 -3.750 18518
6174 1 10 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.085 -0.036 18518
6175 1 10 . 1 1 22 22 LEU C C 22 180.115 180.115 178.240 1.875 18518
6176 1 10 . 1 1 22 22 LEU CA C 22 57.790 57.790 57.834 -0.044 18518
6177 1 10 . 1 1 22 22 LEU CB C 22 42.142 42.142 42.048 0.094 18518
6178 1 10 . 1 1 22 22 LEU H H 22 8.207 8.207 7.745 0.462 18518
6179 1 10 . 1 1 23 23 ILE N N 23 121.450 121.450 119.241 2.209 18518
6180 1 10 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.655 0.358 18518
6181 1 10 . 1 1 23 23 ILE C C 23 178.149 178.149 178.286 -0.137 18518
6182 1 10 . 1 1 23 23 ILE CA C 23 62.171 62.171 63.877 -1.706 18518
6183 1 10 . 1 1 23 23 ILE CB C 23 38.106 38.106 36.435 1.671 18518
6184 1 10 . 1 1 23 23 ILE H H 23 8.105 8.105 8.215 -0.110 18518
6185 1 10 . 1 1 24 24 ARG N N 24 121.139 121.139 118.608 2.531 18518
6186 1 10 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.020 -0.033 18518
6187 1 10 . 1 1 24 24 ARG C C 24 178.702 178.702 179.053 -0.351 18518
6188 1 10 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.817 -1.099 18518
6189 1 10 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.566 -0.797 18518
6190 1 10 . 1 1 24 24 ARG H H 24 8.601 8.601 8.480 0.121 18518
6191 1 10 . 1 1 25 25 GLU N N 25 118.054 118.054 119.128 -1.074 18518
6192 1 10 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.101 -0.075 18518
6193 1 10 . 1 1 25 25 GLU C C 25 178.492 178.492 178.095 0.397 18518
6194 1 10 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.383 0.397 18518
6195 1 10 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.709 0.292 18518
6196 1 10 . 1 1 25 25 GLU H H 25 7.423 7.423 7.814 -0.391 18518
6197 1 10 . 1 1 26 26 GLN N N 26 116.350 116.350 116.886 -0.536 18518
6198 1 10 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.070 -0.134 18518
6199 1 10 . 1 1 26 26 GLN C C 26 176.305 176.305 177.021 -0.716 18518
6200 1 10 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.474 0.029 18518
6201 1 10 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.442 0.765 18518
6202 1 10 . 1 1 26 26 GLN H H 26 7.524 7.524 7.933 -0.409 18518
6203 1 10 . 1 1 27 27 HIS N N 27 116.017 116.017 118.417 -2.400 18518
6204 1 10 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.020 -0.090 18518
6205 1 10 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.940 0.114 18518
6206 1 10 . 1 1 27 27 HIS CB C 27 30.747 30.747 29.963 0.784 18518
6207 1 10 . 1 1 27 27 HIS H H 27 8.284 8.284 8.235 0.049 18518
6208 1 10 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.535 0.046 18518
6209 1 10 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.612 0.306 18518
6210 1 10 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.167 0.288 18518
6211 1 10 . 1 1 29 29 THR N N 29 107.011 107.011 107.356 -0.345 18518
6212 1 10 . 1 1 29 29 THR HA H 29 4.599 4.599 4.377 0.222 18518
6213 1 10 . 1 1 29 29 THR C C 29 172.884 172.884 173.731 -0.847 18518
6214 1 10 . 1 1 29 29 THR CA C 29 60.810 60.810 61.736 -0.926 18518
6215 1 10 . 1 1 29 29 THR CB C 29 68.531 68.531 68.288 0.243 18518
6216 1 10 . 1 1 29 29 THR H H 29 7.890 7.890 8.408 -0.518 18518
6217 1 10 . 1 1 30 30 LYS N N 30 117.679 117.679 121.234 -3.555 18518
6218 1 10 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.890 -0.032 18518
6219 1 10 . 1 1 30 30 LYS C C 30 174.310 174.310 174.457 -0.147 18518
6220 1 10 . 1 1 30 30 LYS CA C 30 53.751 53.751 53.889 -0.138 18518
6221 1 10 . 1 1 30 30 LYS CB C 30 35.804 35.804 35.838 -0.034 18518
6222 1 10 . 1 1 30 30 LYS H H 30 7.441 7.441 7.607 -0.166 18518
6223 1 10 . 1 1 31 31 ILE N N 31 122.849 122.849 121.889 0.960 18518
6224 1 10 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.302 -0.197 18518
6225 1 10 . 1 1 31 31 ILE CA C 31 54.801 54.801 55.792 -0.991 18518
6226 1 10 . 1 1 31 31 ILE CB C 31 38.265 38.265 38.731 -0.466 18518
6227 1 10 . 1 1 31 31 ILE H H 31 9.304 9.304 8.737 0.567 18518
6228 1 10 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.761 0.398 18518
6229 1 10 . 1 1 32 32 PRO C C 32 174.164 174.164 175.553 -1.389 18518
6230 1 10 . 1 1 32 32 PRO CA C 32 61.503 61.503 61.913 -0.410 18518
6231 1 10 . 1 1 32 32 PRO CB C 32 31.145 31.145 30.453 0.692 18518
6232 1 10 . 1 1 33 33 VAL N N 33 125.606 125.606 126.050 -0.444 18518
6233 1 10 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.173 0.040 18518
6234 1 10 . 1 1 33 33 VAL C C 33 173.654 173.654 174.024 -0.370 18518
6235 1 10 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.248 0.796 18518
6236 1 10 . 1 1 33 33 VAL CB C 33 35.604 35.604 36.208 -0.604 18518
6237 1 10 . 1 1 33 33 VAL H H 33 9.424 9.424 8.820 0.604 18518
6238 1 10 . 1 1 34 34 ILE N N 34 128.241 128.241 127.376 0.865 18518
6239 1 10 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.676 0.157 18518
6240 1 10 . 1 1 34 34 ILE C C 34 175.605 175.605 174.679 0.926 18518
6241 1 10 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.641 -1.876 18518
6242 1 10 . 1 1 34 34 ILE CB C 34 36.799 36.799 38.752 -1.953 18518
6243 1 10 . 1 1 34 34 ILE H H 34 8.721 8.721 8.957 -0.236 18518
6244 1 10 . 1 1 35 35 ILE N N 35 125.650 125.650 128.467 -2.817 18518
6245 1 10 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.719 0.117 18518
6246 1 10 . 1 1 35 35 ILE C C 35 174.887 174.887 174.442 0.445 18518
6247 1 10 . 1 1 35 35 ILE CA C 35 60.945 60.945 59.083 1.862 18518
6248 1 10 . 1 1 35 35 ILE CB C 35 39.210 39.210 37.835 1.375 18518
6249 1 10 . 1 1 35 35 ILE H H 35 9.034 9.034 9.253 -0.219 18518
6250 1 10 . 1 1 36 36 GLU N N 36 122.657 122.657 127.292 -4.635 18518
6251 1 10 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.932 -0.071 18518
6252 1 10 . 1 1 36 36 GLU C C 36 173.848 173.848 174.789 -0.941 18518
6253 1 10 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.370 -0.438 18518
6254 1 10 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.441 0.841 18518
6255 1 10 . 1 1 36 36 GLU H H 36 8.303 8.303 8.633 -0.330 18518
6256 1 10 . 1 1 37 37 ARG N N 37 123.228 123.228 126.867 -3.639 18518
6257 1 10 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.784 -1.058 18518
6258 1 10 . 1 1 37 37 ARG C C 37 176.359 176.359 175.813 0.546 18518
6259 1 10 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.774 -0.415 18518
6260 1 10 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.681 0.660 18518
6261 1 10 . 1 1 37 37 ARG H H 37 8.856 8.856 8.802 0.054 18518
6262 1 10 . 1 1 38 38 TYR N N 38 128.981 128.981 127.923 1.058 18518
6263 1 10 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.331 0.021 18518
6264 1 10 . 1 1 38 38 TYR C C 38 177.316 177.316 176.519 0.797 18518
6265 1 10 . 1 1 38 38 TYR CA C 38 57.712 57.712 58.084 -0.371 18518
6266 1 10 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.307 -0.835 18518
6267 1 10 . 1 1 38 38 TYR H H 38 8.628 8.628 8.320 0.308 18518
6268 1 10 . 1 1 39 39 LYS N N 39 130.635 130.635 123.935 6.700 18518
6269 1 10 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.791 0.031 18518
6270 1 10 . 1 1 39 39 LYS CA C 39 58.887 58.887 58.491 0.396 18518
6271 1 10 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.924 -0.153 18518
6272 1 10 . 1 1 39 39 LYS H H 39 8.594 8.594 7.698 0.896 18518
6273 1 10 . 1 1 40 40 GLY C C 40 173.447 173.447 173.534 -0.087 18518
6274 1 10 . 1 1 40 40 GLY CA C 40 44.663 44.663 44.035 0.628 18518
6275 1 10 . 1 1 40 40 GLY H H 40 5.188 5.188 6.807 -1.619 18518
6276 1 10 . 1 1 41 41 GLU N N 41 122.836 122.836 121.136 1.700 18518
6277 1 10 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.339 -0.082 18518
6278 1 10 . 1 1 41 41 GLU C C 41 176.524 176.524 175.816 0.708 18518
6279 1 10 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.985 -0.460 18518
6280 1 10 . 1 1 41 41 GLU CB C 41 30.985 30.985 28.790 2.195 18518
6281 1 10 . 1 1 41 41 GLU H H 41 7.380 7.380 7.286 0.094 18518
6282 1 10 . 1 1 42 42 LYS N N 42 124.040 124.040 124.684 -0.644 18518
6283 1 10 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.432 0.243 18518
6284 1 10 . 1 1 42 42 LYS C C 42 177.538 177.538 177.030 0.508 18518
6285 1 10 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.649 -0.809 18518
6286 1 10 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.195 1.784 18518
6287 1 10 . 1 1 42 42 LYS H H 42 9.034 9.034 8.285 0.749 18518
6288 1 10 . 1 1 43 43 GLN N N 43 119.259 119.259 118.869 0.390 18518
6289 1 10 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.408 0.134 18518
6290 1 10 . 1 1 43 43 GLN C C 43 177.336 177.336 176.043 1.293 18518
6291 1 10 . 1 1 43 43 GLN CA C 43 57.673 57.673 56.363 1.310 18518
6292 1 10 . 1 1 43 43 GLN CB C 43 30.782 30.782 28.811 1.971 18518
6293 1 10 . 1 1 43 43 GLN H H 43 8.435 8.435 8.416 0.019 18518
6294 1 10 . 1 1 44 44 LEU N N 44 120.760 120.760 123.068 -2.308 18518
6295 1 10 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.777 -0.082 18518
6296 1 10 . 1 1 44 44 LEU CA C 44 53.245 53.245 51.951 1.294 18518
6297 1 10 . 1 1 44 44 LEU CB C 44 43.596 43.596 42.208 1.388 18518
6298 1 10 . 1 1 44 44 LEU H H 44 9.126 9.126 7.673 1.453 18518
6299 1 10 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.580 0.137 18518
6300 1 10 . 1 1 45 45 PRO C C 45 175.797 175.797 176.182 -0.385 18518
6301 1 10 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.264 -0.153 18518
6302 1 10 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.344 0.248 18518
6303 1 10 . 1 1 46 46 VAL N N 46 119.052 119.052 120.123 -1.071 18518
6304 1 10 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.516 -0.649 18518
6305 1 10 . 1 1 46 46 VAL C C 46 175.640 175.640 176.810 -1.170 18518
6306 1 10 . 1 1 46 46 VAL CA C 46 62.944 62.944 62.263 0.681 18518
6307 1 10 . 1 1 46 46 VAL CB C 46 32.799 32.799 32.599 0.200 18518
6308 1 10 . 1 1 46 46 VAL H H 46 8.543 8.543 8.260 0.283 18518
6309 1 10 . 1 1 47 47 LEU N N 47 130.203 130.203 125.309 4.894 18518
6310 1 10 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.454 -0.145 18518
6311 1 10 . 1 1 47 47 LEU C C 47 176.198 176.198 177.142 -0.944 18518
6312 1 10 . 1 1 47 47 LEU CA C 47 55.006 55.006 54.818 0.188 18518
6313 1 10 . 1 1 47 47 LEU CB C 47 43.832 43.832 43.339 0.493 18518
6314 1 10 . 1 1 47 47 LEU H H 47 7.799 7.799 8.332 -0.533 18518
6315 1 10 . 1 1 48 48 ASP N N 48 122.403 122.403 122.629 -0.226 18518
6316 1 10 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.564 -0.301 18518
6317 1 10 . 1 1 48 48 ASP C C 48 175.294 175.294 175.775 -0.481 18518
6318 1 10 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.233 0.600 18518
6319 1 10 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.292 -1.109 18518
6320 1 10 . 1 1 48 48 ASP H H 48 8.780 8.780 8.498 0.282 18518
6321 1 10 . 1 1 49 49 LYS N N 49 119.569 119.569 117.675 1.894 18518
6322 1 10 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.522 0.063 18518
6323 1 10 . 1 1 49 49 LYS C C 49 174.678 174.678 175.946 -1.268 18518
6324 1 10 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.012 -1.360 18518
6325 1 10 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.797 1.148 18518
6326 1 10 . 1 1 49 49 LYS H H 49 7.280 7.280 7.557 -0.277 18518
6327 1 10 . 1 1 50 50 THR N N 50 110.862 110.862 114.807 -3.945 18518
6328 1 10 . 1 1 50 50 THR HA H 50 4.811 4.811 4.886 -0.075 18518
6329 1 10 . 1 1 50 50 THR C C 50 172.425 172.425 174.375 -1.950 18518
6330 1 10 . 1 1 50 50 THR CA C 50 62.645 62.645 63.168 -0.523 18518
6331 1 10 . 1 1 50 50 THR CB C 50 71.648 71.648 70.876 0.772 18518
6332 1 10 . 1 1 50 50 THR H H 50 8.042 8.042 8.240 -0.198 18518
6333 1 10 . 1 1 51 51 LYS N N 51 120.008 120.008 123.028 -3.020 18518
6334 1 10 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.617 0.008 18518
6335 1 10 . 1 1 51 51 LYS C C 51 175.082 175.082 176.184 -1.102 18518
6336 1 10 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.883 -2.179 18518
6337 1 10 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.110 -0.734 18518
6338 1 10 . 1 1 51 51 LYS H H 51 7.119 7.119 7.769 -0.650 18518
6339 1 10 . 1 1 52 52 PHE N N 52 122.640 122.640 123.770 -1.130 18518
6340 1 10 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.676 0.661 18518
6341 1 10 . 1 1 52 52 PHE C C 52 174.213 174.213 174.178 0.035 18518
6342 1 10 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.981 -0.370 18518
6343 1 10 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.393 -0.253 18518
6344 1 10 . 1 1 52 52 PHE H H 52 9.709 9.709 9.394 0.315 18518
6345 1 10 . 1 1 53 53 LEU N N 53 122.157 122.157 123.466 -1.309 18518
6346 1 10 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.890 0.057 18518
6347 1 10 . 1 1 53 53 LEU C C 53 175.769 175.769 175.846 -0.077 18518
6348 1 10 . 1 1 53 53 LEU CA C 53 52.957 52.957 54.087 -1.130 18518
6349 1 10 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.114 1.301 18518
6350 1 10 . 1 1 53 53 LEU H H 53 8.959 8.959 8.512 0.447 18518
6351 1 10 . 1 1 54 54 VAL N N 54 124.919 124.919 127.057 -2.138 18518
6352 1 10 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.550 0.009 18518
6353 1 10 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.642 0.488 18518
6354 1 10 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.832 1.136 18518
6355 1 10 . 1 1 54 54 VAL H H 54 8.922 8.922 8.453 0.469 18518
6356 1 10 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.776 -0.335 18518
6357 1 10 . 1 1 55 55 PRO C C 55 176.594 176.594 177.884 -1.290 18518
6358 1 10 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.161 2.154 18518
6359 1 10 . 1 1 55 55 PRO CB C 55 32.665 32.665 31.771 0.894 18518
6360 1 10 . 1 1 56 56 ASP N N 56 120.522 120.522 123.350 -2.828 18518
6361 1 10 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.198 -0.336 18518
6362 1 10 . 1 1 56 56 ASP C C 56 175.809 175.809 176.533 -0.724 18518
6363 1 10 . 1 1 56 56 ASP CA C 56 56.749 56.749 56.985 -0.236 18518
6364 1 10 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.425 0.085 18518
6365 1 10 . 1 1 56 56 ASP H H 56 8.347 8.347 8.282 0.065 18518
6366 1 10 . 1 1 57 57 HIS N N 57 113.482 113.482 113.071 0.411 18518
6367 1 10 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.662 0.058 18518
6368 1 10 . 1 1 57 57 HIS C C 57 176.507 176.507 175.501 1.006 18518
6369 1 10 . 1 1 57 57 HIS CA C 57 55.589 55.589 55.706 -0.117 18518
6370 1 10 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.705 0.938 18518
6371 1 10 . 1 1 57 57 HIS H H 57 7.557 7.557 7.803 -0.246 18518
6372 1 10 . 1 1 58 58 VAL N N 58 123.279 123.279 121.066 2.213 18518
6373 1 10 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.180 -0.344 18518
6374 1 10 . 1 1 58 58 VAL C C 58 175.019 175.019 174.981 0.038 18518
6375 1 10 . 1 1 58 58 VAL CA C 58 62.823 62.823 60.935 1.888 18518
6376 1 10 . 1 1 58 58 VAL CB C 58 32.310 32.310 33.861 -1.551 18518
6377 1 10 . 1 1 58 58 VAL H H 58 7.345 7.345 7.555 -0.210 18518
6378 1 10 . 1 1 59 59 ASN N N 59 123.781 123.781 118.525 5.256 18518
6379 1 10 . 1 1 59 59 ASN HA H 59 5.126 5.126 4.962 0.164 18518
6380 1 10 . 1 1 59 59 ASN C C 59 176.558 176.558 176.309 0.249 18518
6381 1 10 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.701 -0.216 18518
6382 1 10 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.943 -0.836 18518
6383 1 10 . 1 1 59 59 ASN H H 59 8.735 8.735 8.332 0.403 18518
6384 1 10 . 1 1 60 60 MET N N 60 117.453 117.453 118.069 -0.616 18518
6385 1 10 . 1 1 60 60 MET HA H 60 4.395 4.395 4.200 0.195 18518
6386 1 10 . 1 1 60 60 MET C C 60 178.144 178.144 178.068 0.076 18518
6387 1 10 . 1 1 60 60 MET CA C 60 57.097 57.097 57.235 -0.138 18518
6388 1 10 . 1 1 60 60 MET CB C 60 30.140 30.140 30.912 -0.772 18518
6389 1 10 . 1 1 60 60 MET H H 60 8.227 8.227 9.064 -0.837 18518
6390 1 10 . 1 1 61 61 SER N N 61 114.216 114.216 116.513 -2.297 18518
6391 1 10 . 1 1 61 61 SER HA H 61 4.111 4.111 4.101 0.010 18518
6392 1 10 . 1 1 61 61 SER C C 61 177.335 177.335 177.125 0.210 18518
6393 1 10 . 1 1 61 61 SER CA C 61 61.590 61.590 62.458 -0.868 18518
6394 1 10 . 1 1 61 61 SER CB C 61 62.402 62.402 62.547 -0.145 18518
6395 1 10 . 1 1 61 61 SER H H 61 8.464 8.464 8.084 0.380 18518
6396 1 10 . 1 1 62 62 GLU N N 62 123.004 123.004 120.515 2.489 18518
6397 1 10 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.159 -0.112 18518
6398 1 10 . 1 1 62 62 GLU C C 62 178.686 178.686 178.817 -0.131 18518
6399 1 10 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.490 0.135 18518
6400 1 10 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.252 0.402 18518
6401 1 10 . 1 1 62 62 GLU H H 62 7.994 7.994 7.653 0.341 18518
6402 1 10 . 1 1 63 63 LEU N N 63 120.818 120.818 122.002 -1.184 18518
6403 1 10 . 1 1 63 63 LEU HA H 63 3.965 3.965 4.005 -0.040 18518
6404 1 10 . 1 1 63 63 LEU C C 63 178.046 178.046 178.814 -0.768 18518
6405 1 10 . 1 1 63 63 LEU CA C 63 57.920 57.920 58.049 -0.129 18518
6406 1 10 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.317 0.307 18518
6407 1 10 . 1 1 63 63 LEU H H 63 8.130 8.130 7.802 0.328 18518
6408 1 10 . 1 1 64 64 ILE N N 64 118.528 118.528 119.688 -1.160 18518
6409 1 10 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.626 -0.257 18518
6410 1 10 . 1 1 64 64 ILE C C 64 177.127 177.127 177.709 -0.582 18518
6411 1 10 . 1 1 64 64 ILE CA C 64 66.678 66.678 65.883 0.795 18518
6412 1 10 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.713 0.731 18518
6413 1 10 . 1 1 64 64 ILE H H 64 8.488 8.488 8.705 -0.217 18518
6414 1 10 . 1 1 65 65 LYS N N 65 118.336 118.336 120.933 -2.597 18518
6415 1 10 . 1 1 65 65 LYS HA H 65 3.701 3.701 3.959 -0.258 18518
6416 1 10 . 1 1 65 65 LYS C C 65 179.291 179.291 179.189 0.102 18518
6417 1 10 . 1 1 65 65 LYS CA C 65 60.440 60.440 60.049 0.391 18518
6418 1 10 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.382 -0.011 18518
6419 1 10 . 1 1 65 65 LYS H H 65 7.347 7.347 7.638 -0.291 18518
6420 1 10 . 1 1 66 66 ILE N N 66 120.171 120.171 120.086 0.085 18518
6421 1 10 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.708 -0.130 18518
6422 1 10 . 1 1 66 66 ILE C C 66 178.873 178.873 178.141 0.732 18518
6423 1 10 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.318 -0.158 18518
6424 1 10 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.799 0.834 18518
6425 1 10 . 1 1 66 66 ILE H H 66 7.901 7.901 8.465 -0.564 18518
6426 1 10 . 1 1 67 67 ILE N N 67 121.185 121.185 120.656 0.529 18518
6427 1 10 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.529 -0.083 18518
6428 1 10 . 1 1 67 67 ILE C C 67 177.150 177.150 177.828 -0.678 18518
6429 1 10 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.763 -1.957 18518
6430 1 10 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.337 -2.342 18518
6431 1 10 . 1 1 67 67 ILE H H 67 8.290 8.290 7.995 0.295 18518
6432 1 10 . 1 1 68 68 ARG N N 68 119.173 119.173 118.699 0.474 18518
6433 1 10 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.784 -0.853 18518
6434 1 10 . 1 1 68 68 ARG C C 68 178.496 178.496 178.916 -0.420 18518
6435 1 10 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.630 1.006 18518
6436 1 10 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.845 0.596 18518
6437 1 10 . 1 1 68 68 ARG H H 68 8.438 8.438 8.423 0.015 18518
6438 1 10 . 1 1 69 69 ARG N N 69 116.511 116.511 120.036 -3.525 18518
6439 1 10 . 1 1 69 69 ARG HA H 69 4.134 4.134 4.024 0.110 18518
6440 1 10 . 1 1 69 69 ARG C C 69 180.262 180.262 178.544 1.718 18518
6441 1 10 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.063 -0.356 18518
6442 1 10 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.191 -0.238 18518
6443 1 10 . 1 1 69 69 ARG H H 69 7.497 7.497 8.258 -0.761 18518
6444 1 10 . 1 1 70 70 ARG N N 70 123.297 123.297 117.808 5.489 18518
6445 1 10 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.134 -0.118 18518
6446 1 10 . 1 1 70 70 ARG C C 70 178.700 178.700 178.355 0.345 18518
6447 1 10 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.461 0.999 18518
6448 1 10 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.987 0.325 18518
6449 1 10 . 1 1 70 70 ARG H H 70 8.075 8.075 8.072 0.003 18518
6450 1 10 . 1 1 71 71 LEU N N 71 116.829 116.829 119.941 -3.112 18518
6451 1 10 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.228 -0.163 18518
6452 1 10 . 1 1 71 71 LEU C C 71 174.956 174.956 175.960 -1.004 18518
6453 1 10 . 1 1 71 71 LEU CA C 71 55.126 55.126 55.523 -0.397 18518
6454 1 10 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.845 0.401 18518
6455 1 10 . 1 1 71 71 LEU H H 71 7.719 7.719 8.157 -0.438 18518
6456 1 10 . 1 1 72 72 GLN N N 72 114.991 114.991 114.716 0.275 18518
6457 1 10 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.884 -0.048 18518
6458 1 10 . 1 1 72 72 GLN C C 72 175.683 175.683 175.080 0.603 18518
6459 1 10 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.061 0.264 18518
6460 1 10 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.383 0.621 18518
6461 1 10 . 1 1 72 72 GLN H H 72 7.744 7.744 7.553 0.191 18518
6462 1 10 . 1 1 73 73 LEU N N 73 115.045 115.045 119.415 -4.370 18518
6463 1 10 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.042 0.194 18518
6464 1 10 . 1 1 73 73 LEU C C 73 178.762 178.762 176.854 1.908 18518
6465 1 10 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.520 -1.133 18518
6466 1 10 . 1 1 73 73 LEU CB C 73 42.091 42.091 42.334 -0.243 18518
6467 1 10 . 1 1 73 73 LEU H H 73 7.500 7.500 7.473 0.027 18518
6468 1 10 . 1 1 74 74 ASN N N 74 121.700 121.700 123.378 -1.678 18518
6469 1 10 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.550 0.140 18518
6470 1 10 . 1 1 74 74 ASN C C 74 176.617 176.617 176.311 0.306 18518
6471 1 10 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.900 -1.214 18518
6472 1 10 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.599 -0.001 18518
6473 1 10 . 1 1 74 74 ASN H H 74 9.045 9.045 8.611 0.434 18518
6474 1 10 . 1 1 75 75 ALA N N 75 123.952 123.952 124.125 -0.173 18518
6475 1 10 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.273 -0.309 18518
6476 1 10 . 1 1 75 75 ALA C C 75 178.131 178.131 177.644 0.487 18518
6477 1 10 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.981 0.887 18518
6478 1 10 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.146 -0.428 18518
6479 1 10 . 1 1 75 75 ALA H H 75 8.784 8.784 8.473 0.311 18518
6480 1 10 . 1 1 76 76 ASN N N 76 112.295 112.295 116.053 -3.758 18518
6481 1 10 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.648 -0.068 18518
6482 1 10 . 1 1 76 76 ASN C C 76 175.448 175.448 175.270 0.178 18518
6483 1 10 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.478 -0.264 18518
6484 1 10 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.657 -0.337 18518
6485 1 10 . 1 1 76 76 ASN H H 76 8.391 8.391 8.453 -0.062 18518
6486 1 10 . 1 1 77 77 GLN N N 77 120.577 120.577 119.306 1.271 18518
6487 1 10 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.562 -0.289 18518
6488 1 10 . 1 1 77 77 GLN C C 77 175.045 175.045 173.592 1.453 18518
6489 1 10 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.806 0.999 18518
6490 1 10 . 1 1 77 77 GLN CB C 77 30.157 30.157 31.503 -1.346 18518
6491 1 10 . 1 1 77 77 GLN H H 77 7.552 7.552 7.442 0.110 18518
6492 1 10 . 1 1 78 78 ALA N N 78 130.670 130.670 123.718 6.952 18518
6493 1 10 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.547 -0.376 18518
6494 1 10 . 1 1 78 78 ALA C C 78 176.512 176.512 175.806 0.706 18518
6495 1 10 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.528 1.314 18518
6496 1 10 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.013 -0.953 18518
6497 1 10 . 1 1 78 78 ALA H H 78 8.799 8.799 8.495 0.304 18518
6498 1 10 . 1 1 79 79 PHE N N 79 119.325 119.325 116.024 3.301 18518
6499 1 10 . 1 1 79 79 PHE HA H 79 4.434 4.434 4.798 -0.364 18518
6500 1 10 . 1 1 79 79 PHE C C 79 171.726 171.726 172.886 -1.160 18518
6501 1 10 . 1 1 79 79 PHE CA C 79 59.145 59.145 55.810 3.335 18518
6502 1 10 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.055 1.116 18518
6503 1 10 . 1 1 79 79 PHE H H 79 7.664 7.664 8.125 -0.461 18518
6504 1 10 . 1 1 80 80 PHE N N 80 126.314 126.314 118.272 8.042 18518
6505 1 10 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.285 0.107 18518
6506 1 10 . 1 1 80 80 PHE C C 80 177.169 177.169 173.205 3.964 18518
6507 1 10 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.427 0.226 18518
6508 1 10 . 1 1 80 80 PHE CB C 80 41.933 41.933 42.739 -0.806 18518
6509 1 10 . 1 1 80 80 PHE H H 80 8.508 8.508 8.538 -0.030 18518
6510 1 10 . 1 1 81 81 LEU N N 81 121.426 121.426 122.997 -1.571 18518
6511 1 10 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.148 -0.297 18518
6512 1 10 . 1 1 81 81 LEU C C 81 174.488 174.488 175.243 -0.755 18518
6513 1 10 . 1 1 81 81 LEU CA C 81 53.197 53.197 53.457 -0.260 18518
6514 1 10 . 1 1 81 81 LEU CB C 81 45.100 45.100 43.823 1.277 18518
6515 1 10 . 1 1 81 81 LEU H H 81 8.229 8.229 8.538 -0.309 18518
6516 1 10 . 1 1 82 82 LEU N N 82 125.155 125.155 127.154 -1.999 18518
6517 1 10 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.538 0.295 18518
6518 1 10 . 1 1 82 82 LEU C C 82 177.166 177.166 175.616 1.550 18518
6519 1 10 . 1 1 82 82 LEU CA C 82 54.197 54.197 54.031 0.166 18518
6520 1 10 . 1 1 82 82 LEU CB C 82 43.442 43.442 44.198 -0.756 18518
6521 1 10 . 1 1 82 82 LEU H H 82 9.400 9.400 9.353 0.047 18518
6522 1 10 . 1 1 83 83 VAL N N 83 123.886 123.886 121.154 2.732 18518
6523 1 10 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.593 -0.214 18518
6524 1 10 . 1 1 83 83 VAL C C 83 175.810 175.810 176.350 -0.540 18518
6525 1 10 . 1 1 83 83 VAL CA C 83 61.677 61.677 61.719 -0.042 18518
6526 1 10 . 1 1 83 83 VAL CB C 83 33.758 33.758 32.999 0.758 18518
6527 1 10 . 1 1 83 83 VAL H H 83 8.721 8.721 8.447 0.274 18518
6528 1 10 . 1 1 84 84 ASN N N 84 126.474 126.474 127.872 -1.398 18518
6529 1 10 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.535 -0.139 18518
6530 1 10 . 1 1 84 84 ASN C C 84 175.164 175.164 175.054 0.110 18518
6531 1 10 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.734 0.004 18518
6532 1 10 . 1 1 84 84 ASN CB C 84 37.950 37.950 37.697 0.253 18518
6533 1 10 . 1 1 84 84 ASN H H 84 9.707 9.707 9.651 0.056 18518
6534 1 10 . 1 1 85 85 GLY N N 85 101.296 101.296 104.377 -3.081 18518
6535 1 10 . 1 1 85 85 GLY C C 85 173.680 173.680 173.404 0.276 18518
6536 1 10 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.930 0.673 18518
6537 1 10 . 1 1 85 85 GLY H H 85 8.644 8.644 8.422 0.222 18518
6538 1 10 . 1 1 86 86 HIS N N 86 117.238 117.238 119.218 -1.980 18518
6539 1 10 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.560 0.457 18518
6540 1 10 . 1 1 86 86 HIS C C 86 173.841 173.841 174.080 -0.239 18518
6541 1 10 . 1 1 86 86 HIS CA C 86 53.796 53.796 54.165 -0.369 18518
6542 1 10 . 1 1 86 86 HIS CB C 86 31.280 31.280 31.039 0.241 18518
6543 1 10 . 1 1 86 86 HIS H H 86 7.918 7.918 8.196 -0.278 18518
6544 1 10 . 1 1 87 87 SER N N 87 118.179 118.179 121.742 -3.563 18518
6545 1 10 . 1 1 87 87 SER HA H 87 4.699 4.699 4.452 0.247 18518
6546 1 10 . 1 1 87 87 SER C C 87 175.904 175.904 174.497 1.407 18518
6547 1 10 . 1 1 87 87 SER CA C 87 58.271 58.271 58.413 -0.143 18518
6548 1 10 . 1 1 87 87 SER CB C 87 63.735 63.735 61.685 2.050 18518
6549 1 10 . 1 1 87 87 SER H H 87 8.977 8.977 8.786 0.191 18518
6550 1 10 . 1 1 88 88 MET N N 88 125.472 125.472 122.526 2.946 18518
6551 1 10 . 1 1 88 88 MET HA H 88 4.830 4.830 4.666 0.164 18518
6552 1 10 . 1 1 88 88 MET C C 88 176.419 176.419 174.957 1.462 18518
6553 1 10 . 1 1 88 88 MET CA C 88 54.899 54.899 55.595 -0.696 18518
6554 1 10 . 1 1 88 88 MET CB C 88 33.336 33.336 33.401 -0.065 18518
6555 1 10 . 1 1 88 88 MET H H 88 9.184 9.184 7.994 1.190 18518
6556 1 10 . 1 1 89 89 VAL N N 89 120.747 120.747 115.476 5.271 18518
6557 1 10 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.378 -0.146 18518
6558 1 10 . 1 1 89 89 VAL C C 89 175.958 175.958 175.085 0.873 18518
6559 1 10 . 1 1 89 89 VAL CA C 89 63.154 63.154 60.651 2.503 18518
6560 1 10 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.733 -1.855 18518
6561 1 10 . 1 1 89 89 VAL H H 89 8.233 8.233 7.500 0.733 18518
6562 1 10 . 1 1 90 90 SER N N 90 117.362 117.362 115.900 1.462 18518
6563 1 10 . 1 1 90 90 SER HA H 90 4.590 4.590 4.846 -0.256 18518
6564 1 10 . 1 1 90 90 SER C C 90 175.741 175.741 175.847 -0.106 18518
6565 1 10 . 1 1 90 90 SER CA C 90 57.717 57.717 56.749 0.968 18518
6566 1 10 . 1 1 90 90 SER CB C 90 63.223 63.223 65.940 -2.717 18518
6567 1 10 . 1 1 90 90 SER H H 90 8.482 8.482 8.071 0.411 18518
6568 1 10 . 1 1 91 91 VAL N N 91 120.466 120.466 120.991 -0.525 18518
6569 1 10 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.879 0.168 18518
6570 1 10 . 1 1 91 91 VAL C C 91 176.329 176.329 175.735 0.594 18518
6571 1 10 . 1 1 91 91 VAL CA C 91 63.492 63.492 63.992 -0.500 18518
6572 1 10 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.926 0.642 18518
6573 1 10 . 1 1 91 91 VAL H H 91 8.188 8.188 8.668 -0.480 18518
6574 1 10 . 1 1 92 92 SER N N 92 116.398 116.398 112.804 3.594 18518
6575 1 10 . 1 1 92 92 SER HA H 92 4.636 4.636 4.713 -0.077 18518
6576 1 10 . 1 1 92 92 SER C C 92 174.159 174.159 174.159 0.000 18518
6577 1 10 . 1 1 92 92 SER CA C 92 57.805 57.805 57.774 0.031 18518
6578 1 10 . 1 1 92 92 SER CB C 92 63.046 63.046 63.863 -0.817 18518
6579 1 10 . 1 1 92 92 SER H H 92 8.370 8.370 8.077 0.293 18518
6580 1 10 . 1 1 93 93 THR N N 93 119.211 119.211 121.430 -2.219 18518
6581 1 10 . 1 1 93 93 THR HA H 93 4.484 4.484 4.680 -0.196 18518
6582 1 10 . 1 1 93 93 THR CA C 93 60.884 60.884 60.648 0.236 18518
6583 1 10 . 1 1 93 93 THR CB C 93 70.609 70.609 68.969 1.641 18518
6584 1 10 . 1 1 93 93 THR H H 93 7.416 7.416 7.512 -0.096 18518
6585 1 10 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.414 0.026 18518
6586 1 10 . 1 1 94 94 PRO C C 94 178.775 178.775 177.026 1.749 18518
6587 1 10 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.631 0.312 18518
6588 1 10 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.507 0.142 18518
6589 1 10 . 1 1 95 95 ILE N N 95 124.174 124.174 122.944 1.230 18518
6590 1 10 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.827 0.122 18518
6591 1 10 . 1 1 95 95 ILE C C 95 176.498 176.498 177.055 -0.557 18518
6592 1 10 . 1 1 95 95 ILE CA C 95 63.904 63.904 62.136 1.768 18518
6593 1 10 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.217 -0.035 18518
6594 1 10 . 1 1 95 95 ILE H H 95 9.305 9.305 8.310 0.995 18518
6595 1 10 . 1 1 96 96 SER N N 96 116.920 116.920 116.409 0.511 18518
6596 1 10 . 1 1 96 96 SER HA H 96 4.029 4.029 4.061 -0.032 18518
6597 1 10 . 1 1 96 96 SER C C 96 176.574 176.574 176.478 0.096 18518
6598 1 10 . 1 1 96 96 SER CA C 96 61.356 61.356 62.090 -0.734 18518
6599 1 10 . 1 1 96 96 SER CB C 96 61.723 61.723 62.179 -0.456 18518
6600 1 10 . 1 1 96 96 SER H H 96 8.335 8.335 8.006 0.329 18518
6601 1 10 . 1 1 97 97 GLU N N 97 123.255 123.255 122.461 0.794 18518
6602 1 10 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.175 0.103 18518
6603 1 10 . 1 1 97 97 GLU C C 97 179.716 179.716 179.004 0.712 18518
6604 1 10 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.861 -0.069 18518
6605 1 10 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.239 0.323 18518
6606 1 10 . 1 1 97 97 GLU H H 97 7.376 7.376 7.976 -0.600 18518
6607 1 10 . 1 1 98 98 VAL N N 98 121.137 121.137 120.340 0.797 18518
6608 1 10 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.702 0.100 18518
6609 1 10 . 1 1 98 98 VAL C C 98 177.637 177.637 178.073 -0.436 18518
6610 1 10 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.162 -0.338 18518
6611 1 10 . 1 1 98 98 VAL CB C 98 32.154 32.154 30.837 1.317 18518
6612 1 10 . 1 1 98 98 VAL H H 98 7.387 7.387 7.886 -0.499 18518
6613 1 10 . 1 1 99 99 TYR N N 99 118.927 118.927 122.175 -3.248 18518
6614 1 10 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.015 -0.025 18518
6615 1 10 . 1 1 99 99 TYR C C 99 176.081 176.081 177.073 -0.992 18518
6616 1 10 . 1 1 99 99 TYR CA C 99 62.223 62.223 61.890 0.333 18518
6617 1 10 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.416 0.566 18518
6618 1 10 . 1 1 99 99 TYR H H 99 9.048 9.048 8.517 0.531 18518
6619 1 10 . 1 1 100 100 GLU N N 100 113.894 113.894 116.079 -2.185 18518
6620 1 10 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.527 0.319 18518
6621 1 10 . 1 1 100 100 GLU C C 100 177.989 177.989 178.625 -0.636 18518
6622 1 10 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.855 0.232 18518
6623 1 10 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.893 0.489 18518
6624 1 10 . 1 1 100 100 GLU H H 100 7.422 7.422 8.249 -0.827 18518
6625 1 10 . 1 1 101 101 SER N N 101 108.991 108.991 115.199 -6.208 18518
6626 1 10 . 1 1 101 101 SER HA H 101 4.524 4.524 4.306 0.218 18518
6627 1 10 . 1 1 101 101 SER C C 101 176.628 176.628 176.083 0.545 18518
6628 1 10 . 1 1 101 101 SER CA C 101 60.349 60.349 60.637 -0.288 18518
6629 1 10 . 1 1 101 101 SER CB C 101 64.741 64.741 63.405 1.336 18518
6630 1 10 . 1 1 101 101 SER H H 101 7.424 7.424 7.815 -0.391 18518
6631 1 10 . 1 1 102 102 GLU N N 102 116.533 116.533 118.792 -2.259 18518
6632 1 10 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.541 0.203 18518
6633 1 10 . 1 1 102 102 GLU C C 102 176.774 176.774 176.092 0.682 18518
6634 1 10 . 1 1 102 102 GLU CA C 102 55.581 55.581 54.918 0.663 18518
6635 1 10 . 1 1 102 102 GLU CB C 102 30.697 30.697 30.348 0.349 18518
6636 1 10 . 1 1 102 102 GLU H H 102 8.487 8.487 8.094 0.393 18518
6637 1 10 . 1 1 103 103 LYS N N 103 118.370 118.370 118.821 -0.451 18518
6638 1 10 . 1 1 103 103 LYS HA H 103 4.178 4.178 4.008 0.170 18518
6639 1 10 . 1 1 103 103 LYS C C 103 175.018 175.018 176.520 -1.502 18518
6640 1 10 . 1 1 103 103 LYS CA C 103 57.329 57.329 56.397 0.932 18518
6641 1 10 . 1 1 103 103 LYS CB C 103 32.186 32.186 32.286 -0.100 18518
6642 1 10 . 1 1 103 103 LYS H H 103 7.831 7.831 7.511 0.320 18518
6643 1 10 . 1 1 104 104 ASP N N 104 123.500 123.500 122.623 0.877 18518
6644 1 10 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.743 0.012 18518
6645 1 10 . 1 1 104 104 ASP C C 104 177.383 177.383 177.893 -0.510 18518
6646 1 10 . 1 1 104 104 ASP CA C 104 53.846 53.846 53.818 0.028 18518
6647 1 10 . 1 1 104 104 ASP CB C 104 43.411 43.411 43.026 0.384 18518
6648 1 10 . 1 1 104 104 ASP H H 104 9.041 9.041 8.326 0.715 18518
6649 1 10 . 1 1 105 105 GLU N N 105 125.448 125.448 121.892 3.556 18518
6650 1 10 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.176 0.004 18518
6651 1 10 . 1 1 105 105 GLU C C 105 177.519 177.519 177.023 0.496 18518
6652 1 10 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.852 0.676 18518
6653 1 10 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.603 0.441 18518
6654 1 10 . 1 1 105 105 GLU H H 105 8.906 8.906 8.910 -0.004 18518
6655 1 10 . 1 1 106 106 ASP N N 106 118.824 118.824 116.639 2.185 18518
6656 1 10 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.650 -0.471 18518
6657 1 10 . 1 1 106 106 ASP C C 106 176.223 176.223 177.067 -0.844 18518
6658 1 10 . 1 1 106 106 ASP CA C 106 54.756 54.756 54.702 0.054 18518
6659 1 10 . 1 1 106 106 ASP CB C 106 39.999 39.999 41.198 -1.199 18518
6660 1 10 . 1 1 106 106 ASP H H 106 10.036 10.036 8.177 1.859 18518
6661 1 10 . 1 1 107 107 GLY N N 107 105.866 105.866 105.936 -0.070 18518
6662 1 10 . 1 1 107 107 GLY C C 107 175.136 175.136 173.803 1.333 18518
6663 1 10 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.330 -0.108 18518
6664 1 10 . 1 1 107 107 GLY H H 107 8.001 8.001 7.954 0.047 18518
6665 1 10 . 1 1 108 108 PHE N N 108 123.820 123.820 121.599 2.221 18518
6666 1 10 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.770 -0.108 18518
6667 1 10 . 1 1 108 108 PHE C C 108 174.899 174.899 174.468 0.431 18518
6668 1 10 . 1 1 108 108 PHE CA C 108 60.238 60.238 58.163 2.075 18518
6669 1 10 . 1 1 108 108 PHE CB C 108 40.365 40.365 40.197 0.168 18518
6670 1 10 . 1 1 108 108 PHE H H 108 9.912 9.912 7.564 2.348 18518
6671 1 10 . 1 1 109 109 LEU N N 109 120.130 120.130 123.916 -3.786 18518
6672 1 10 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.800 0.230 18518
6673 1 10 . 1 1 109 109 LEU C C 109 173.916 173.916 174.682 -0.766 18518
6674 1 10 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.466 -0.042 18518
6675 1 10 . 1 1 109 109 LEU CB C 109 45.203 45.203 44.917 0.286 18518
6676 1 10 . 1 1 109 109 LEU H H 109 7.997 7.997 8.509 -0.512 18518
6677 1 10 . 1 1 110 110 TYR N N 110 126.579 126.579 124.374 2.205 18518
6678 1 10 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.767 0.236 18518
6679 1 10 . 1 1 110 110 TYR C C 110 176.671 176.671 175.211 1.460 18518
6680 1 10 . 1 1 110 110 TYR CA C 110 59.058 59.058 57.831 1.227 18518
6681 1 10 . 1 1 110 110 TYR CB C 110 39.556 39.556 40.458 -0.902 18518
6682 1 10 . 1 1 110 110 TYR H H 110 9.377 9.377 8.889 0.488 18518
6683 1 10 . 1 1 111 111 MET N N 111 119.240 119.240 121.053 -1.813 18518
6684 1 10 . 1 1 111 111 MET HA H 111 5.486 5.486 5.410 0.075 18518
6685 1 10 . 1 1 111 111 MET C C 111 175.695 175.695 174.337 1.358 18518
6686 1 10 . 1 1 111 111 MET CA C 111 54.124 54.124 54.731 -0.607 18518
6687 1 10 . 1 1 111 111 MET CB C 111 36.960 36.960 37.811 -0.851 18518
6688 1 10 . 1 1 111 111 MET H H 111 9.658 9.658 9.022 0.636 18518
6689 1 10 . 1 1 112 112 VAL N N 112 119.865 119.865 117.802 2.063 18518
6690 1 10 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.641 0.322 18518
6691 1 10 . 1 1 112 112 VAL C C 112 175.058 175.058 173.874 1.184 18518
6692 1 10 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.235 -0.324 18518
6693 1 10 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.508 0.543 18518
6694 1 10 . 1 1 112 112 VAL H H 112 8.794 8.794 9.053 -0.259 18518
6695 1 10 . 1 1 113 113 TYR N N 113 119.664 119.664 119.693 -0.029 18518
6696 1 10 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.816 0.302 18518
6697 1 10 . 1 1 113 113 TYR C C 113 173.375 173.375 173.437 -0.062 18518
6698 1 10 . 1 1 113 113 TYR CA C 113 54.153 54.153 54.988 -0.835 18518
6699 1 10 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.760 1.552 18518
6700 1 10 . 1 1 113 113 TYR H H 113 8.315 8.315 8.527 -0.212 18518
6701 1 10 . 1 1 114 114 ALA N N 114 119.763 119.763 122.961 -3.198 18518
6702 1 10 . 1 1 114 114 ALA HA H 114 4.800 4.800 4.868 -0.068 18518
6703 1 10 . 1 1 114 114 ALA C C 114 176.216 176.216 175.254 0.962 18518
6704 1 10 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.968 -0.836 18518
6705 1 10 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.355 2.240 18518
6706 1 10 . 1 1 114 114 ALA H H 114 8.465 8.465 9.012 -0.547 18518
6707 1 10 . 1 1 115 115 SER N N 115 114.763 114.763 116.400 -1.637 18518
6708 1 10 . 1 1 115 115 SER HA H 115 4.496 4.496 4.745 -0.249 18518
6709 1 10 . 1 1 115 115 SER C C 115 172.671 172.671 174.122 -1.451 18518
6710 1 10 . 1 1 115 115 SER CA C 115 58.651 58.651 58.276 0.376 18518
6711 1 10 . 1 1 115 115 SER CB C 115 63.526 63.526 62.219 1.307 18518
6712 1 10 . 1 1 115 115 SER H H 115 9.915 9.915 8.846 1.069 18518
6713 1 10 . 1 1 116 116 GLN N N 116 116.611 116.611 124.617 -8.006 18518
6714 1 10 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.478 0.006 18518
6715 1 10 . 1 1 116 116 GLN C C 116 172.733 172.733 173.763 -1.030 18518
6716 1 10 . 1 1 116 116 GLN CA C 116 53.926 53.926 56.135 -2.209 18518
6717 1 10 . 1 1 116 116 GLN CB C 116 32.358 32.358 30.863 1.495 18518
6718 1 10 . 1 1 116 116 GLN H H 116 7.219 7.219 8.104 -0.885 18518
6719 1 10 . 1 1 117 117 GLU N N 117 117.623 117.623 122.132 -4.509 18518
6720 1 10 . 1 1 117 117 GLU HA H 117 3.287 3.287 2.711 0.576 18518
6721 1 10 . 1 1 117 117 GLU C C 117 175.168 175.168 175.676 -0.508 18518
6722 1 10 . 1 1 117 117 GLU CA C 117 56.882 56.882 56.947 -0.065 18518
6723 1 10 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.661 0.861 18518
6724 1 10 . 1 1 117 117 GLU H H 117 7.882 7.882 8.616 -0.734 18518
6725 1 10 . 1 1 118 118 THR N N 118 109.820 109.820 110.644 -0.824 18518
6726 1 10 . 1 1 118 118 THR HA H 118 4.066 4.066 4.413 -0.347 18518
6727 1 10 . 1 1 118 118 THR C C 118 172.355 172.355 173.468 -1.113 18518
6728 1 10 . 1 1 118 118 THR CA C 118 60.029 60.029 60.053 -0.024 18518
6729 1 10 . 1 1 118 118 THR CB C 118 70.480 70.480 69.679 0.801 18518
6730 1 10 . 1 1 118 118 THR H H 118 6.992 6.992 7.272 -0.280 18518
6731 1 11 . 1 1 2 2 ALA HA H 2 4.336 4.336 4.630 -0.294 18518
6732 1 11 . 1 1 2 2 ALA C C 2 177.974 177.974 176.724 1.250 18518
6733 1 11 . 1 1 2 2 ALA CA C 2 52.785 52.785 52.393 0.392 18518
6734 1 11 . 1 1 2 2 ALA CB C 2 19.444 19.444 18.873 0.571 18518
6735 1 11 . 1 1 3 3 MET N N 3 119.311 119.311 123.870 -4.559 18518
6736 1 11 . 1 1 3 3 MET HA H 3 4.451 4.451 4.562 -0.111 18518
6737 1 11 . 1 1 3 3 MET C C 3 176.913 176.913 175.425 1.488 18518
6738 1 11 . 1 1 3 3 MET CA C 3 55.679 55.679 55.407 0.272 18518
6739 1 11 . 1 1 3 3 MET CB C 3 32.590 32.590 35.130 -2.540 18518
6740 1 11 . 1 1 3 3 MET H H 3 8.638 8.638 8.482 0.156 18518
6741 1 11 . 1 1 4 4 GLY N N 4 110.281 110.281 111.154 -0.873 18518
6742 1 11 . 1 1 4 4 GLY C C 4 174.180 174.180 173.778 0.402 18518
6743 1 11 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.922 0.573 18518
6744 1 11 . 1 1 4 4 GLY H H 4 8.552 8.552 8.536 0.016 18518
6745 1 11 . 1 1 5 5 LYS N N 5 120.818 120.818 125.607 -4.789 18518
6746 1 11 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.292 0.217 18518
6747 1 11 . 1 1 5 5 LYS C C 5 177.605 177.605 176.394 1.211 18518
6748 1 11 . 1 1 5 5 LYS CA C 5 56.134 56.134 56.292 -0.158 18518
6749 1 11 . 1 1 5 5 LYS CB C 5 34.813 34.813 33.501 1.312 18518
6750 1 11 . 1 1 5 5 LYS H H 5 8.133 8.133 8.297 -0.164 18518
6751 1 11 . 1 1 6 6 THR N N 6 114.781 114.781 118.344 -3.563 18518
6752 1 11 . 1 1 6 6 THR HA H 6 4.421 4.421 4.530 -0.109 18518
6753 1 11 . 1 1 6 6 THR C C 6 175.524 175.524 175.557 -0.033 18518
6754 1 11 . 1 1 6 6 THR CA C 6 61.127 61.127 61.016 0.111 18518
6755 1 11 . 1 1 6 6 THR CB C 6 69.926 69.926 70.303 -0.377 18518
6756 1 11 . 1 1 6 6 THR H H 6 8.483 8.483 8.098 0.385 18518
6757 1 11 . 1 1 7 7 PHE N N 7 125.552 125.552 122.391 3.161 18518
6758 1 11 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.178 -0.173 18518
6759 1 11 . 1 1 7 7 PHE C C 7 177.397 177.397 177.202 0.195 18518
6760 1 11 . 1 1 7 7 PHE CA C 7 63.393 63.393 61.632 1.762 18518
6761 1 11 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.330 1.237 18518
6762 1 11 . 1 1 7 7 PHE H H 7 10.245 10.245 8.921 1.324 18518
6763 1 11 . 1 1 8 8 LYS N N 8 114.053 114.053 118.469 -4.416 18518
6764 1 11 . 1 1 8 8 LYS HA H 8 3.835 3.835 4.142 -0.307 18518
6765 1 11 . 1 1 8 8 LYS C C 8 175.520 175.520 178.596 -3.076 18518
6766 1 11 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.740 1.253 18518
6767 1 11 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.690 1.999 18518
6768 1 11 . 1 1 8 8 LYS H H 8 8.775 8.775 7.227 1.548 18518
6769 1 11 . 1 1 9 9 GLN N N 9 113.516 113.516 116.746 -3.230 18518
6770 1 11 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.045 0.104 18518
6771 1 11 . 1 1 9 9 GLN C C 9 177.615 177.615 177.753 -0.138 18518
6772 1 11 . 1 1 9 9 GLN CA C 9 56.819 56.819 58.580 -1.761 18518
6773 1 11 . 1 1 9 9 GLN CB C 9 30.019 30.019 28.586 1.433 18518
6774 1 11 . 1 1 9 9 GLN H H 9 7.355 7.355 8.091 -0.736 18518
6775 1 11 . 1 1 10 10 ARG N N 10 118.294 118.294 116.187 2.107 18518
6776 1 11 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.222 0.080 18518
6777 1 11 . 1 1 10 10 ARG C C 10 179.380 179.380 176.947 2.433 18518
6778 1 11 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.448 -0.180 18518
6779 1 11 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.900 0.742 18518
6780 1 11 . 1 1 10 10 ARG H H 10 7.936 7.936 7.773 0.163 18518
6781 1 11 . 1 1 11 11 ARG N N 11 121.137 121.137 119.624 1.513 18518
6782 1 11 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.674 0.006 18518
6783 1 11 . 1 1 11 11 ARG CA C 11 53.453 53.453 54.924 -1.471 18518
6784 1 11 . 1 1 11 11 ARG CB C 11 32.938 32.938 32.712 0.226 18518
6785 1 11 . 1 1 11 11 ARG H H 11 7.390 7.390 7.551 -0.161 18518
6786 1 11 . 1 1 12 12 THR N N 12 116.819 116.819 120.195 -3.376 18518
6787 1 11 . 1 1 12 12 THR HA H 12 4.359 4.359 4.447 -0.088 18518
6788 1 11 . 1 1 12 12 THR C C 12 174.989 174.989 176.624 -1.635 18518
6789 1 11 . 1 1 12 12 THR CA C 12 61.748 61.748 62.297 -0.548 18518
6790 1 11 . 1 1 12 12 THR CB C 12 71.068 71.068 69.898 1.170 18518
6791 1 11 . 1 1 12 12 THR H H 12 8.953 8.953 8.439 0.514 18518
6792 1 11 . 1 1 13 13 PHE N N 13 123.200 123.200 124.427 -1.227 18518
6793 1 11 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.188 -0.160 18518
6794 1 11 . 1 1 13 13 PHE C C 13 176.029 176.029 177.498 -1.469 18518
6795 1 11 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.771 0.093 18518
6796 1 11 . 1 1 13 13 PHE CB C 13 39.560 39.560 38.907 0.653 18518
6797 1 11 . 1 1 13 13 PHE H H 13 9.284 9.284 8.964 0.320 18518
6798 1 11 . 1 1 14 14 GLU N N 14 115.414 115.414 117.911 -2.497 18518
6799 1 11 . 1 1 14 14 GLU HA H 14 3.794 3.794 4.135 -0.341 18518
6800 1 11 . 1 1 14 14 GLU C C 14 180.081 180.081 179.372 0.709 18518
6801 1 11 . 1 1 14 14 GLU CA C 14 60.619 60.619 60.738 -0.119 18518
6802 1 11 . 1 1 14 14 GLU CB C 14 28.852 28.852 29.020 -0.168 18518
6803 1 11 . 1 1 14 14 GLU H H 14 8.973 8.973 8.801 0.172 18518
6804 1 11 . 1 1 15 15 GLN N N 15 119.276 119.276 118.274 1.002 18518
6805 1 11 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.132 -0.132 18518
6806 1 11 . 1 1 15 15 GLN C C 15 177.978 177.978 178.221 -0.243 18518
6807 1 11 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.485 0.350 18518
6808 1 11 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.205 1.165 18518
6809 1 11 . 1 1 15 15 GLN H H 15 7.756 7.756 8.053 -0.297 18518
6810 1 11 . 1 1 16 16 ARG N N 16 121.336 121.336 120.699 0.637 18518
6811 1 11 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.181 0.089 18518
6812 1 11 . 1 1 16 16 ARG C C 16 177.416 177.416 178.637 -1.221 18518
6813 1 11 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.624 1.751 18518
6814 1 11 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.195 0.410 18518
6815 1 11 . 1 1 16 16 ARG H H 16 8.645 8.645 8.279 0.366 18518
6816 1 11 . 1 1 17 17 VAL N N 17 117.630 117.630 120.302 -2.672 18518
6817 1 11 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.764 0.093 18518
6818 1 11 . 1 1 17 17 VAL C C 17 179.748 179.748 176.957 2.791 18518
6819 1 11 . 1 1 17 17 VAL CA C 17 65.726 65.726 66.074 -0.348 18518
6820 1 11 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.956 0.238 18518
6821 1 11 . 1 1 17 17 VAL H H 17 8.373 8.373 8.502 -0.129 18518
6822 1 11 . 1 1 18 18 GLU N N 18 120.864 120.864 119.255 1.609 18518
6823 1 11 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.964 0.338 18518
6824 1 11 . 1 1 18 18 GLU C C 18 177.728 177.728 178.430 -0.702 18518
6825 1 11 . 1 1 18 18 GLU CA C 18 58.486 58.486 60.033 -1.547 18518
6826 1 11 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.329 0.053 18518
6827 1 11 . 1 1 18 18 GLU H H 18 7.368 7.368 8.044 -0.676 18518
6828 1 11 . 1 1 19 19 ASP N N 19 121.425 121.425 120.425 1.000 18518
6829 1 11 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.408 0.026 18518
6830 1 11 . 1 1 19 19 ASP C C 19 179.978 179.978 178.833 1.145 18518
6831 1 11 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.429 -0.007 18518
6832 1 11 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.548 0.739 18518
6833 1 11 . 1 1 19 19 ASP H H 19 8.671 8.671 8.090 0.581 18518
6834 1 11 . 1 1 20 20 VAL N N 20 119.730 119.730 120.005 -0.275 18518
6835 1 11 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.301 -0.096 18518
6836 1 11 . 1 1 20 20 VAL C C 20 176.284 176.284 177.772 -1.488 18518
6837 1 11 . 1 1 20 20 VAL CA C 20 66.315 66.315 66.517 -0.202 18518
6838 1 11 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.601 -0.494 18518
6839 1 11 . 1 1 20 20 VAL H H 20 7.999 7.999 8.290 -0.291 18518
6840 1 11 . 1 1 21 21 ARG N N 21 121.455 121.455 119.288 2.167 18518
6841 1 11 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.966 -0.152 18518
6842 1 11 . 1 1 21 21 ARG C C 21 180.120 180.120 178.898 1.222 18518
6843 1 11 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.868 0.962 18518
6844 1 11 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.192 0.754 18518
6845 1 11 . 1 1 21 21 ARG H H 21 8.098 8.098 7.812 0.286 18518
6846 1 11 . 1 1 22 22 LEU N N 22 117.826 117.826 121.165 -3.339 18518
6847 1 11 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.069 -0.020 18518
6848 1 11 . 1 1 22 22 LEU C C 22 180.115 180.115 178.939 1.176 18518
6849 1 11 . 1 1 22 22 LEU CA C 22 57.790 57.790 58.112 -0.322 18518
6850 1 11 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.330 0.812 18518
6851 1 11 . 1 1 22 22 LEU H H 22 8.207 8.207 8.408 -0.201 18518
6852 1 11 . 1 1 23 23 ILE N N 23 121.450 121.450 118.585 2.865 18518
6853 1 11 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.712 0.301 18518
6854 1 11 . 1 1 23 23 ILE C C 23 178.149 178.149 178.678 -0.529 18518
6855 1 11 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.153 -1.982 18518
6856 1 11 . 1 1 23 23 ILE CB C 23 38.106 38.106 36.682 1.424 18518
6857 1 11 . 1 1 23 23 ILE H H 23 8.105 8.105 8.348 -0.243 18518
6858 1 11 . 1 1 24 24 ARG N N 24 121.139 121.139 119.302 1.837 18518
6859 1 11 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.106 -0.119 18518
6860 1 11 . 1 1 24 24 ARG C C 24 178.702 178.702 178.853 -0.151 18518
6861 1 11 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.517 -0.799 18518
6862 1 11 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.785 -1.016 18518
6863 1 11 . 1 1 24 24 ARG H H 24 8.601 8.601 8.296 0.305 18518
6864 1 11 . 1 1 25 25 GLU N N 25 118.054 118.054 119.203 -1.149 18518
6865 1 11 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.146 -0.120 18518
6866 1 11 . 1 1 25 25 GLU C C 25 178.492 178.492 178.671 -0.179 18518
6867 1 11 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.806 -0.026 18518
6868 1 11 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.576 0.425 18518
6869 1 11 . 1 1 25 25 GLU H H 25 7.423 7.423 7.697 -0.274 18518
6870 1 11 . 1 1 26 26 GLN N N 26 116.350 116.350 116.352 -0.002 18518
6871 1 11 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.093 -0.157 18518
6872 1 11 . 1 1 26 26 GLN C C 26 176.305 176.305 176.653 -0.348 18518
6873 1 11 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.233 0.270 18518
6874 1 11 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.804 0.403 18518
6875 1 11 . 1 1 26 26 GLN H H 26 7.524 7.524 7.779 -0.255 18518
6876 1 11 . 1 1 27 27 HIS N N 27 116.017 116.017 117.851 -1.834 18518
6877 1 11 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.125 -0.195 18518
6878 1 11 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.698 0.356 18518
6879 1 11 . 1 1 27 27 HIS CB C 27 30.747 30.747 30.264 0.483 18518
6880 1 11 . 1 1 27 27 HIS H H 27 8.284 8.284 8.056 0.228 18518
6881 1 11 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.578 0.003 18518
6882 1 11 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.533 0.386 18518
6883 1 11 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.007 0.448 18518
6884 1 11 . 1 1 29 29 THR N N 29 107.011 107.011 108.334 -1.323 18518
6885 1 11 . 1 1 29 29 THR HA H 29 4.599 4.599 4.378 0.221 18518
6886 1 11 . 1 1 29 29 THR C C 29 172.884 172.884 173.824 -0.940 18518
6887 1 11 . 1 1 29 29 THR CA C 29 60.810 60.810 61.262 -0.452 18518
6888 1 11 . 1 1 29 29 THR CB C 29 68.531 68.531 68.834 -0.303 18518
6889 1 11 . 1 1 29 29 THR H H 29 7.890 7.890 8.271 -0.381 18518
6890 1 11 . 1 1 30 30 LYS N N 30 117.679 117.679 121.237 -3.558 18518
6891 1 11 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.869 -0.011 18518
6892 1 11 . 1 1 30 30 LYS C C 30 174.310 174.310 174.620 -0.310 18518
6893 1 11 . 1 1 30 30 LYS CA C 30 53.751 53.751 53.854 -0.103 18518
6894 1 11 . 1 1 30 30 LYS CB C 30 35.804 35.804 35.651 0.153 18518
6895 1 11 . 1 1 30 30 LYS H H 30 7.441 7.441 7.656 -0.215 18518
6896 1 11 . 1 1 31 31 ILE N N 31 122.849 122.849 122.867 -0.018 18518
6897 1 11 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.282 -0.177 18518
6898 1 11 . 1 1 31 31 ILE CA C 31 54.801 54.801 56.051 -1.250 18518
6899 1 11 . 1 1 31 31 ILE CB C 31 38.265 38.265 38.130 0.135 18518
6900 1 11 . 1 1 31 31 ILE H H 31 9.304 9.304 8.896 0.408 18518
6901 1 11 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.953 0.206 18518
6902 1 11 . 1 1 32 32 PRO C C 32 174.164 174.164 176.311 -2.147 18518
6903 1 11 . 1 1 32 32 PRO CA C 32 61.503 61.503 61.803 -0.300 18518
6904 1 11 . 1 1 32 32 PRO CB C 32 31.145 31.145 30.500 0.645 18518
6905 1 11 . 1 1 33 33 VAL N N 33 125.606 125.606 121.134 4.472 18518
6906 1 11 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.247 -0.034 18518
6907 1 11 . 1 1 33 33 VAL C C 33 173.654 173.654 174.393 -0.739 18518
6908 1 11 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.572 0.472 18518
6909 1 11 . 1 1 33 33 VAL CB C 33 35.604 35.604 36.109 -0.505 18518
6910 1 11 . 1 1 33 33 VAL H H 33 9.424 9.424 8.615 0.809 18518
6911 1 11 . 1 1 34 34 ILE N N 34 128.241 128.241 123.563 4.678 18518
6912 1 11 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.824 0.009 18518
6913 1 11 . 1 1 34 34 ILE C C 34 175.605 175.605 175.098 0.507 18518
6914 1 11 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.552 -1.787 18518
6915 1 11 . 1 1 34 34 ILE CB C 34 36.799 36.799 38.434 -1.635 18518
6916 1 11 . 1 1 34 34 ILE H H 34 8.721 8.721 8.968 -0.247 18518
6917 1 11 . 1 1 35 35 ILE N N 35 125.650 125.650 128.524 -2.874 18518
6918 1 11 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.599 0.237 18518
6919 1 11 . 1 1 35 35 ILE C C 35 174.887 174.887 174.352 0.535 18518
6920 1 11 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.392 0.554 18518
6921 1 11 . 1 1 35 35 ILE CB C 35 39.210 39.210 39.070 0.140 18518
6922 1 11 . 1 1 35 35 ILE H H 35 9.034 9.034 9.140 -0.106 18518
6923 1 11 . 1 1 36 36 GLU N N 36 122.657 122.657 126.561 -3.904 18518
6924 1 11 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.773 0.088 18518
6925 1 11 . 1 1 36 36 GLU C C 36 173.848 173.848 174.355 -0.507 18518
6926 1 11 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.115 -0.183 18518
6927 1 11 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.250 1.032 18518
6928 1 11 . 1 1 36 36 GLU H H 36 8.303 8.303 8.347 -0.044 18518
6929 1 11 . 1 1 37 37 ARG N N 37 123.228 123.228 125.481 -2.253 18518
6930 1 11 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.307 -0.581 18518
6931 1 11 . 1 1 37 37 ARG C C 37 176.359 176.359 175.779 0.580 18518
6932 1 11 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.128 0.231 18518
6933 1 11 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.586 0.755 18518
6934 1 11 . 1 1 37 37 ARG H H 37 8.856 8.856 8.627 0.229 18518
6935 1 11 . 1 1 38 38 TYR N N 38 128.981 128.981 127.801 1.180 18518
6936 1 11 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.284 0.068 18518
6937 1 11 . 1 1 38 38 TYR C C 38 177.316 177.316 176.530 0.786 18518
6938 1 11 . 1 1 38 38 TYR CA C 38 57.712 57.712 58.645 -0.933 18518
6939 1 11 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.168 -0.696 18518
6940 1 11 . 1 1 38 38 TYR H H 38 8.628 8.628 8.507 0.121 18518
6941 1 11 . 1 1 39 39 LYS N N 39 130.635 130.635 125.247 5.388 18518
6942 1 11 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.821 0.001 18518
6943 1 11 . 1 1 39 39 LYS CA C 39 58.887 58.887 57.958 0.929 18518
6944 1 11 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.953 -0.182 18518
6945 1 11 . 1 1 39 39 LYS H H 39 8.594 8.594 7.701 0.893 18518
6946 1 11 . 1 1 40 40 GLY C C 40 173.447 173.447 173.893 -0.446 18518
6947 1 11 . 1 1 40 40 GLY CA C 40 44.663 44.663 44.284 0.379 18518
6948 1 11 . 1 1 40 40 GLY H H 40 5.188 5.188 6.933 -1.745 18518
6949 1 11 . 1 1 41 41 GLU N N 41 122.836 122.836 121.161 1.675 18518
6950 1 11 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.328 -0.071 18518
6951 1 11 . 1 1 41 41 GLU C C 41 176.524 176.524 176.130 0.394 18518
6952 1 11 . 1 1 41 41 GLU CA C 41 56.525 56.525 55.781 0.744 18518
6953 1 11 . 1 1 41 41 GLU CB C 41 30.985 30.985 29.187 1.798 18518
6954 1 11 . 1 1 41 41 GLU H H 41 7.380 7.380 7.434 -0.054 18518
6955 1 11 . 1 1 42 42 LYS N N 42 124.040 124.040 127.482 -3.442 18518
6956 1 11 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.529 0.146 18518
6957 1 11 . 1 1 42 42 LYS C C 42 177.538 177.538 176.842 0.696 18518
6958 1 11 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.626 -0.786 18518
6959 1 11 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.393 1.586 18518
6960 1 11 . 1 1 42 42 LYS H H 42 9.034 9.034 8.769 0.265 18518
6961 1 11 . 1 1 43 43 GLN N N 43 119.259 119.259 118.945 0.314 18518
6962 1 11 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.440 0.102 18518
6963 1 11 . 1 1 43 43 GLN C C 43 177.336 177.336 176.458 0.878 18518
6964 1 11 . 1 1 43 43 GLN CA C 43 57.673 57.673 56.984 0.689 18518
6965 1 11 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.118 0.664 18518
6966 1 11 . 1 1 43 43 GLN H H 43 8.435 8.435 8.893 -0.458 18518
6967 1 11 . 1 1 44 44 LEU N N 44 120.760 120.760 123.552 -2.792 18518
6968 1 11 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.606 0.089 18518
6969 1 11 . 1 1 44 44 LEU CA C 44 53.245 53.245 53.190 0.055 18518
6970 1 11 . 1 1 44 44 LEU CB C 44 43.596 43.596 42.251 1.345 18518
6971 1 11 . 1 1 44 44 LEU H H 44 9.126 9.126 8.538 0.588 18518
6972 1 11 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.656 0.061 18518
6973 1 11 . 1 1 45 45 PRO C C 45 175.797 175.797 176.512 -0.715 18518
6974 1 11 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.114 -0.003 18518
6975 1 11 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.570 0.022 18518
6976 1 11 . 1 1 46 46 VAL N N 46 119.052 119.052 120.538 -1.486 18518
6977 1 11 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.019 -0.152 18518
6978 1 11 . 1 1 46 46 VAL C C 46 175.640 175.640 176.236 -0.596 18518
6979 1 11 . 1 1 46 46 VAL CA C 46 62.944 62.944 62.619 0.325 18518
6980 1 11 . 1 1 46 46 VAL CB C 46 32.799 32.799 32.381 0.418 18518
6981 1 11 . 1 1 46 46 VAL H H 46 8.543 8.543 8.314 0.229 18518
6982 1 11 . 1 1 47 47 LEU N N 47 130.203 130.203 127.633 2.570 18518
6983 1 11 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.419 -0.110 18518
6984 1 11 . 1 1 47 47 LEU C C 47 176.198 176.198 177.471 -1.273 18518
6985 1 11 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.619 -0.613 18518
6986 1 11 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.604 1.228 18518
6987 1 11 . 1 1 47 47 LEU H H 47 7.799 7.799 8.524 -0.725 18518
6988 1 11 . 1 1 48 48 ASP N N 48 122.403 122.403 124.959 -2.556 18518
6989 1 11 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.556 -0.293 18518
6990 1 11 . 1 1 48 48 ASP C C 48 175.294 175.294 176.020 -0.726 18518
6991 1 11 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.709 0.123 18518
6992 1 11 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.441 -1.257 18518
6993 1 11 . 1 1 48 48 ASP H H 48 8.780 8.780 8.579 0.201 18518
6994 1 11 . 1 1 49 49 LYS N N 49 119.569 119.569 116.811 2.758 18518
6995 1 11 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.561 0.024 18518
6996 1 11 . 1 1 49 49 LYS C C 49 174.678 174.678 175.533 -0.855 18518
6997 1 11 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.114 -1.462 18518
6998 1 11 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.691 1.254 18518
6999 1 11 . 1 1 49 49 LYS H H 49 7.280 7.280 7.563 -0.283 18518
7000 1 11 . 1 1 50 50 THR N N 50 110.862 110.862 115.000 -4.138 18518
7001 1 11 . 1 1 50 50 THR HA H 50 4.811 4.811 4.910 -0.099 18518
7002 1 11 . 1 1 50 50 THR C C 50 172.425 172.425 174.262 -1.837 18518
7003 1 11 . 1 1 50 50 THR CA C 50 62.645 62.645 62.848 -0.203 18518
7004 1 11 . 1 1 50 50 THR CB C 50 71.648 71.648 70.571 1.077 18518
7005 1 11 . 1 1 50 50 THR H H 50 8.042 8.042 8.393 -0.351 18518
7006 1 11 . 1 1 51 51 LYS N N 51 120.008 120.008 122.492 -2.484 18518
7007 1 11 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.831 -0.206 18518
7008 1 11 . 1 1 51 51 LYS C C 51 175.082 175.082 175.974 -0.892 18518
7009 1 11 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.466 -1.762 18518
7010 1 11 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.228 -0.853 18518
7011 1 11 . 1 1 51 51 LYS H H 51 7.119 7.119 7.766 -0.647 18518
7012 1 11 . 1 1 52 52 PHE N N 52 122.640 122.640 124.187 -1.547 18518
7013 1 11 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.800 0.537 18518
7014 1 11 . 1 1 52 52 PHE C C 52 174.213 174.213 174.064 0.149 18518
7015 1 11 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.874 -0.263 18518
7016 1 11 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.333 -0.193 18518
7017 1 11 . 1 1 52 52 PHE H H 52 9.709 9.709 9.294 0.415 18518
7018 1 11 . 1 1 53 53 LEU N N 53 122.157 122.157 123.274 -1.117 18518
7019 1 11 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.886 0.061 18518
7020 1 11 . 1 1 53 53 LEU C C 53 175.769 175.769 175.585 0.184 18518
7021 1 11 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.843 -0.886 18518
7022 1 11 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.961 0.454 18518
7023 1 11 . 1 1 53 53 LEU H H 53 8.959 8.959 8.523 0.436 18518
7024 1 11 . 1 1 54 54 VAL N N 54 124.919 124.919 125.723 -0.804 18518
7025 1 11 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.536 0.023 18518
7026 1 11 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.836 0.295 18518
7027 1 11 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.007 1.961 18518
7028 1 11 . 1 1 54 54 VAL H H 54 8.922 8.922 8.659 0.263 18518
7029 1 11 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.664 -0.223 18518
7030 1 11 . 1 1 55 55 PRO C C 55 176.594 176.594 178.036 -1.442 18518
7031 1 11 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.031 2.284 18518
7032 1 11 . 1 1 55 55 PRO CB C 55 32.665 32.665 31.620 1.044 18518
7033 1 11 . 1 1 56 56 ASP N N 56 120.522 120.522 123.688 -3.166 18518
7034 1 11 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.177 -0.315 18518
7035 1 11 . 1 1 56 56 ASP C C 56 175.809 175.809 176.572 -0.763 18518
7036 1 11 . 1 1 56 56 ASP CA C 56 56.749 56.749 56.804 -0.056 18518
7037 1 11 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.517 -0.007 18518
7038 1 11 . 1 1 56 56 ASP H H 56 8.347 8.347 8.194 0.152 18518
7039 1 11 . 1 1 57 57 HIS N N 57 113.482 113.482 114.835 -1.353 18518
7040 1 11 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.608 0.112 18518
7041 1 11 . 1 1 57 57 HIS C C 57 176.507 176.507 175.321 1.186 18518
7042 1 11 . 1 1 57 57 HIS CA C 57 55.589 55.589 56.053 -0.464 18518
7043 1 11 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.495 1.148 18518
7044 1 11 . 1 1 57 57 HIS H H 57 7.557 7.557 8.028 -0.471 18518
7045 1 11 . 1 1 58 58 VAL N N 58 123.279 123.279 120.769 2.510 18518
7046 1 11 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.282 -0.446 18518
7047 1 11 . 1 1 58 58 VAL C C 58 175.019 175.019 174.712 0.307 18518
7048 1 11 . 1 1 58 58 VAL CA C 58 62.823 62.823 60.541 2.282 18518
7049 1 11 . 1 1 58 58 VAL CB C 58 32.310 32.310 34.223 -1.913 18518
7050 1 11 . 1 1 58 58 VAL H H 58 7.345 7.345 7.415 -0.070 18518
7051 1 11 . 1 1 59 59 ASN N N 59 123.781 123.781 119.784 3.997 18518
7052 1 11 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.181 -0.055 18518
7053 1 11 . 1 1 59 59 ASN C C 59 176.558 176.558 176.359 0.199 18518
7054 1 11 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.353 0.132 18518
7055 1 11 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.535 -0.428 18518
7056 1 11 . 1 1 59 59 ASN H H 59 8.735 8.735 8.090 0.645 18518
7057 1 11 . 1 1 60 60 MET N N 60 117.453 117.453 119.134 -1.681 18518
7058 1 11 . 1 1 60 60 MET HA H 60 4.395 4.395 3.995 0.400 18518
7059 1 11 . 1 1 60 60 MET C C 60 178.144 178.144 177.938 0.206 18518
7060 1 11 . 1 1 60 60 MET CA C 60 57.097 57.097 60.163 -3.066 18518
7061 1 11 . 1 1 60 60 MET CB C 60 30.140 30.140 32.184 -2.044 18518
7062 1 11 . 1 1 60 60 MET H H 60 8.227 8.227 8.843 -0.616 18518
7063 1 11 . 1 1 61 61 SER N N 61 114.216 114.216 115.873 -1.657 18518
7064 1 11 . 1 1 61 61 SER HA H 61 4.111 4.111 4.056 0.055 18518
7065 1 11 . 1 1 61 61 SER C C 61 177.335 177.335 177.133 0.202 18518
7066 1 11 . 1 1 61 61 SER CA C 61 61.590 61.590 62.242 -0.652 18518
7067 1 11 . 1 1 61 61 SER CB C 61 62.402 62.402 62.760 -0.358 18518
7068 1 11 . 1 1 61 61 SER H H 61 8.464 8.464 8.108 0.356 18518
7069 1 11 . 1 1 62 62 GLU N N 62 123.004 123.004 120.650 2.354 18518
7070 1 11 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.134 -0.087 18518
7071 1 11 . 1 1 62 62 GLU C C 62 178.686 178.686 178.930 -0.244 18518
7072 1 11 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.365 0.260 18518
7073 1 11 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.184 0.470 18518
7074 1 11 . 1 1 62 62 GLU H H 62 7.994 7.994 7.723 0.271 18518
7075 1 11 . 1 1 63 63 LEU N N 63 120.818 120.818 122.213 -1.395 18518
7076 1 11 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.992 -0.027 18518
7077 1 11 . 1 1 63 63 LEU C C 63 178.046 178.046 178.806 -0.760 18518
7078 1 11 . 1 1 63 63 LEU CA C 63 57.920 57.920 58.068 -0.148 18518
7079 1 11 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.694 -0.070 18518
7080 1 11 . 1 1 63 63 LEU H H 63 8.130 8.130 7.775 0.355 18518
7081 1 11 . 1 1 64 64 ILE N N 64 118.528 118.528 118.694 -0.166 18518
7082 1 11 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.593 -0.224 18518
7083 1 11 . 1 1 64 64 ILE C C 64 177.127 177.127 177.668 -0.541 18518
7084 1 11 . 1 1 64 64 ILE CA C 64 66.678 66.678 65.270 1.408 18518
7085 1 11 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.461 0.983 18518
7086 1 11 . 1 1 64 64 ILE H H 64 8.488 8.488 8.373 0.115 18518
7087 1 11 . 1 1 65 65 LYS N N 65 118.336 118.336 120.995 -2.659 18518
7088 1 11 . 1 1 65 65 LYS HA H 65 3.701 3.701 3.938 -0.237 18518
7089 1 11 . 1 1 65 65 LYS C C 65 179.291 179.291 179.174 0.117 18518
7090 1 11 . 1 1 65 65 LYS CA C 65 60.440 60.440 60.060 0.380 18518
7091 1 11 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.172 0.199 18518
7092 1 11 . 1 1 65 65 LYS H H 65 7.347 7.347 7.584 -0.237 18518
7093 1 11 . 1 1 66 66 ILE N N 66 120.171 120.171 119.874 0.297 18518
7094 1 11 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.701 -0.123 18518
7095 1 11 . 1 1 66 66 ILE C C 66 178.873 178.873 178.086 0.787 18518
7096 1 11 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.059 0.101 18518
7097 1 11 . 1 1 66 66 ILE CB C 66 38.633 38.633 38.012 0.621 18518
7098 1 11 . 1 1 66 66 ILE H H 66 7.901 7.901 7.954 -0.053 18518
7099 1 11 . 1 1 67 67 ILE N N 67 121.185 121.185 120.820 0.365 18518
7100 1 11 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.532 -0.086 18518
7101 1 11 . 1 1 67 67 ILE C C 67 177.150 177.150 177.783 -0.633 18518
7102 1 11 . 1 1 67 67 ILE CA C 67 62.806 62.806 65.088 -2.282 18518
7103 1 11 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.434 -2.439 18518
7104 1 11 . 1 1 67 67 ILE H H 67 8.290 8.290 7.714 0.576 18518
7105 1 11 . 1 1 68 68 ARG N N 68 119.173 119.173 118.343 0.830 18518
7106 1 11 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.772 -0.841 18518
7107 1 11 . 1 1 68 68 ARG C C 68 178.496 178.496 178.571 -0.075 18518
7108 1 11 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.299 1.337 18518
7109 1 11 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.779 0.661 18518
7110 1 11 . 1 1 68 68 ARG H H 68 8.438 8.438 8.402 0.036 18518
7111 1 11 . 1 1 69 69 ARG N N 69 116.511 116.511 120.765 -4.254 18518
7112 1 11 . 1 1 69 69 ARG HA H 69 4.134 4.134 3.953 0.181 18518
7113 1 11 . 1 1 69 69 ARG C C 69 180.262 180.262 178.296 1.966 18518
7114 1 11 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.489 -0.782 18518
7115 1 11 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.225 -0.272 18518
7116 1 11 . 1 1 69 69 ARG H H 69 7.497 7.497 8.294 -0.797 18518
7117 1 11 . 1 1 70 70 ARG N N 70 123.297 123.297 117.240 6.057 18518
7118 1 11 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.131 -0.115 18518
7119 1 11 . 1 1 70 70 ARG C C 70 178.700 178.700 178.351 0.349 18518
7120 1 11 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.313 1.147 18518
7121 1 11 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.646 0.666 18518
7122 1 11 . 1 1 70 70 ARG H H 70 8.075 8.075 7.892 0.183 18518
7123 1 11 . 1 1 71 71 LEU N N 71 116.829 116.829 119.147 -2.318 18518
7124 1 11 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.018 0.047 18518
7125 1 11 . 1 1 71 71 LEU C C 71 174.956 174.956 176.734 -1.778 18518
7126 1 11 . 1 1 71 71 LEU CA C 71 55.126 55.126 56.455 -1.329 18518
7127 1 11 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.287 0.959 18518
7128 1 11 . 1 1 71 71 LEU H H 71 7.719 7.719 7.643 0.076 18518
7129 1 11 . 1 1 72 72 GLN N N 72 114.991 114.991 113.277 1.714 18518
7130 1 11 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.873 -0.037 18518
7131 1 11 . 1 1 72 72 GLN C C 72 175.683 175.683 175.671 0.012 18518
7132 1 11 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.053 0.272 18518
7133 1 11 . 1 1 72 72 GLN CB C 72 26.004 26.004 26.049 -0.045 18518
7134 1 11 . 1 1 72 72 GLN H H 72 7.744 7.744 7.783 -0.039 18518
7135 1 11 . 1 1 73 73 LEU N N 73 115.045 115.045 113.575 1.470 18518
7136 1 11 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.173 0.063 18518
7137 1 11 . 1 1 73 73 LEU C C 73 178.762 178.762 177.133 1.629 18518
7138 1 11 . 1 1 73 73 LEU CA C 73 54.386 54.386 54.566 -0.180 18518
7139 1 11 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.850 0.241 18518
7140 1 11 . 1 1 73 73 LEU H H 73 7.500 7.500 7.540 -0.040 18518
7141 1 11 . 1 1 74 74 ASN N N 74 121.700 121.700 119.654 2.046 18518
7142 1 11 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.582 0.108 18518
7143 1 11 . 1 1 74 74 ASN C C 74 176.617 176.617 176.140 0.477 18518
7144 1 11 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.259 -0.574 18518
7145 1 11 . 1 1 74 74 ASN CB C 74 39.598 39.598 40.090 -0.492 18518
7146 1 11 . 1 1 74 74 ASN H H 74 9.045 9.045 8.201 0.844 18518
7147 1 11 . 1 1 75 75 ALA N N 75 123.952 123.952 124.288 -0.336 18518
7148 1 11 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.174 -0.210 18518
7149 1 11 . 1 1 75 75 ALA C C 75 178.131 178.131 177.799 0.332 18518
7150 1 11 . 1 1 75 75 ALA CA C 75 54.868 54.868 54.359 0.509 18518
7151 1 11 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.051 -0.333 18518
7152 1 11 . 1 1 75 75 ALA H H 75 8.784 8.784 8.516 0.268 18518
7153 1 11 . 1 1 76 76 ASN N N 76 112.295 112.295 114.914 -2.619 18518
7154 1 11 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.623 -0.043 18518
7155 1 11 . 1 1 76 76 ASN C C 76 175.448 175.448 175.060 0.388 18518
7156 1 11 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.650 -0.436 18518
7157 1 11 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.463 -0.143 18518
7158 1 11 . 1 1 76 76 ASN H H 76 8.391 8.391 8.393 -0.002 18518
7159 1 11 . 1 1 77 77 GLN N N 77 120.577 120.577 117.704 2.873 18518
7160 1 11 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.678 -0.405 18518
7161 1 11 . 1 1 77 77 GLN C C 77 175.045 175.045 174.248 0.797 18518
7162 1 11 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.723 1.082 18518
7163 1 11 . 1 1 77 77 GLN CB C 77 30.157 30.157 30.631 -0.474 18518
7164 1 11 . 1 1 77 77 GLN H H 77 7.552 7.552 7.316 0.236 18518
7165 1 11 . 1 1 78 78 ALA N N 78 130.670 130.670 124.063 6.607 18518
7166 1 11 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.657 -0.486 18518
7167 1 11 . 1 1 78 78 ALA C C 78 176.512 176.512 175.352 1.160 18518
7168 1 11 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.201 1.641 18518
7169 1 11 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.700 -1.640 18518
7170 1 11 . 1 1 78 78 ALA H H 78 8.799 8.799 8.847 -0.048 18518
7171 1 11 . 1 1 79 79 PHE N N 79 119.325 119.325 116.846 2.479 18518
7172 1 11 . 1 1 79 79 PHE HA H 79 4.434 4.434 5.060 -0.626 18518
7173 1 11 . 1 1 79 79 PHE C C 79 171.726 171.726 172.920 -1.194 18518
7174 1 11 . 1 1 79 79 PHE CA C 79 59.145 59.145 55.865 3.280 18518
7175 1 11 . 1 1 79 79 PHE CB C 79 42.171 42.171 42.044 0.127 18518
7176 1 11 . 1 1 79 79 PHE H H 79 7.664 7.664 8.150 -0.486 18518
7177 1 11 . 1 1 80 80 PHE N N 80 126.314 126.314 118.047 8.267 18518
7178 1 11 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.241 0.151 18518
7179 1 11 . 1 1 80 80 PHE C C 80 177.169 177.169 172.947 4.222 18518
7180 1 11 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.382 0.271 18518
7181 1 11 . 1 1 80 80 PHE CB C 80 41.933 41.933 43.007 -1.073 18518
7182 1 11 . 1 1 80 80 PHE H H 80 8.508 8.508 9.042 -0.534 18518
7183 1 11 . 1 1 81 81 LEU N N 81 121.426 121.426 121.384 0.042 18518
7184 1 11 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.096 -0.245 18518
7185 1 11 . 1 1 81 81 LEU C C 81 174.488 174.488 174.763 -0.275 18518
7186 1 11 . 1 1 81 81 LEU CA C 81 53.197 53.197 53.966 -0.769 18518
7187 1 11 . 1 1 81 81 LEU CB C 81 45.100 45.100 45.305 -0.205 18518
7188 1 11 . 1 1 81 81 LEU H H 81 8.229 8.229 8.458 -0.229 18518
7189 1 11 . 1 1 82 82 LEU N N 82 125.155 125.155 125.660 -0.505 18518
7190 1 11 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.531 0.302 18518
7191 1 11 . 1 1 82 82 LEU C C 82 177.166 177.166 174.744 2.422 18518
7192 1 11 . 1 1 82 82 LEU CA C 82 54.197 54.197 53.697 0.500 18518
7193 1 11 . 1 1 82 82 LEU CB C 82 43.442 43.442 44.392 -0.950 18518
7194 1 11 . 1 1 82 82 LEU H H 82 9.400 9.400 9.181 0.219 18518
7195 1 11 . 1 1 83 83 VAL N N 83 123.886 123.886 120.242 3.644 18518
7196 1 11 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.524 -0.145 18518
7197 1 11 . 1 1 83 83 VAL C C 83 175.810 175.810 176.508 -0.698 18518
7198 1 11 . 1 1 83 83 VAL CA C 83 61.677 61.677 60.865 0.812 18518
7199 1 11 . 1 1 83 83 VAL CB C 83 33.758 33.758 32.780 0.978 18518
7200 1 11 . 1 1 83 83 VAL H H 83 8.721 8.721 8.546 0.175 18518
7201 1 11 . 1 1 84 84 ASN N N 84 126.474 126.474 128.206 -1.732 18518
7202 1 11 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.404 -0.008 18518
7203 1 11 . 1 1 84 84 ASN C C 84 175.164 175.164 175.212 -0.048 18518
7204 1 11 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.646 0.092 18518
7205 1 11 . 1 1 84 84 ASN CB C 84 37.950 37.950 37.471 0.479 18518
7206 1 11 . 1 1 84 84 ASN H H 84 9.707 9.707 9.372 0.335 18518
7207 1 11 . 1 1 85 85 GLY N N 85 101.296 101.296 104.422 -3.126 18518
7208 1 11 . 1 1 85 85 GLY C C 85 173.680 173.680 173.059 0.621 18518
7209 1 11 . 1 1 85 85 GLY CA C 85 45.603 45.603 45.174 0.429 18518
7210 1 11 . 1 1 85 85 GLY H H 85 8.644 8.644 8.478 0.166 18518
7211 1 11 . 1 1 86 86 HIS N N 86 117.238 117.238 113.500 3.738 18518
7212 1 11 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.690 0.327 18518
7213 1 11 . 1 1 86 86 HIS C C 86 173.841 173.841 173.720 0.121 18518
7214 1 11 . 1 1 86 86 HIS CA C 86 53.796 53.796 53.547 0.249 18518
7215 1 11 . 1 1 86 86 HIS CB C 86 31.280 31.280 32.295 -1.016 18518
7216 1 11 . 1 1 86 86 HIS H H 86 7.918 7.918 7.820 0.098 18518
7217 1 11 . 1 1 87 87 SER N N 87 118.179 118.179 118.755 -0.576 18518
7218 1 11 . 1 1 87 87 SER HA H 87 4.699 4.699 4.532 0.167 18518
7219 1 11 . 1 1 87 87 SER C C 87 175.904 175.904 174.689 1.215 18518
7220 1 11 . 1 1 87 87 SER CA C 87 58.271 58.271 57.535 0.736 18518
7221 1 11 . 1 1 87 87 SER CB C 87 63.735 63.735 62.298 1.437 18518
7222 1 11 . 1 1 87 87 SER H H 87 8.977 8.977 8.751 0.226 18518
7223 1 11 . 1 1 88 88 MET N N 88 125.472 125.472 124.570 0.902 18518
7224 1 11 . 1 1 88 88 MET HA H 88 4.830 4.830 4.695 0.135 18518
7225 1 11 . 1 1 88 88 MET C C 88 176.419 176.419 175.228 1.191 18518
7226 1 11 . 1 1 88 88 MET CA C 88 54.899 54.899 55.704 -0.805 18518
7227 1 11 . 1 1 88 88 MET CB C 88 33.336 33.336 33.187 0.149 18518
7228 1 11 . 1 1 88 88 MET H H 88 9.184 9.184 8.044 1.140 18518
7229 1 11 . 1 1 89 89 VAL N N 89 120.747 120.747 119.887 0.860 18518
7230 1 11 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.406 -0.174 18518
7231 1 11 . 1 1 89 89 VAL C C 89 175.958 175.958 175.549 0.409 18518
7232 1 11 . 1 1 89 89 VAL CA C 89 63.154 63.154 60.861 2.293 18518
7233 1 11 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.385 -1.507 18518
7234 1 11 . 1 1 89 89 VAL H H 89 8.233 8.233 7.605 0.628 18518
7235 1 11 . 1 1 90 90 SER N N 90 117.362 117.362 117.481 -0.119 18518
7236 1 11 . 1 1 90 90 SER HA H 90 4.590 4.590 4.670 -0.080 18518
7237 1 11 . 1 1 90 90 SER C C 90 175.741 175.741 174.754 0.987 18518
7238 1 11 . 1 1 90 90 SER CA C 90 57.717 57.717 58.396 -0.679 18518
7239 1 11 . 1 1 90 90 SER CB C 90 63.223 63.223 64.069 -0.846 18518
7240 1 11 . 1 1 90 90 SER H H 90 8.482 8.482 8.449 0.033 18518
7241 1 11 . 1 1 91 91 VAL N N 91 120.466 120.466 115.955 4.511 18518
7242 1 11 . 1 1 91 91 VAL HA H 91 4.047 4.047 4.287 -0.240 18518
7243 1 11 . 1 1 91 91 VAL C C 91 176.329 176.329 175.105 1.224 18518
7244 1 11 . 1 1 91 91 VAL CA C 91 63.492 63.492 63.428 0.064 18518
7245 1 11 . 1 1 91 91 VAL CB C 91 32.568 32.568 32.266 0.302 18518
7246 1 11 . 1 1 91 91 VAL H H 91 8.188 8.188 8.285 -0.097 18518
7247 1 11 . 1 1 92 92 SER N N 92 116.398 116.398 114.694 1.704 18518
7248 1 11 . 1 1 92 92 SER HA H 92 4.636 4.636 4.631 0.005 18518
7249 1 11 . 1 1 92 92 SER C C 92 174.159 174.159 174.707 -0.548 18518
7250 1 11 . 1 1 92 92 SER CA C 92 57.805 57.805 57.648 0.157 18518
7251 1 11 . 1 1 92 92 SER CB C 92 63.046 63.046 63.459 -0.412 18518
7252 1 11 . 1 1 92 92 SER H H 92 8.370 8.370 8.038 0.332 18518
7253 1 11 . 1 1 93 93 THR N N 93 119.211 119.211 117.182 2.029 18518
7254 1 11 . 1 1 93 93 THR HA H 93 4.484 4.484 4.586 -0.102 18518
7255 1 11 . 1 1 93 93 THR CA C 93 60.884 60.884 59.427 1.457 18518
7256 1 11 . 1 1 93 93 THR CB C 93 70.609 70.609 68.789 1.820 18518
7257 1 11 . 1 1 93 93 THR H H 93 7.416 7.416 7.559 -0.143 18518
7258 1 11 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.691 -0.251 18518
7259 1 11 . 1 1 94 94 PRO C C 94 178.775 178.775 177.049 1.726 18518
7260 1 11 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.115 0.828 18518
7261 1 11 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.506 0.143 18518
7262 1 11 . 1 1 95 95 ILE N N 95 124.174 124.174 126.577 -2.403 18518
7263 1 11 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.816 0.133 18518
7264 1 11 . 1 1 95 95 ILE C C 95 176.498 176.498 176.829 -0.331 18518
7265 1 11 . 1 1 95 95 ILE CA C 95 63.904 63.904 62.804 1.100 18518
7266 1 11 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.114 0.068 18518
7267 1 11 . 1 1 95 95 ILE H H 95 9.305 9.305 8.848 0.457 18518
7268 1 11 . 1 1 96 96 SER N N 96 116.920 116.920 115.284 1.636 18518
7269 1 11 . 1 1 96 96 SER HA H 96 4.029 4.029 4.053 -0.024 18518
7270 1 11 . 1 1 96 96 SER C C 96 176.574 176.574 176.252 0.322 18518
7271 1 11 . 1 1 96 96 SER CA C 96 61.356 61.356 62.424 -1.068 18518
7272 1 11 . 1 1 96 96 SER CB C 96 61.723 61.723 62.917 -1.194 18518
7273 1 11 . 1 1 96 96 SER H H 96 8.335 8.335 8.589 -0.254 18518
7274 1 11 . 1 1 97 97 GLU N N 97 123.255 123.255 121.477 1.778 18518
7275 1 11 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.215 0.063 18518
7276 1 11 . 1 1 97 97 GLU C C 97 179.716 179.716 179.124 0.592 18518
7277 1 11 . 1 1 97 97 GLU CA C 97 58.792 58.792 59.183 -0.391 18518
7278 1 11 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.311 0.251 18518
7279 1 11 . 1 1 97 97 GLU H H 97 7.376 7.376 7.803 -0.427 18518
7280 1 11 . 1 1 98 98 VAL N N 98 121.137 121.137 121.009 0.128 18518
7281 1 11 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.665 0.137 18518
7282 1 11 . 1 1 98 98 VAL C C 98 177.637 177.637 177.966 -0.329 18518
7283 1 11 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.155 -0.331 18518
7284 1 11 . 1 1 98 98 VAL CB C 98 32.154 32.154 30.624 1.530 18518
7285 1 11 . 1 1 98 98 VAL H H 98 7.387 7.387 7.861 -0.474 18518
7286 1 11 . 1 1 99 99 TYR N N 99 118.927 118.927 121.659 -2.732 18518
7287 1 11 . 1 1 99 99 TYR HA H 99 3.990 3.990 3.969 0.022 18518
7288 1 11 . 1 1 99 99 TYR C C 99 176.081 176.081 177.236 -1.155 18518
7289 1 11 . 1 1 99 99 TYR CA C 99 62.223 62.223 62.394 -0.171 18518
7290 1 11 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.576 0.406 18518
7291 1 11 . 1 1 99 99 TYR H H 99 9.048 9.048 8.580 0.468 18518
7292 1 11 . 1 1 100 100 GLU N N 100 113.894 113.894 116.492 -2.598 18518
7293 1 11 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.929 -0.083 18518
7294 1 11 . 1 1 100 100 GLU C C 100 177.989 177.989 178.142 -0.153 18518
7295 1 11 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.666 0.421 18518
7296 1 11 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.965 0.417 18518
7297 1 11 . 1 1 100 100 GLU H H 100 7.422 7.422 8.207 -0.785 18518
7298 1 11 . 1 1 101 101 SER N N 101 108.991 108.991 114.082 -5.091 18518
7299 1 11 . 1 1 101 101 SER HA H 101 4.524 4.524 4.471 0.053 18518
7300 1 11 . 1 1 101 101 SER C C 101 176.628 176.628 175.557 1.071 18518
7301 1 11 . 1 1 101 101 SER CA C 101 60.349 60.349 60.353 -0.004 18518
7302 1 11 . 1 1 101 101 SER CB C 101 64.741 64.741 63.923 0.818 18518
7303 1 11 . 1 1 101 101 SER H H 101 7.424 7.424 7.781 -0.357 18518
7304 1 11 . 1 1 102 102 GLU N N 102 116.533 116.533 119.242 -2.709 18518
7305 1 11 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.564 0.180 18518
7306 1 11 . 1 1 102 102 GLU C C 102 176.774 176.774 175.699 1.075 18518
7307 1 11 . 1 1 102 102 GLU CA C 102 55.581 55.581 56.139 -0.558 18518
7308 1 11 . 1 1 102 102 GLU CB C 102 30.697 30.697 31.282 -0.585 18518
7309 1 11 . 1 1 102 102 GLU H H 102 8.487 8.487 8.086 0.401 18518
7310 1 11 . 1 1 103 103 LYS N N 103 118.370 118.370 120.212 -1.842 18518
7311 1 11 . 1 1 103 103 LYS HA H 103 4.178 4.178 3.850 0.328 18518
7312 1 11 . 1 1 103 103 LYS C C 103 175.018 175.018 176.481 -1.463 18518
7313 1 11 . 1 1 103 103 LYS CA C 103 57.329 57.329 56.892 0.437 18518
7314 1 11 . 1 1 103 103 LYS CB C 103 32.186 32.186 31.838 0.348 18518
7315 1 11 . 1 1 103 103 LYS H H 103 7.831 7.831 7.598 0.233 18518
7316 1 11 . 1 1 104 104 ASP N N 104 123.500 123.500 124.942 -1.442 18518
7317 1 11 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.752 0.003 18518
7318 1 11 . 1 1 104 104 ASP C C 104 177.383 177.383 178.004 -0.621 18518
7319 1 11 . 1 1 104 104 ASP CA C 104 53.846 53.846 53.638 0.208 18518
7320 1 11 . 1 1 104 104 ASP CB C 104 43.411 43.411 42.801 0.610 18518
7321 1 11 . 1 1 104 104 ASP H H 104 9.041 9.041 8.104 0.937 18518
7322 1 11 . 1 1 105 105 GLU N N 105 125.448 125.448 120.341 5.107 18518
7323 1 11 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.066 0.114 18518
7324 1 11 . 1 1 105 105 GLU C C 105 177.519 177.519 176.617 0.902 18518
7325 1 11 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.996 0.533 18518
7326 1 11 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.542 0.502 18518
7327 1 11 . 1 1 105 105 GLU H H 105 8.906 8.906 8.878 0.028 18518
7328 1 11 . 1 1 106 106 ASP N N 106 118.824 118.824 117.842 0.982 18518
7329 1 11 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.339 -0.160 18518
7330 1 11 . 1 1 106 106 ASP C C 106 176.223 176.223 176.726 -0.503 18518
7331 1 11 . 1 1 106 106 ASP CA C 106 54.756 54.756 54.352 0.404 18518
7332 1 11 . 1 1 106 106 ASP CB C 106 39.999 39.999 41.218 -1.219 18518
7333 1 11 . 1 1 106 106 ASP H H 106 10.036 10.036 8.121 1.915 18518
7334 1 11 . 1 1 107 107 GLY N N 107 105.866 105.866 106.815 -0.949 18518
7335 1 11 . 1 1 107 107 GLY C C 107 175.136 175.136 174.393 0.743 18518
7336 1 11 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.091 0.131 18518
7337 1 11 . 1 1 107 107 GLY H H 107 8.001 8.001 7.794 0.207 18518
7338 1 11 . 1 1 108 108 PHE N N 108 123.820 123.820 123.211 0.609 18518
7339 1 11 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.527 0.135 18518
7340 1 11 . 1 1 108 108 PHE C C 108 174.899 174.899 174.638 0.261 18518
7341 1 11 . 1 1 108 108 PHE CA C 108 60.238 60.238 59.142 1.096 18518
7342 1 11 . 1 1 108 108 PHE CB C 108 40.365 40.365 40.037 0.328 18518
7343 1 11 . 1 1 108 108 PHE H H 108 9.912 9.912 7.495 2.417 18518
7344 1 11 . 1 1 109 109 LEU N N 109 120.130 120.130 125.191 -5.061 18518
7345 1 11 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.621 0.409 18518
7346 1 11 . 1 1 109 109 LEU C C 109 173.916 173.916 174.760 -0.844 18518
7347 1 11 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.644 -0.220 18518
7348 1 11 . 1 1 109 109 LEU CB C 109 45.203 45.203 44.649 0.554 18518
7349 1 11 . 1 1 109 109 LEU H H 109 7.997 7.997 8.694 -0.697 18518
7350 1 11 . 1 1 110 110 TYR N N 110 126.579 126.579 126.270 0.309 18518
7351 1 11 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.478 0.525 18518
7352 1 11 . 1 1 110 110 TYR C C 110 176.671 176.671 175.449 1.222 18518
7353 1 11 . 1 1 110 110 TYR CA C 110 59.058 59.058 58.744 0.314 18518
7354 1 11 . 1 1 110 110 TYR CB C 110 39.556 39.556 38.624 0.932 18518
7355 1 11 . 1 1 110 110 TYR H H 110 9.377 9.377 8.776 0.601 18518
7356 1 11 . 1 1 111 111 MET N N 111 119.240 119.240 121.138 -1.898 18518
7357 1 11 . 1 1 111 111 MET HA H 111 5.486 5.486 5.141 0.345 18518
7358 1 11 . 1 1 111 111 MET C C 111 175.695 175.695 174.815 0.880 18518
7359 1 11 . 1 1 111 111 MET CA C 111 54.124 54.124 54.846 -0.722 18518
7360 1 11 . 1 1 111 111 MET CB C 111 36.960 36.960 37.030 -0.070 18518
7361 1 11 . 1 1 111 111 MET H H 111 9.658 9.658 8.882 0.776 18518
7362 1 11 . 1 1 112 112 VAL N N 112 119.865 119.865 119.459 0.406 18518
7363 1 11 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.401 0.562 18518
7364 1 11 . 1 1 112 112 VAL C C 112 175.058 175.058 174.437 0.621 18518
7365 1 11 . 1 1 112 112 VAL CA C 112 58.911 58.911 60.621 -1.710 18518
7366 1 11 . 1 1 112 112 VAL CB C 112 36.051 36.051 36.294 -0.243 18518
7367 1 11 . 1 1 112 112 VAL H H 112 8.794 8.794 9.008 -0.214 18518
7368 1 11 . 1 1 113 113 TYR N N 113 119.664 119.664 119.968 -0.304 18518
7369 1 11 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.617 0.501 18518
7370 1 11 . 1 1 113 113 TYR C C 113 173.375 173.375 173.478 -0.103 18518
7371 1 11 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.287 -1.134 18518
7372 1 11 . 1 1 113 113 TYR CB C 113 43.312 43.312 42.028 1.284 18518
7373 1 11 . 1 1 113 113 TYR H H 113 8.315 8.315 8.620 -0.305 18518
7374 1 11 . 1 1 114 114 ALA N N 114 119.763 119.763 122.025 -2.262 18518
7375 1 11 . 1 1 114 114 ALA HA H 114 4.800 4.800 5.003 -0.203 18518
7376 1 11 . 1 1 114 114 ALA C C 114 176.216 176.216 175.154 1.062 18518
7377 1 11 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.929 -0.797 18518
7378 1 11 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.431 2.165 18518
7379 1 11 . 1 1 114 114 ALA H H 114 8.465 8.465 9.020 -0.555 18518
7380 1 11 . 1 1 115 115 SER N N 115 114.763 114.763 115.623 -0.860 18518
7381 1 11 . 1 1 115 115 SER HA H 115 4.496 4.496 4.990 -0.494 18518
7382 1 11 . 1 1 115 115 SER C C 115 172.671 172.671 173.531 -0.860 18518
7383 1 11 . 1 1 115 115 SER CA C 115 58.651 58.651 57.414 1.237 18518
7384 1 11 . 1 1 115 115 SER CB C 115 63.526 63.526 62.275 1.251 18518
7385 1 11 . 1 1 115 115 SER H H 115 9.915 9.915 9.105 0.810 18518
7386 1 11 . 1 1 116 116 GLN N N 116 116.611 116.611 123.432 -6.821 18518
7387 1 11 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.524 -0.040 18518
7388 1 11 . 1 1 116 116 GLN C C 116 172.733 172.733 173.761 -1.028 18518
7389 1 11 . 1 1 116 116 GLN CA C 116 53.926 53.926 56.015 -2.089 18518
7390 1 11 . 1 1 116 116 GLN CB C 116 32.358 32.358 30.792 1.566 18518
7391 1 11 . 1 1 116 116 GLN H H 116 7.219 7.219 8.280 -1.061 18518
7392 1 11 . 1 1 117 117 GLU N N 117 117.623 117.623 120.592 -2.969 18518
7393 1 11 . 1 1 117 117 GLU HA H 117 3.287 3.287 2.843 0.444 18518
7394 1 11 . 1 1 117 117 GLU C C 117 175.168 175.168 175.740 -0.572 18518
7395 1 11 . 1 1 117 117 GLU CA C 117 56.882 56.882 56.840 0.042 18518
7396 1 11 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.400 1.122 18518
7397 1 11 . 1 1 117 117 GLU H H 117 7.882 7.882 8.376 -0.494 18518
7398 1 11 . 1 1 118 118 THR N N 118 109.820 109.820 111.201 -1.381 18518
7399 1 11 . 1 1 118 118 THR HA H 118 4.066 4.066 4.467 -0.401 18518
7400 1 11 . 1 1 118 118 THR C C 118 172.355 172.355 173.697 -1.342 18518
7401 1 11 . 1 1 118 118 THR CA C 118 60.029 60.029 61.119 -1.090 18518
7402 1 11 . 1 1 118 118 THR CB C 118 70.480 70.480 69.791 0.689 18518
7403 1 11 . 1 1 118 118 THR H H 118 6.992 6.992 7.486 -0.494 18518
7404 1 12 . 1 1 2 2 ALA HA H 2 4.336 4.336 4.755 -0.419 18518
7405 1 12 . 1 1 2 2 ALA C C 2 177.974 177.974 176.184 1.790 18518
7406 1 12 . 1 1 2 2 ALA CA C 2 52.785 52.785 52.587 0.198 18518
7407 1 12 . 1 1 2 2 ALA CB C 2 19.444 19.444 19.110 0.334 18518
7408 1 12 . 1 1 3 3 MET N N 3 119.311 119.311 123.622 -4.311 18518
7409 1 12 . 1 1 3 3 MET HA H 3 4.451 4.451 4.611 -0.160 18518
7410 1 12 . 1 1 3 3 MET C C 3 176.913 176.913 175.286 1.627 18518
7411 1 12 . 1 1 3 3 MET CA C 3 55.679 55.679 54.920 0.759 18518
7412 1 12 . 1 1 3 3 MET CB C 3 32.590 32.590 34.283 -1.693 18518
7413 1 12 . 1 1 3 3 MET H H 3 8.638 8.638 8.303 0.335 18518
7414 1 12 . 1 1 4 4 GLY N N 4 110.281 110.281 111.997 -1.716 18518
7415 1 12 . 1 1 4 4 GLY C C 4 174.180 174.180 174.310 -0.130 18518
7416 1 12 . 1 1 4 4 GLY CA C 4 45.495 45.495 45.336 0.159 18518
7417 1 12 . 1 1 4 4 GLY H H 4 8.552 8.552 8.536 0.016 18518
7418 1 12 . 1 1 5 5 LYS N N 5 120.818 120.818 125.372 -4.554 18518
7419 1 12 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.312 0.197 18518
7420 1 12 . 1 1 5 5 LYS C C 5 177.605 177.605 176.916 0.689 18518
7421 1 12 . 1 1 5 5 LYS CA C 5 56.134 56.134 56.546 -0.412 18518
7422 1 12 . 1 1 5 5 LYS CB C 5 34.813 34.813 32.983 1.830 18518
7423 1 12 . 1 1 5 5 LYS H H 5 8.133 8.133 8.340 -0.207 18518
7424 1 12 . 1 1 6 6 THR N N 6 114.781 114.781 113.937 0.844 18518
7425 1 12 . 1 1 6 6 THR HA H 6 4.421 4.421 4.518 -0.097 18518
7426 1 12 . 1 1 6 6 THR C C 6 175.524 175.524 176.002 -0.478 18518
7427 1 12 . 1 1 6 6 THR CA C 6 61.127 61.127 60.778 0.349 18518
7428 1 12 . 1 1 6 6 THR CB C 6 69.926 69.926 70.456 -0.530 18518
7429 1 12 . 1 1 6 6 THR H H 6 8.483 8.483 8.042 0.441 18518
7430 1 12 . 1 1 7 7 PHE N N 7 125.552 125.552 121.271 4.281 18518
7431 1 12 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.153 -0.148 18518
7432 1 12 . 1 1 7 7 PHE C C 7 177.397 177.397 176.774 0.623 18518
7433 1 12 . 1 1 7 7 PHE CA C 7 63.393 63.393 60.831 2.562 18518
7434 1 12 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.215 1.352 18518
7435 1 12 . 1 1 7 7 PHE H H 7 10.245 10.245 9.119 1.126 18518
7436 1 12 . 1 1 8 8 LYS N N 8 114.053 114.053 116.929 -2.876 18518
7437 1 12 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.614 0.221 18518
7438 1 12 . 1 1 8 8 LYS C C 8 175.520 175.520 178.816 -3.296 18518
7439 1 12 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.635 1.358 18518
7440 1 12 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.259 2.430 18518
7441 1 12 . 1 1 8 8 LYS H H 8 8.775 8.775 7.382 1.393 18518
7442 1 12 . 1 1 9 9 GLN N N 9 113.516 113.516 118.446 -4.930 18518
7443 1 12 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.132 0.017 18518
7444 1 12 . 1 1 9 9 GLN C C 9 177.615 177.615 178.118 -0.503 18518
7445 1 12 . 1 1 9 9 GLN CA C 9 56.819 56.819 58.187 -1.368 18518
7446 1 12 . 1 1 9 9 GLN CB C 9 30.019 30.019 28.703 1.316 18518
7447 1 12 . 1 1 9 9 GLN H H 9 7.355 7.355 7.438 -0.083 18518
7448 1 12 . 1 1 10 10 ARG N N 10 118.294 118.294 116.718 1.576 18518
7449 1 12 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.261 0.041 18518
7450 1 12 . 1 1 10 10 ARG C C 10 179.380 179.380 176.166 3.214 18518
7451 1 12 . 1 1 10 10 ARG CA C 10 57.268 57.268 56.619 0.649 18518
7452 1 12 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.651 0.991 18518
7453 1 12 . 1 1 10 10 ARG H H 10 7.936 7.936 7.796 0.140 18518
7454 1 12 . 1 1 11 11 ARG N N 11 121.137 121.137 119.360 1.777 18518
7455 1 12 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.583 0.097 18518
7456 1 12 . 1 1 11 11 ARG CA C 11 53.453 53.453 54.325 -0.873 18518
7457 1 12 . 1 1 11 11 ARG CB C 11 32.938 32.938 31.619 1.319 18518
7458 1 12 . 1 1 11 11 ARG H H 11 7.390 7.390 7.216 0.174 18518
7459 1 12 . 1 1 12 12 THR N N 12 116.819 116.819 119.460 -2.641 18518
7460 1 12 . 1 1 12 12 THR HA H 12 4.359 4.359 4.292 0.067 18518
7461 1 12 . 1 1 12 12 THR C C 12 174.989 174.989 175.873 -0.884 18518
7462 1 12 . 1 1 12 12 THR CA C 12 61.748 61.748 62.679 -0.931 18518
7463 1 12 . 1 1 12 12 THR CB C 12 71.068 71.068 70.041 1.027 18518
7464 1 12 . 1 1 12 12 THR H H 12 8.953 8.953 8.593 0.360 18518
7465 1 12 . 1 1 13 13 PHE N N 13 123.200 123.200 122.925 0.275 18518
7466 1 12 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.219 -0.191 18518
7467 1 12 . 1 1 13 13 PHE C C 13 176.029 176.029 177.059 -1.030 18518
7468 1 12 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.557 0.307 18518
7469 1 12 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.456 0.104 18518
7470 1 12 . 1 1 13 13 PHE H H 13 9.284 9.284 8.965 0.319 18518
7471 1 12 . 1 1 14 14 GLU N N 14 115.414 115.414 118.459 -3.045 18518
7472 1 12 . 1 1 14 14 GLU HA H 14 3.794 3.794 4.027 -0.233 18518
7473 1 12 . 1 1 14 14 GLU C C 14 180.081 180.081 179.143 0.938 18518
7474 1 12 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.891 0.728 18518
7475 1 12 . 1 1 14 14 GLU CB C 14 28.852 28.852 28.700 0.152 18518
7476 1 12 . 1 1 14 14 GLU H H 14 8.973 8.973 8.762 0.211 18518
7477 1 12 . 1 1 15 15 GLN N N 15 119.276 119.276 118.855 0.421 18518
7478 1 12 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.139 -0.139 18518
7479 1 12 . 1 1 15 15 GLN C C 15 177.978 177.978 178.683 -0.705 18518
7480 1 12 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.572 0.263 18518
7481 1 12 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.154 1.216 18518
7482 1 12 . 1 1 15 15 GLN H H 15 7.756 7.756 8.654 -0.898 18518
7483 1 12 . 1 1 16 16 ARG N N 16 121.336 121.336 120.541 0.795 18518
7484 1 12 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.198 0.072 18518
7485 1 12 . 1 1 16 16 ARG C C 16 177.416 177.416 178.668 -1.252 18518
7486 1 12 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.838 1.537 18518
7487 1 12 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.177 0.428 18518
7488 1 12 . 1 1 16 16 ARG H H 16 8.645 8.645 7.989 0.655 18518
7489 1 12 . 1 1 17 17 VAL N N 17 117.630 117.630 120.450 -2.820 18518
7490 1 12 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.622 0.235 18518
7491 1 12 . 1 1 17 17 VAL C C 17 179.748 179.748 177.246 2.502 18518
7492 1 12 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.893 -0.167 18518
7493 1 12 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.931 0.263 18518
7494 1 12 . 1 1 17 17 VAL H H 17 8.373 8.373 8.216 0.157 18518
7495 1 12 . 1 1 18 18 GLU N N 18 120.864 120.864 119.421 1.443 18518
7496 1 12 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.947 0.355 18518
7497 1 12 . 1 1 18 18 GLU C C 18 177.728 177.728 178.614 -0.886 18518
7498 1 12 . 1 1 18 18 GLU CA C 18 58.486 58.486 60.099 -1.613 18518
7499 1 12 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.420 -0.038 18518
7500 1 12 . 1 1 18 18 GLU H H 18 7.368 7.368 8.318 -0.950 18518
7501 1 12 . 1 1 19 19 ASP N N 19 121.425 121.425 120.351 1.074 18518
7502 1 12 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.454 -0.019 18518
7503 1 12 . 1 1 19 19 ASP C C 19 179.978 179.978 178.921 1.057 18518
7504 1 12 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.486 -0.064 18518
7505 1 12 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.783 0.503 18518
7506 1 12 . 1 1 19 19 ASP H H 19 8.671 8.671 8.283 0.388 18518
7507 1 12 . 1 1 20 20 VAL N N 20 119.730 119.730 120.414 -0.684 18518
7508 1 12 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.471 -0.266 18518
7509 1 12 . 1 1 20 20 VAL C C 20 176.284 176.284 176.820 -0.536 18518
7510 1 12 . 1 1 20 20 VAL CA C 20 66.315 66.315 65.477 0.838 18518
7511 1 12 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.215 -0.108 18518
7512 1 12 . 1 1 20 20 VAL H H 20 7.999 7.999 8.016 -0.017 18518
7513 1 12 . 1 1 21 21 ARG N N 21 121.455 121.455 120.338 1.117 18518
7514 1 12 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.889 -0.075 18518
7515 1 12 . 1 1 21 21 ARG C C 21 180.120 180.120 178.490 1.630 18518
7516 1 12 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.859 0.971 18518
7517 1 12 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.031 0.915 18518
7518 1 12 . 1 1 21 21 ARG H H 21 8.098 8.098 8.213 -0.115 18518
7519 1 12 . 1 1 22 22 LEU N N 22 117.826 117.826 120.907 -3.081 18518
7520 1 12 . 1 1 22 22 LEU HA H 22 4.049 4.049 3.993 0.056 18518
7521 1 12 . 1 1 22 22 LEU C C 22 180.115 180.115 178.538 1.577 18518
7522 1 12 . 1 1 22 22 LEU CA C 22 57.790 57.790 58.085 -0.295 18518
7523 1 12 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.701 0.441 18518
7524 1 12 . 1 1 22 22 LEU H H 22 8.207 8.207 8.194 0.013 18518
7525 1 12 . 1 1 23 23 ILE N N 23 121.450 121.450 119.169 2.281 18518
7526 1 12 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.715 0.298 18518
7527 1 12 . 1 1 23 23 ILE C C 23 178.149 178.149 177.576 0.573 18518
7528 1 12 . 1 1 23 23 ILE CA C 23 62.171 62.171 63.651 -1.480 18518
7529 1 12 . 1 1 23 23 ILE CB C 23 38.106 38.106 37.842 0.264 18518
7530 1 12 . 1 1 23 23 ILE H H 23 8.105 8.105 7.796 0.309 18518
7531 1 12 . 1 1 24 24 ARG N N 24 121.139 121.139 119.746 1.393 18518
7532 1 12 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.068 -0.081 18518
7533 1 12 . 1 1 24 24 ARG C C 24 178.702 178.702 178.827 -0.125 18518
7534 1 12 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.892 -1.174 18518
7535 1 12 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.737 -0.968 18518
7536 1 12 . 1 1 24 24 ARG H H 24 8.601 8.601 8.227 0.374 18518
7537 1 12 . 1 1 25 25 GLU N N 25 118.054 118.054 118.586 -0.532 18518
7538 1 12 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.106 -0.080 18518
7539 1 12 . 1 1 25 25 GLU C C 25 178.492 178.492 178.344 0.148 18518
7540 1 12 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.613 0.167 18518
7541 1 12 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.619 0.382 18518
7542 1 12 . 1 1 25 25 GLU H H 25 7.423 7.423 8.110 -0.687 18518
7543 1 12 . 1 1 26 26 GLN N N 26 116.350 116.350 116.460 -0.110 18518
7544 1 12 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.051 -0.115 18518
7545 1 12 . 1 1 26 26 GLN C C 26 176.305 176.305 176.841 -0.536 18518
7546 1 12 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.342 0.161 18518
7547 1 12 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.571 0.636 18518
7548 1 12 . 1 1 26 26 GLN H H 26 7.524 7.524 7.757 -0.233 18518
7549 1 12 . 1 1 27 27 HIS N N 27 116.017 116.017 118.829 -2.812 18518
7550 1 12 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.104 -0.174 18518
7551 1 12 . 1 1 27 27 HIS CA C 27 53.054 53.054 53.004 0.050 18518
7552 1 12 . 1 1 27 27 HIS CB C 27 30.747 30.747 29.753 0.994 18518
7553 1 12 . 1 1 27 27 HIS H H 27 8.284 8.284 8.167 0.117 18518
7554 1 12 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.571 0.010 18518
7555 1 12 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.430 0.489 18518
7556 1 12 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.238 0.217 18518
7557 1 12 . 1 1 29 29 THR N N 29 107.011 107.011 107.702 -0.691 18518
7558 1 12 . 1 1 29 29 THR HA H 29 4.599 4.599 4.317 0.282 18518
7559 1 12 . 1 1 29 29 THR C C 29 172.884 172.884 173.819 -0.935 18518
7560 1 12 . 1 1 29 29 THR CA C 29 60.810 60.810 61.786 -0.976 18518
7561 1 12 . 1 1 29 29 THR CB C 29 68.531 68.531 68.415 0.116 18518
7562 1 12 . 1 1 29 29 THR H H 29 7.890 7.890 8.386 -0.496 18518
7563 1 12 . 1 1 30 30 LYS N N 30 117.679 117.679 121.241 -3.562 18518
7564 1 12 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.933 -0.075 18518
7565 1 12 . 1 1 30 30 LYS C C 30 174.310 174.310 174.697 -0.387 18518
7566 1 12 . 1 1 30 30 LYS CA C 30 53.751 53.751 53.921 -0.170 18518
7567 1 12 . 1 1 30 30 LYS CB C 30 35.804 35.804 35.798 0.006 18518
7568 1 12 . 1 1 30 30 LYS H H 30 7.441 7.441 7.598 -0.157 18518
7569 1 12 . 1 1 31 31 ILE N N 31 122.849 122.849 123.402 -0.553 18518
7570 1 12 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.131 -0.026 18518
7571 1 12 . 1 1 31 31 ILE CA C 31 54.801 54.801 58.168 -3.367 18518
7572 1 12 . 1 1 31 31 ILE CB C 31 38.265 38.265 39.106 -0.841 18518
7573 1 12 . 1 1 31 31 ILE H H 31 9.304 9.304 8.871 0.433 18518
7574 1 12 . 1 1 32 32 PRO HA H 32 5.159 5.159 5.002 0.157 18518
7575 1 12 . 1 1 32 32 PRO C C 32 174.164 174.164 175.659 -1.495 18518
7576 1 12 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.164 -0.661 18518
7577 1 12 . 1 1 32 32 PRO CB C 32 31.145 31.145 31.105 0.040 18518
7578 1 12 . 1 1 33 33 VAL N N 33 125.606 125.606 125.617 -0.011 18518
7579 1 12 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.115 0.098 18518
7580 1 12 . 1 1 33 33 VAL C C 33 173.654 173.654 173.766 -0.112 18518
7581 1 12 . 1 1 33 33 VAL CA C 33 60.044 60.044 58.945 1.099 18518
7582 1 12 . 1 1 33 33 VAL CB C 33 35.604 35.604 36.305 -0.701 18518
7583 1 12 . 1 1 33 33 VAL H H 33 9.424 9.424 8.497 0.927 18518
7584 1 12 . 1 1 34 34 ILE N N 34 128.241 128.241 126.931 1.310 18518
7585 1 12 . 1 1 34 34 ILE HA H 34 4.833 4.833 5.084 -0.251 18518
7586 1 12 . 1 1 34 34 ILE C C 34 175.605 175.605 175.274 0.331 18518
7587 1 12 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.230 -1.465 18518
7588 1 12 . 1 1 34 34 ILE CB C 34 36.799 36.799 39.299 -2.500 18518
7589 1 12 . 1 1 34 34 ILE H H 34 8.721 8.721 8.984 -0.263 18518
7590 1 12 . 1 1 35 35 ILE N N 35 125.650 125.650 127.662 -2.012 18518
7591 1 12 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.795 0.041 18518
7592 1 12 . 1 1 35 35 ILE C C 35 174.887 174.887 174.714 0.173 18518
7593 1 12 . 1 1 35 35 ILE CA C 35 60.945 60.945 58.953 1.992 18518
7594 1 12 . 1 1 35 35 ILE CB C 35 39.210 39.210 37.865 1.345 18518
7595 1 12 . 1 1 35 35 ILE H H 35 9.034 9.034 8.905 0.129 18518
7596 1 12 . 1 1 36 36 GLU N N 36 122.657 122.657 127.737 -5.080 18518
7597 1 12 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.702 0.159 18518
7598 1 12 . 1 1 36 36 GLU C C 36 173.848 173.848 174.184 -0.336 18518
7599 1 12 . 1 1 36 36 GLU CA C 36 53.932 53.932 53.787 0.145 18518
7600 1 12 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.469 0.813 18518
7601 1 12 . 1 1 36 36 GLU H H 36 8.303 8.303 8.692 -0.389 18518
7602 1 12 . 1 1 37 37 ARG N N 37 123.228 123.228 124.700 -1.472 18518
7603 1 12 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.608 -0.882 18518
7604 1 12 . 1 1 37 37 ARG C C 37 176.359 176.359 175.698 0.661 18518
7605 1 12 . 1 1 37 37 ARG CA C 37 56.359 56.359 55.636 0.723 18518
7606 1 12 . 1 1 37 37 ARG CB C 37 31.341 31.341 31.069 0.272 18518
7607 1 12 . 1 1 37 37 ARG H H 37 8.856 8.856 8.426 0.430 18518
7608 1 12 . 1 1 38 38 TYR N N 38 128.981 128.981 127.738 1.243 18518
7609 1 12 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.214 0.138 18518
7610 1 12 . 1 1 38 38 TYR C C 38 177.316 177.316 176.501 0.815 18518
7611 1 12 . 1 1 38 38 TYR CA C 38 57.712 57.712 58.345 -0.633 18518
7612 1 12 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.075 -0.603 18518
7613 1 12 . 1 1 38 38 TYR H H 38 8.628 8.628 8.290 0.338 18518
7614 1 12 . 1 1 39 39 LYS N N 39 130.635 130.635 125.250 5.385 18518
7615 1 12 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.869 -0.047 18518
7616 1 12 . 1 1 39 39 LYS CA C 39 58.887 58.887 58.082 0.805 18518
7617 1 12 . 1 1 39 39 LYS CB C 39 31.771 31.771 32.007 -0.236 18518
7618 1 12 . 1 1 39 39 LYS H H 39 8.594 8.594 7.977 0.617 18518
7619 1 12 . 1 1 40 40 GLY C C 40 173.447 173.447 173.440 0.007 18518
7620 1 12 . 1 1 40 40 GLY CA C 40 44.663 44.663 43.914 0.749 18518
7621 1 12 . 1 1 40 40 GLY H H 40 5.188 5.188 6.326 -1.138 18518
7622 1 12 . 1 1 41 41 GLU N N 41 122.836 122.836 120.428 2.408 18518
7623 1 12 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.340 -0.083 18518
7624 1 12 . 1 1 41 41 GLU C C 41 176.524 176.524 175.896 0.628 18518
7625 1 12 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.113 0.412 18518
7626 1 12 . 1 1 41 41 GLU CB C 41 30.985 30.985 29.735 1.250 18518
7627 1 12 . 1 1 41 41 GLU H H 41 7.380 7.380 7.410 -0.030 18518
7628 1 12 . 1 1 42 42 LYS N N 42 124.040 124.040 123.991 0.049 18518
7629 1 12 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.520 0.155 18518
7630 1 12 . 1 1 42 42 LYS C C 42 177.538 177.538 177.257 0.281 18518
7631 1 12 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.484 -0.645 18518
7632 1 12 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.913 1.065 18518
7633 1 12 . 1 1 42 42 LYS H H 42 9.034 9.034 8.532 0.502 18518
7634 1 12 . 1 1 43 43 GLN N N 43 119.259 119.259 117.050 2.209 18518
7635 1 12 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.321 0.221 18518
7636 1 12 . 1 1 43 43 GLN C C 43 177.336 177.336 176.014 1.322 18518
7637 1 12 . 1 1 43 43 GLN CA C 43 57.673 57.673 56.747 0.926 18518
7638 1 12 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.298 0.484 18518
7639 1 12 . 1 1 43 43 GLN H H 43 8.435 8.435 8.732 -0.297 18518
7640 1 12 . 1 1 44 44 LEU N N 44 120.760 120.760 123.626 -2.866 18518
7641 1 12 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.823 -0.128 18518
7642 1 12 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.219 1.026 18518
7643 1 12 . 1 1 44 44 LEU CB C 44 43.596 43.596 41.684 1.912 18518
7644 1 12 . 1 1 44 44 LEU H H 44 9.126 9.126 8.336 0.790 18518
7645 1 12 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.533 0.184 18518
7646 1 12 . 1 1 45 45 PRO C C 45 175.797 175.797 176.085 -0.288 18518
7647 1 12 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.352 -0.241 18518
7648 1 12 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.448 0.144 18518
7649 1 12 . 1 1 46 46 VAL N N 46 119.052 119.052 121.263 -2.211 18518
7650 1 12 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.658 -0.791 18518
7651 1 12 . 1 1 46 46 VAL C C 46 175.640 175.640 176.309 -0.669 18518
7652 1 12 . 1 1 46 46 VAL CA C 46 62.944 62.944 61.463 1.481 18518
7653 1 12 . 1 1 46 46 VAL CB C 46 32.799 32.799 33.684 -0.885 18518
7654 1 12 . 1 1 46 46 VAL H H 46 8.543 8.543 8.203 0.340 18518
7655 1 12 . 1 1 47 47 LEU N N 47 130.203 130.203 126.839 3.364 18518
7656 1 12 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.414 -0.105 18518
7657 1 12 . 1 1 47 47 LEU C C 47 176.198 176.198 177.344 -1.146 18518
7658 1 12 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.310 -0.304 18518
7659 1 12 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.438 1.394 18518
7660 1 12 . 1 1 47 47 LEU H H 47 7.799 7.799 8.557 -0.758 18518
7661 1 12 . 1 1 48 48 ASP N N 48 122.403 122.403 119.561 2.842 18518
7662 1 12 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.582 -0.319 18518
7663 1 12 . 1 1 48 48 ASP C C 48 175.294 175.294 175.677 -0.383 18518
7664 1 12 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.859 -0.027 18518
7665 1 12 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.415 -1.231 18518
7666 1 12 . 1 1 48 48 ASP H H 48 8.780 8.780 8.523 0.257 18518
7667 1 12 . 1 1 49 49 LYS N N 49 119.569 119.569 117.746 1.823 18518
7668 1 12 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.540 0.044 18518
7669 1 12 . 1 1 49 49 LYS C C 49 174.678 174.678 175.641 -0.963 18518
7670 1 12 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.513 -1.861 18518
7671 1 12 . 1 1 49 49 LYS CB C 49 35.945 35.945 35.416 0.529 18518
7672 1 12 . 1 1 49 49 LYS H H 49 7.280 7.280 7.986 -0.706 18518
7673 1 12 . 1 1 50 50 THR N N 50 110.862 110.862 111.989 -1.127 18518
7674 1 12 . 1 1 50 50 THR HA H 50 4.811 4.811 4.649 0.162 18518
7675 1 12 . 1 1 50 50 THR C C 50 172.425 172.425 174.509 -2.084 18518
7676 1 12 . 1 1 50 50 THR CA C 50 62.645 62.645 62.873 -0.228 18518
7677 1 12 . 1 1 50 50 THR CB C 50 71.648 71.648 69.959 1.689 18518
7678 1 12 . 1 1 50 50 THR H H 50 8.042 8.042 8.202 -0.160 18518
7679 1 12 . 1 1 51 51 LYS N N 51 120.008 120.008 122.693 -2.685 18518
7680 1 12 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.604 0.021 18518
7681 1 12 . 1 1 51 51 LYS C C 51 175.082 175.082 175.981 -0.899 18518
7682 1 12 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.898 -2.194 18518
7683 1 12 . 1 1 51 51 LYS CB C 51 32.376 32.376 32.497 -0.121 18518
7684 1 12 . 1 1 51 51 LYS H H 51 7.119 7.119 7.814 -0.695 18518
7685 1 12 . 1 1 52 52 PHE N N 52 122.640 122.640 125.284 -2.644 18518
7686 1 12 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.766 0.571 18518
7687 1 12 . 1 1 52 52 PHE C C 52 174.213 174.213 174.235 -0.022 18518
7688 1 12 . 1 1 52 52 PHE CA C 52 56.611 56.611 57.120 -0.509 18518
7689 1 12 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.085 0.055 18518
7690 1 12 . 1 1 52 52 PHE H H 52 9.709 9.709 9.352 0.357 18518
7691 1 12 . 1 1 53 53 LEU N N 53 122.157 122.157 123.344 -1.187 18518
7692 1 12 . 1 1 53 53 LEU HA H 53 4.947 4.947 5.002 -0.055 18518
7693 1 12 . 1 1 53 53 LEU C C 53 175.769 175.769 175.106 0.663 18518
7694 1 12 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.853 -0.896 18518
7695 1 12 . 1 1 53 53 LEU CB C 53 44.415 44.415 44.064 0.351 18518
7696 1 12 . 1 1 53 53 LEU H H 53 8.959 8.959 8.369 0.590 18518
7697 1 12 . 1 1 54 54 VAL N N 54 124.919 124.919 124.003 0.916 18518
7698 1 12 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.546 0.013 18518
7699 1 12 . 1 1 54 54 VAL CA C 54 59.130 59.130 57.870 1.260 18518
7700 1 12 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.264 1.704 18518
7701 1 12 . 1 1 54 54 VAL H H 54 8.922 8.922 8.466 0.456 18518
7702 1 12 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.831 -0.390 18518
7703 1 12 . 1 1 55 55 PRO C C 55 176.594 176.594 178.164 -1.570 18518
7704 1 12 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.197 2.118 18518
7705 1 12 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.097 0.568 18518
7706 1 12 . 1 1 56 56 ASP N N 56 120.522 120.522 123.377 -2.855 18518
7707 1 12 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.181 -0.319 18518
7708 1 12 . 1 1 56 56 ASP C C 56 175.809 175.809 176.241 -0.432 18518
7709 1 12 . 1 1 56 56 ASP CA C 56 56.749 56.749 56.645 0.104 18518
7710 1 12 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.204 0.306 18518
7711 1 12 . 1 1 56 56 ASP H H 56 8.347 8.347 8.326 0.021 18518
7712 1 12 . 1 1 57 57 HIS N N 57 113.482 113.482 113.761 -0.279 18518
7713 1 12 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.555 0.165 18518
7714 1 12 . 1 1 57 57 HIS C C 57 176.507 176.507 175.500 1.007 18518
7715 1 12 . 1 1 57 57 HIS CA C 57 55.589 55.589 56.130 -0.541 18518
7716 1 12 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.828 0.815 18518
7717 1 12 . 1 1 57 57 HIS H H 57 7.557 7.557 8.115 -0.558 18518
7718 1 12 . 1 1 58 58 VAL N N 58 123.279 123.279 118.077 5.202 18518
7719 1 12 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.517 -0.681 18518
7720 1 12 . 1 1 58 58 VAL C C 58 175.019 175.019 174.969 0.050 18518
7721 1 12 . 1 1 58 58 VAL CA C 58 62.823 62.823 60.242 2.581 18518
7722 1 12 . 1 1 58 58 VAL CB C 58 32.310 32.310 33.632 -1.322 18518
7723 1 12 . 1 1 58 58 VAL H H 58 7.345 7.345 7.467 -0.122 18518
7724 1 12 . 1 1 59 59 ASN N N 59 123.781 123.781 117.413 6.368 18518
7725 1 12 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.006 0.120 18518
7726 1 12 . 1 1 59 59 ASN C C 59 176.558 176.558 176.493 0.065 18518
7727 1 12 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.297 0.188 18518
7728 1 12 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.936 -0.829 18518
7729 1 12 . 1 1 59 59 ASN H H 59 8.735 8.735 8.166 0.569 18518
7730 1 12 . 1 1 60 60 MET N N 60 117.453 117.453 118.450 -0.997 18518
7731 1 12 . 1 1 60 60 MET HA H 60 4.395 4.395 4.094 0.301 18518
7732 1 12 . 1 1 60 60 MET C C 60 178.144 178.144 178.271 -0.127 18518
7733 1 12 . 1 1 60 60 MET CA C 60 57.097 57.097 58.096 -0.999 18518
7734 1 12 . 1 1 60 60 MET CB C 60 30.140 30.140 31.335 -1.195 18518
7735 1 12 . 1 1 60 60 MET H H 60 8.227 8.227 8.318 -0.091 18518
7736 1 12 . 1 1 61 61 SER N N 61 114.216 114.216 115.423 -1.207 18518
7737 1 12 . 1 1 61 61 SER HA H 61 4.111 4.111 4.083 0.028 18518
7738 1 12 . 1 1 61 61 SER C C 61 177.335 177.335 177.075 0.260 18518
7739 1 12 . 1 1 61 61 SER CA C 61 61.590 61.590 62.423 -0.833 18518
7740 1 12 . 1 1 61 61 SER CB C 61 62.402 62.402 62.518 -0.116 18518
7741 1 12 . 1 1 61 61 SER H H 61 8.464 8.464 8.593 -0.129 18518
7742 1 12 . 1 1 62 62 GLU N N 62 123.004 123.004 121.302 1.702 18518
7743 1 12 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.065 -0.018 18518
7744 1 12 . 1 1 62 62 GLU C C 62 178.686 178.686 178.852 -0.166 18518
7745 1 12 . 1 1 62 62 GLU CA C 62 58.625 58.625 59.106 -0.481 18518
7746 1 12 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.396 0.258 18518
7747 1 12 . 1 1 62 62 GLU H H 62 7.994 7.994 7.582 0.412 18518
7748 1 12 . 1 1 63 63 LEU N N 63 120.818 120.818 121.658 -0.840 18518
7749 1 12 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.979 -0.014 18518
7750 1 12 . 1 1 63 63 LEU C C 63 178.046 178.046 178.905 -0.859 18518
7751 1 12 . 1 1 63 63 LEU CA C 63 57.920 57.920 57.924 -0.004 18518
7752 1 12 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.602 0.021 18518
7753 1 12 . 1 1 63 63 LEU H H 63 8.130 8.130 7.805 0.325 18518
7754 1 12 . 1 1 64 64 ILE N N 64 118.528 118.528 119.551 -1.023 18518
7755 1 12 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.621 -0.252 18518
7756 1 12 . 1 1 64 64 ILE C C 64 177.127 177.127 177.678 -0.551 18518
7757 1 12 . 1 1 64 64 ILE CA C 64 66.678 66.678 66.126 0.552 18518
7758 1 12 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.558 0.886 18518
7759 1 12 . 1 1 64 64 ILE H H 64 8.488 8.488 8.669 -0.181 18518
7760 1 12 . 1 1 65 65 LYS N N 65 118.336 118.336 120.768 -2.432 18518
7761 1 12 . 1 1 65 65 LYS HA H 65 3.701 3.701 4.016 -0.315 18518
7762 1 12 . 1 1 65 65 LYS C C 65 179.291 179.291 179.155 0.136 18518
7763 1 12 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.947 0.493 18518
7764 1 12 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.230 0.141 18518
7765 1 12 . 1 1 65 65 LYS H H 65 7.347 7.347 7.943 -0.596 18518
7766 1 12 . 1 1 66 66 ILE N N 66 120.171 120.171 120.683 -0.512 18518
7767 1 12 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.702 -0.124 18518
7768 1 12 . 1 1 66 66 ILE C C 66 178.873 178.873 178.300 0.573 18518
7769 1 12 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.245 -0.085 18518
7770 1 12 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.949 0.684 18518
7771 1 12 . 1 1 66 66 ILE H H 66 7.901 7.901 8.251 -0.350 18518
7772 1 12 . 1 1 67 67 ILE N N 67 121.185 121.185 120.738 0.447 18518
7773 1 12 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.571 -0.125 18518
7774 1 12 . 1 1 67 67 ILE C C 67 177.150 177.150 177.600 -0.450 18518
7775 1 12 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.207 -1.401 18518
7776 1 12 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.327 -2.332 18518
7777 1 12 . 1 1 67 67 ILE H H 67 8.290 8.290 8.339 -0.049 18518
7778 1 12 . 1 1 68 68 ARG N N 68 119.173 119.173 119.199 -0.026 18518
7779 1 12 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.810 -0.879 18518
7780 1 12 . 1 1 68 68 ARG C C 68 178.496 178.496 178.680 -0.184 18518
7781 1 12 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.929 0.707 18518
7782 1 12 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.922 0.518 18518
7783 1 12 . 1 1 68 68 ARG H H 68 8.438 8.438 8.190 0.248 18518
7784 1 12 . 1 1 69 69 ARG N N 69 116.511 116.511 119.924 -3.413 18518
7785 1 12 . 1 1 69 69 ARG HA H 69 4.134 4.134 4.018 0.116 18518
7786 1 12 . 1 1 69 69 ARG C C 69 180.262 180.262 179.091 1.171 18518
7787 1 12 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.182 -0.475 18518
7788 1 12 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.051 -0.098 18518
7789 1 12 . 1 1 69 69 ARG H H 69 7.497 7.497 8.353 -0.856 18518
7790 1 12 . 1 1 70 70 ARG N N 70 123.297 123.297 119.596 3.701 18518
7791 1 12 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.124 -0.108 18518
7792 1 12 . 1 1 70 70 ARG C C 70 178.700 178.700 178.251 0.449 18518
7793 1 12 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.754 0.706 18518
7794 1 12 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.699 0.613 18518
7795 1 12 . 1 1 70 70 ARG H H 70 8.075 8.075 7.928 0.147 18518
7796 1 12 . 1 1 71 71 LEU N N 71 116.829 116.829 118.122 -1.293 18518
7797 1 12 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.366 -0.301 18518
7798 1 12 . 1 1 71 71 LEU C C 71 174.956 174.956 176.004 -1.048 18518
7799 1 12 . 1 1 71 71 LEU CA C 71 55.126 55.126 54.818 0.308 18518
7800 1 12 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.106 1.140 18518
7801 1 12 . 1 1 71 71 LEU H H 71 7.719 7.719 7.750 -0.031 18518
7802 1 12 . 1 1 72 72 GLN N N 72 114.991 114.991 114.395 0.596 18518
7803 1 12 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.843 -0.007 18518
7804 1 12 . 1 1 72 72 GLN C C 72 175.683 175.683 175.295 0.388 18518
7805 1 12 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.343 -0.018 18518
7806 1 12 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.897 0.107 18518
7807 1 12 . 1 1 72 72 GLN H H 72 7.744 7.744 7.542 0.202 18518
7808 1 12 . 1 1 73 73 LEU N N 73 115.045 115.045 119.377 -4.332 18518
7809 1 12 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.037 0.199 18518
7810 1 12 . 1 1 73 73 LEU C C 73 178.762 178.762 177.283 1.479 18518
7811 1 12 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.230 -0.844 18518
7812 1 12 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.285 0.805 18518
7813 1 12 . 1 1 73 73 LEU H H 73 7.500 7.500 7.677 -0.177 18518
7814 1 12 . 1 1 74 74 ASN N N 74 121.700 121.700 123.723 -2.023 18518
7815 1 12 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.489 0.201 18518
7816 1 12 . 1 1 74 74 ASN C C 74 176.617 176.617 175.997 0.620 18518
7817 1 12 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.970 -1.285 18518
7818 1 12 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.814 -0.216 18518
7819 1 12 . 1 1 74 74 ASN H H 74 9.045 9.045 8.582 0.463 18518
7820 1 12 . 1 1 75 75 ALA N N 75 123.952 123.952 122.771 1.181 18518
7821 1 12 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.277 -0.313 18518
7822 1 12 . 1 1 75 75 ALA C C 75 178.131 178.131 177.652 0.479 18518
7823 1 12 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.374 1.494 18518
7824 1 12 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.400 -0.682 18518
7825 1 12 . 1 1 75 75 ALA H H 75 8.784 8.784 8.688 0.096 18518
7826 1 12 . 1 1 76 76 ASN N N 76 112.295 112.295 115.930 -3.635 18518
7827 1 12 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.618 -0.038 18518
7828 1 12 . 1 1 76 76 ASN C C 76 175.448 175.448 175.346 0.102 18518
7829 1 12 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.779 -0.565 18518
7830 1 12 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.949 -0.629 18518
7831 1 12 . 1 1 76 76 ASN H H 76 8.391 8.391 8.108 0.283 18518
7832 1 12 . 1 1 77 77 GLN N N 77 120.577 120.577 118.892 1.685 18518
7833 1 12 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.525 -0.252 18518
7834 1 12 . 1 1 77 77 GLN C C 77 175.045 175.045 174.151 0.894 18518
7835 1 12 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.840 0.965 18518
7836 1 12 . 1 1 77 77 GLN CB C 77 30.157 30.157 30.258 -0.101 18518
7837 1 12 . 1 1 77 77 GLN H H 77 7.552 7.552 7.692 -0.140 18518
7838 1 12 . 1 1 78 78 ALA N N 78 130.670 130.670 126.200 4.470 18518
7839 1 12 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.527 -0.356 18518
7840 1 12 . 1 1 78 78 ALA C C 78 176.512 176.512 176.125 0.387 18518
7841 1 12 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.282 1.560 18518
7842 1 12 . 1 1 78 78 ALA CB C 78 20.060 20.060 20.735 -0.675 18518
7843 1 12 . 1 1 78 78 ALA H H 78 8.799 8.799 8.362 0.437 18518
7844 1 12 . 1 1 79 79 PHE N N 79 119.325 119.325 116.803 2.522 18518
7845 1 12 . 1 1 79 79 PHE HA H 79 4.434 4.434 4.758 -0.324 18518
7846 1 12 . 1 1 79 79 PHE C C 79 171.726 171.726 172.677 -0.951 18518
7847 1 12 . 1 1 79 79 PHE CA C 79 59.145 59.145 57.139 2.006 18518
7848 1 12 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.237 0.934 18518
7849 1 12 . 1 1 79 79 PHE H H 79 7.664 7.664 7.975 -0.311 18518
7850 1 12 . 1 1 80 80 PHE N N 80 126.314 126.314 117.727 8.587 18518
7851 1 12 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.607 -0.215 18518
7852 1 12 . 1 1 80 80 PHE C C 80 177.169 177.169 173.797 3.372 18518
7853 1 12 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.159 0.494 18518
7854 1 12 . 1 1 80 80 PHE CB C 80 41.933 41.933 43.552 -1.619 18518
7855 1 12 . 1 1 80 80 PHE H H 80 8.508 8.508 9.061 -0.553 18518
7856 1 12 . 1 1 81 81 LEU N N 81 121.426 121.426 122.888 -1.462 18518
7857 1 12 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.287 -0.436 18518
7858 1 12 . 1 1 81 81 LEU C C 81 174.488 174.488 174.887 -0.399 18518
7859 1 12 . 1 1 81 81 LEU CA C 81 53.197 53.197 53.761 -0.564 18518
7860 1 12 . 1 1 81 81 LEU CB C 81 45.100 45.100 44.451 0.649 18518
7861 1 12 . 1 1 81 81 LEU H H 81 8.229 8.229 8.348 -0.119 18518
7862 1 12 . 1 1 82 82 LEU N N 82 125.155 125.155 126.903 -1.748 18518
7863 1 12 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.608 0.225 18518
7864 1 12 . 1 1 82 82 LEU C C 82 177.166 177.166 175.173 1.993 18518
7865 1 12 . 1 1 82 82 LEU CA C 82 54.197 54.197 53.663 0.534 18518
7866 1 12 . 1 1 82 82 LEU CB C 82 43.442 43.442 44.826 -1.384 18518
7867 1 12 . 1 1 82 82 LEU H H 82 9.400 9.400 9.071 0.329 18518
7868 1 12 . 1 1 83 83 VAL N N 83 123.886 123.886 123.378 0.508 18518
7869 1 12 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.319 0.060 18518
7870 1 12 . 1 1 83 83 VAL C C 83 175.810 175.810 176.889 -1.079 18518
7871 1 12 . 1 1 83 83 VAL CA C 83 61.677 61.677 62.448 -0.771 18518
7872 1 12 . 1 1 83 83 VAL CB C 83 33.758 33.758 31.689 2.069 18518
7873 1 12 . 1 1 83 83 VAL H H 83 8.721 8.721 8.311 0.410 18518
7874 1 12 . 1 1 84 84 ASN N N 84 126.474 126.474 125.607 0.867 18518
7875 1 12 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.460 -0.064 18518
7876 1 12 . 1 1 84 84 ASN C C 84 175.164 175.164 175.264 -0.100 18518
7877 1 12 . 1 1 84 84 ASN CA C 84 54.738 54.738 55.323 -0.585 18518
7878 1 12 . 1 1 84 84 ASN CB C 84 37.950 37.950 38.287 -0.337 18518
7879 1 12 . 1 1 84 84 ASN H H 84 9.707 9.707 9.469 0.238 18518
7880 1 12 . 1 1 85 85 GLY N N 85 101.296 101.296 104.954 -3.658 18518
7881 1 12 . 1 1 85 85 GLY C C 85 173.680 173.680 173.133 0.547 18518
7882 1 12 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.794 0.809 18518
7883 1 12 . 1 1 85 85 GLY H H 85 8.644 8.644 8.280 0.364 18518
7884 1 12 . 1 1 86 86 HIS N N 86 117.238 117.238 119.962 -2.724 18518
7885 1 12 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.777 0.240 18518
7886 1 12 . 1 1 86 86 HIS C C 86 173.841 173.841 174.292 -0.451 18518
7887 1 12 . 1 1 86 86 HIS CA C 86 53.796 53.796 54.488 -0.692 18518
7888 1 12 . 1 1 86 86 HIS CB C 86 31.280 31.280 31.964 -0.684 18518
7889 1 12 . 1 1 86 86 HIS H H 86 7.918 7.918 8.354 -0.436 18518
7890 1 12 . 1 1 87 87 SER N N 87 118.179 118.179 121.395 -3.216 18518
7891 1 12 . 1 1 87 87 SER HA H 87 4.699 4.699 4.602 0.097 18518
7892 1 12 . 1 1 87 87 SER C C 87 175.904 175.904 174.356 1.548 18518
7893 1 12 . 1 1 87 87 SER CA C 87 58.271 58.271 58.274 -0.003 18518
7894 1 12 . 1 1 87 87 SER CB C 87 63.735 63.735 62.524 1.211 18518
7895 1 12 . 1 1 87 87 SER H H 87 8.977 8.977 8.780 0.197 18518
7896 1 12 . 1 1 88 88 MET N N 88 125.472 125.472 122.805 2.667 18518
7897 1 12 . 1 1 88 88 MET HA H 88 4.830 4.830 4.505 0.325 18518
7898 1 12 . 1 1 88 88 MET C C 88 176.419 176.419 176.753 -0.334 18518
7899 1 12 . 1 1 88 88 MET CA C 88 54.899 54.899 55.755 -0.856 18518
7900 1 12 . 1 1 88 88 MET CB C 88 33.336 33.336 32.516 0.820 18518
7901 1 12 . 1 1 88 88 MET H H 88 9.184 9.184 8.544 0.640 18518
7902 1 12 . 1 1 89 89 VAL N N 89 120.747 120.747 119.591 1.156 18518
7903 1 12 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.161 0.071 18518
7904 1 12 . 1 1 89 89 VAL C C 89 175.958 175.958 175.231 0.727 18518
7905 1 12 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.383 1.771 18518
7906 1 12 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.335 -1.457 18518
7907 1 12 . 1 1 89 89 VAL H H 89 8.233 8.233 7.961 0.272 18518
7908 1 12 . 1 1 90 90 SER N N 90 117.362 117.362 117.030 0.332 18518
7909 1 12 . 1 1 90 90 SER HA H 90 4.590 4.590 4.807 -0.217 18518
7910 1 12 . 1 1 90 90 SER C C 90 175.741 175.741 175.764 -0.023 18518
7911 1 12 . 1 1 90 90 SER CA C 90 57.717 57.717 56.998 0.719 18518
7912 1 12 . 1 1 90 90 SER CB C 90 63.223 63.223 65.045 -1.822 18518
7913 1 12 . 1 1 90 90 SER H H 90 8.482 8.482 8.271 0.211 18518
7914 1 12 . 1 1 91 91 VAL N N 91 120.466 120.466 119.474 0.992 18518
7915 1 12 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.907 0.140 18518
7916 1 12 . 1 1 91 91 VAL C C 91 176.329 176.329 176.367 -0.038 18518
7917 1 12 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.439 -0.947 18518
7918 1 12 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.669 0.898 18518
7919 1 12 . 1 1 91 91 VAL H H 91 8.188 8.188 8.612 -0.424 18518
7920 1 12 . 1 1 92 92 SER N N 92 116.398 116.398 115.731 0.667 18518
7921 1 12 . 1 1 92 92 SER HA H 92 4.636 4.636 4.406 0.230 18518
7922 1 12 . 1 1 92 92 SER C C 92 174.159 174.159 174.813 -0.654 18518
7923 1 12 . 1 1 92 92 SER CA C 92 57.805 57.805 59.157 -1.351 18518
7924 1 12 . 1 1 92 92 SER CB C 92 63.046 63.046 63.059 -0.014 18518
7925 1 12 . 1 1 92 92 SER H H 92 8.370 8.370 8.417 -0.047 18518
7926 1 12 . 1 1 93 93 THR N N 93 119.211 119.211 119.645 -0.434 18518
7927 1 12 . 1 1 93 93 THR HA H 93 4.484 4.484 4.654 -0.170 18518
7928 1 12 . 1 1 93 93 THR CA C 93 60.884 60.884 60.621 0.263 18518
7929 1 12 . 1 1 93 93 THR CB C 93 70.609 70.609 69.019 1.591 18518
7930 1 12 . 1 1 93 93 THR H H 93 7.416 7.416 7.460 -0.044 18518
7931 1 12 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.558 -0.118 18518
7932 1 12 . 1 1 94 94 PRO C C 94 178.775 178.775 177.091 1.684 18518
7933 1 12 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.354 0.589 18518
7934 1 12 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.771 -0.122 18518
7935 1 12 . 1 1 95 95 ILE N N 95 124.174 124.174 122.998 1.176 18518
7936 1 12 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.851 0.098 18518
7937 1 12 . 1 1 95 95 ILE C C 95 176.498 176.498 176.996 -0.498 18518
7938 1 12 . 1 1 95 95 ILE CA C 95 63.904 63.904 63.279 0.625 18518
7939 1 12 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.220 -0.038 18518
7940 1 12 . 1 1 95 95 ILE H H 95 9.305 9.305 7.793 1.512 18518
7941 1 12 . 1 1 96 96 SER N N 96 116.920 116.920 116.749 0.171 18518
7942 1 12 . 1 1 96 96 SER HA H 96 4.029 4.029 4.075 -0.046 18518
7943 1 12 . 1 1 96 96 SER C C 96 176.574 176.574 176.258 0.316 18518
7944 1 12 . 1 1 96 96 SER CA C 96 61.356 61.356 61.978 -0.622 18518
7945 1 12 . 1 1 96 96 SER CB C 96 61.723 61.723 62.367 -0.644 18518
7946 1 12 . 1 1 96 96 SER H H 96 8.335 8.335 8.623 -0.288 18518
7947 1 12 . 1 1 97 97 GLU N N 97 123.255 123.255 122.978 0.277 18518
7948 1 12 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.348 -0.070 18518
7949 1 12 . 1 1 97 97 GLU C C 97 179.716 179.716 178.887 0.829 18518
7950 1 12 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.584 0.207 18518
7951 1 12 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.196 0.366 18518
7952 1 12 . 1 1 97 97 GLU H H 97 7.376 7.376 7.997 -0.621 18518
7953 1 12 . 1 1 98 98 VAL N N 98 121.137 121.137 120.651 0.486 18518
7954 1 12 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.685 0.117 18518
7955 1 12 . 1 1 98 98 VAL C C 98 177.637 177.637 177.981 -0.344 18518
7956 1 12 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.552 -0.728 18518
7957 1 12 . 1 1 98 98 VAL CB C 98 32.154 32.154 31.256 0.898 18518
7958 1 12 . 1 1 98 98 VAL H H 98 7.387 7.387 7.813 -0.426 18518
7959 1 12 . 1 1 99 99 TYR N N 99 118.927 118.927 121.653 -2.726 18518
7960 1 12 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.020 -0.030 18518
7961 1 12 . 1 1 99 99 TYR C C 99 176.081 176.081 176.963 -0.882 18518
7962 1 12 . 1 1 99 99 TYR CA C 99 62.223 62.223 61.551 0.672 18518
7963 1 12 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.442 0.540 18518
7964 1 12 . 1 1 99 99 TYR H H 99 9.048 9.048 8.376 0.672 18518
7965 1 12 . 1 1 100 100 GLU N N 100 113.894 113.894 116.112 -2.218 18518
7966 1 12 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.788 0.058 18518
7967 1 12 . 1 1 100 100 GLU C C 100 177.989 177.989 178.089 -0.100 18518
7968 1 12 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.386 0.701 18518
7969 1 12 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.956 0.426 18518
7970 1 12 . 1 1 100 100 GLU H H 100 7.422 7.422 8.047 -0.625 18518
7971 1 12 . 1 1 101 101 SER N N 101 108.991 108.991 113.480 -4.489 18518
7972 1 12 . 1 1 101 101 SER HA H 101 4.524 4.524 4.428 0.096 18518
7973 1 12 . 1 1 101 101 SER C C 101 176.628 176.628 175.342 1.286 18518
7974 1 12 . 1 1 101 101 SER CA C 101 60.349 60.349 59.681 0.668 18518
7975 1 12 . 1 1 101 101 SER CB C 101 64.741 64.741 64.103 0.638 18518
7976 1 12 . 1 1 101 101 SER H H 101 7.424 7.424 7.800 -0.376 18518
7977 1 12 . 1 1 102 102 GLU N N 102 116.533 116.533 119.294 -2.761 18518
7978 1 12 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.597 0.147 18518
7979 1 12 . 1 1 102 102 GLU C C 102 176.774 176.774 175.449 1.325 18518
7980 1 12 . 1 1 102 102 GLU CA C 102 55.581 55.581 55.719 -0.138 18518
7981 1 12 . 1 1 102 102 GLU CB C 102 30.697 30.697 31.467 -0.770 18518
7982 1 12 . 1 1 102 102 GLU H H 102 8.487 8.487 7.799 0.688 18518
7983 1 12 . 1 1 103 103 LYS N N 103 118.370 118.370 120.387 -2.017 18518
7984 1 12 . 1 1 103 103 LYS HA H 103 4.178 4.178 3.938 0.240 18518
7985 1 12 . 1 1 103 103 LYS C C 103 175.018 175.018 176.687 -1.669 18518
7986 1 12 . 1 1 103 103 LYS CA C 103 57.329 57.329 56.728 0.601 18518
7987 1 12 . 1 1 103 103 LYS CB C 103 32.186 32.186 31.330 0.856 18518
7988 1 12 . 1 1 103 103 LYS H H 103 7.831 7.831 7.571 0.260 18518
7989 1 12 . 1 1 104 104 ASP N N 104 123.500 123.500 125.527 -2.027 18518
7990 1 12 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.692 0.063 18518
7991 1 12 . 1 1 104 104 ASP C C 104 177.383 177.383 177.669 -0.286 18518
7992 1 12 . 1 1 104 104 ASP CA C 104 53.846 53.846 54.627 -0.781 18518
7993 1 12 . 1 1 104 104 ASP CB C 104 43.411 43.411 42.202 1.209 18518
7994 1 12 . 1 1 104 104 ASP H H 104 9.041 9.041 8.216 0.825 18518
7995 1 12 . 1 1 105 105 GLU N N 105 125.448 125.448 121.591 3.857 18518
7996 1 12 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.108 0.072 18518
7997 1 12 . 1 1 105 105 GLU C C 105 177.519 177.519 176.608 0.911 18518
7998 1 12 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.919 0.610 18518
7999 1 12 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.662 0.382 18518
8000 1 12 . 1 1 105 105 GLU H H 105 8.906 8.906 8.923 -0.017 18518
8001 1 12 . 1 1 106 106 ASP N N 106 118.824 118.824 115.129 3.695 18518
8002 1 12 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.620 -0.441 18518
8003 1 12 . 1 1 106 106 ASP C C 106 176.223 176.223 177.230 -1.007 18518
8004 1 12 . 1 1 106 106 ASP CA C 106 54.756 54.756 53.958 0.798 18518
8005 1 12 . 1 1 106 106 ASP CB C 106 39.999 39.999 40.528 -0.529 18518
8006 1 12 . 1 1 106 106 ASP H H 106 10.036 10.036 8.165 1.871 18518
8007 1 12 . 1 1 107 107 GLY N N 107 105.866 105.866 107.445 -1.579 18518
8008 1 12 . 1 1 107 107 GLY C C 107 175.136 175.136 173.750 1.386 18518
8009 1 12 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.034 0.188 18518
8010 1 12 . 1 1 107 107 GLY H H 107 8.001 8.001 7.819 0.182 18518
8011 1 12 . 1 1 108 108 PHE N N 108 123.820 123.820 120.832 2.988 18518
8012 1 12 . 1 1 108 108 PHE HA H 108 4.662 4.662 5.188 -0.526 18518
8013 1 12 . 1 1 108 108 PHE C C 108 174.899 174.899 174.384 0.515 18518
8014 1 12 . 1 1 108 108 PHE CA C 108 60.238 60.238 58.512 1.726 18518
8015 1 12 . 1 1 108 108 PHE CB C 108 40.365 40.365 40.945 -0.580 18518
8016 1 12 . 1 1 108 108 PHE H H 108 9.912 9.912 8.201 1.711 18518
8017 1 12 . 1 1 109 109 LEU N N 109 120.130 120.130 121.292 -1.162 18518
8018 1 12 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.736 0.294 18518
8019 1 12 . 1 1 109 109 LEU C C 109 173.916 173.916 174.623 -0.707 18518
8020 1 12 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.624 -0.200 18518
8021 1 12 . 1 1 109 109 LEU CB C 109 45.203 45.203 44.922 0.281 18518
8022 1 12 . 1 1 109 109 LEU H H 109 7.997 7.997 8.456 -0.459 18518
8023 1 12 . 1 1 110 110 TYR N N 110 126.579 126.579 124.863 1.716 18518
8024 1 12 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.750 0.253 18518
8025 1 12 . 1 1 110 110 TYR C C 110 176.671 176.671 174.873 1.798 18518
8026 1 12 . 1 1 110 110 TYR CA C 110 59.058 59.058 57.490 1.568 18518
8027 1 12 . 1 1 110 110 TYR CB C 110 39.556 39.556 39.777 -0.221 18518
8028 1 12 . 1 1 110 110 TYR H H 110 9.377 9.377 8.955 0.422 18518
8029 1 12 . 1 1 111 111 MET N N 111 119.240 119.240 121.842 -2.602 18518
8030 1 12 . 1 1 111 111 MET HA H 111 5.486 5.486 5.193 0.293 18518
8031 1 12 . 1 1 111 111 MET C C 111 175.695 175.695 174.814 0.881 18518
8032 1 12 . 1 1 111 111 MET CA C 111 54.124 54.124 54.605 -0.481 18518
8033 1 12 . 1 1 111 111 MET CB C 111 36.960 36.960 36.708 0.252 18518
8034 1 12 . 1 1 111 111 MET H H 111 9.658 9.658 9.112 0.546 18518
8035 1 12 . 1 1 112 112 VAL N N 112 119.865 119.865 116.030 3.835 18518
8036 1 12 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.552 0.411 18518
8037 1 12 . 1 1 112 112 VAL C C 112 175.058 175.058 174.573 0.485 18518
8038 1 12 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.110 -0.199 18518
8039 1 12 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.214 0.837 18518
8040 1 12 . 1 1 112 112 VAL H H 112 8.794 8.794 9.148 -0.354 18518
8041 1 12 . 1 1 113 113 TYR N N 113 119.664 119.664 119.311 0.353 18518
8042 1 12 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.795 0.323 18518
8043 1 12 . 1 1 113 113 TYR C C 113 173.375 173.375 173.549 -0.174 18518
8044 1 12 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.379 -1.226 18518
8045 1 12 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.692 1.620 18518
8046 1 12 . 1 1 113 113 TYR H H 113 8.315 8.315 8.415 -0.100 18518
8047 1 12 . 1 1 114 114 ALA N N 114 119.763 119.763 123.639 -3.876 18518
8048 1 12 . 1 1 114 114 ALA HA H 114 4.800 4.800 5.192 -0.392 18518
8049 1 12 . 1 1 114 114 ALA C C 114 176.216 176.216 175.400 0.816 18518
8050 1 12 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.447 -0.315 18518
8051 1 12 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.700 1.896 18518
8052 1 12 . 1 1 114 114 ALA H H 114 8.465 8.465 9.177 -0.712 18518
8053 1 12 . 1 1 115 115 SER N N 115 114.763 114.763 116.004 -1.241 18518
8054 1 12 . 1 1 115 115 SER HA H 115 4.496 4.496 4.917 -0.421 18518
8055 1 12 . 1 1 115 115 SER C C 115 172.671 172.671 173.761 -1.090 18518
8056 1 12 . 1 1 115 115 SER CA C 115 58.651 58.651 57.531 1.120 18518
8057 1 12 . 1 1 115 115 SER CB C 115 63.526 63.526 61.651 1.875 18518
8058 1 12 . 1 1 115 115 SER H H 115 9.915 9.915 8.965 0.950 18518
8059 1 12 . 1 1 116 116 GLN N N 116 116.611 116.611 124.361 -7.750 18518
8060 1 12 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.548 -0.064 18518
8061 1 12 . 1 1 116 116 GLN C C 116 172.733 172.733 173.830 -1.097 18518
8062 1 12 . 1 1 116 116 GLN CA C 116 53.926 53.926 56.089 -2.163 18518
8063 1 12 . 1 1 116 116 GLN CB C 116 32.358 32.358 31.491 0.867 18518
8064 1 12 . 1 1 116 116 GLN H H 116 7.219 7.219 8.135 -0.916 18518
8065 1 12 . 1 1 117 117 GLU N N 117 117.623 117.623 120.181 -2.558 18518
8066 1 12 . 1 1 117 117 GLU HA H 117 3.287 3.287 2.819 0.468 18518
8067 1 12 . 1 1 117 117 GLU C C 117 175.168 175.168 175.062 0.106 18518
8068 1 12 . 1 1 117 117 GLU CA C 117 56.882 56.882 56.929 -0.047 18518
8069 1 12 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.629 0.893 18518
8070 1 12 . 1 1 117 117 GLU H H 117 7.882 7.882 8.498 -0.616 18518
8071 1 12 . 1 1 118 118 THR N N 118 109.820 109.820 108.470 1.350 18518
8072 1 12 . 1 1 118 118 THR HA H 118 4.066 4.066 4.199 -0.133 18518
8073 1 12 . 1 1 118 118 THR C C 118 172.355 172.355 173.682 -1.327 18518
8074 1 12 . 1 1 118 118 THR CA C 118 60.029 60.029 60.638 -0.609 18518
8075 1 12 . 1 1 118 118 THR CB C 118 70.480 70.480 70.142 0.338 18518
8076 1 12 . 1 1 118 118 THR H H 118 6.992 6.992 7.238 -0.246 18518
8077 1 13 . 1 1 2 2 ALA HA H 2 4.336 4.336 5.227 -0.891 18518
8078 1 13 . 1 1 2 2 ALA C C 2 177.974 177.974 176.254 1.720 18518
8079 1 13 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.557 1.228 18518
8080 1 13 . 1 1 2 2 ALA CB C 2 19.444 19.444 20.759 -1.315 18518
8081 1 13 . 1 1 3 3 MET N N 3 119.311 119.311 119.961 -0.650 18518
8082 1 13 . 1 1 3 3 MET HA H 3 4.451 4.451 4.720 -0.269 18518
8083 1 13 . 1 1 3 3 MET C C 3 176.913 176.913 175.875 1.038 18518
8084 1 13 . 1 1 3 3 MET CA C 3 55.679 55.679 54.949 0.730 18518
8085 1 13 . 1 1 3 3 MET CB C 3 32.590 32.590 35.856 -3.266 18518
8086 1 13 . 1 1 3 3 MET H H 3 8.638 8.638 8.629 0.009 18518
8087 1 13 . 1 1 4 4 GLY N N 4 110.281 110.281 110.131 0.150 18518
8088 1 13 . 1 1 4 4 GLY C C 4 174.180 174.180 174.200 -0.020 18518
8089 1 13 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.918 0.577 18518
8090 1 13 . 1 1 4 4 GLY H H 4 8.552 8.552 8.597 -0.045 18518
8091 1 13 . 1 1 5 5 LYS N N 5 120.818 120.818 125.311 -4.493 18518
8092 1 13 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.445 0.064 18518
8093 1 13 . 1 1 5 5 LYS C C 5 177.605 177.605 176.704 0.901 18518
8094 1 13 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.094 1.040 18518
8095 1 13 . 1 1 5 5 LYS CB C 5 34.813 34.813 33.482 1.331 18518
8096 1 13 . 1 1 5 5 LYS H H 5 8.133 8.133 7.985 0.148 18518
8097 1 13 . 1 1 6 6 THR N N 6 114.781 114.781 116.585 -1.804 18518
8098 1 13 . 1 1 6 6 THR HA H 6 4.421 4.421 4.414 0.007 18518
8099 1 13 . 1 1 6 6 THR C C 6 175.524 175.524 176.174 -0.650 18518
8100 1 13 . 1 1 6 6 THR CA C 6 61.127 61.127 60.915 0.212 18518
8101 1 13 . 1 1 6 6 THR CB C 6 69.926 69.926 70.041 -0.115 18518
8102 1 13 . 1 1 6 6 THR H H 6 8.483 8.483 8.398 0.085 18518
8103 1 13 . 1 1 7 7 PHE N N 7 125.552 125.552 121.386 4.166 18518
8104 1 13 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.223 -0.218 18518
8105 1 13 . 1 1 7 7 PHE C C 7 177.397 177.397 176.976 0.421 18518
8106 1 13 . 1 1 7 7 PHE CA C 7 63.393 63.393 60.278 3.115 18518
8107 1 13 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.304 1.263 18518
8108 1 13 . 1 1 7 7 PHE H H 7 10.245 10.245 9.341 0.904 18518
8109 1 13 . 1 1 8 8 LYS N N 8 114.053 114.053 118.298 -4.245 18518
8110 1 13 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.462 0.373 18518
8111 1 13 . 1 1 8 8 LYS C C 8 175.520 175.520 178.681 -3.161 18518
8112 1 13 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.238 1.755 18518
8113 1 13 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.662 2.027 18518
8114 1 13 . 1 1 8 8 LYS H H 8 8.775 8.775 6.212 2.563 18518
8115 1 13 . 1 1 9 9 GLN N N 9 113.516 113.516 117.414 -3.898 18518
8116 1 13 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.170 -0.021 18518
8117 1 13 . 1 1 9 9 GLN C C 9 177.615 177.615 178.002 -0.387 18518
8118 1 13 . 1 1 9 9 GLN CA C 9 56.819 56.819 57.663 -0.844 18518
8119 1 13 . 1 1 9 9 GLN CB C 9 30.019 30.019 28.860 1.159 18518
8120 1 13 . 1 1 9 9 GLN H H 9 7.355 7.355 7.573 -0.218 18518
8121 1 13 . 1 1 10 10 ARG N N 10 118.294 118.294 118.717 -0.423 18518
8122 1 13 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.202 0.100 18518
8123 1 13 . 1 1 10 10 ARG C C 10 179.380 179.380 176.846 2.534 18518
8124 1 13 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.339 -0.071 18518
8125 1 13 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.897 0.745 18518
8126 1 13 . 1 1 10 10 ARG H H 10 7.936 7.936 7.810 0.126 18518
8127 1 13 . 1 1 11 11 ARG N N 11 121.137 121.137 119.351 1.786 18518
8128 1 13 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.743 -0.063 18518
8129 1 13 . 1 1 11 11 ARG CA C 11 53.453 53.453 53.643 -0.190 18518
8130 1 13 . 1 1 11 11 ARG CB C 11 32.938 32.938 32.068 0.870 18518
8131 1 13 . 1 1 11 11 ARG H H 11 7.390 7.390 7.632 -0.242 18518
8132 1 13 . 1 1 12 12 THR N N 12 116.819 116.819 118.984 -2.165 18518
8133 1 13 . 1 1 12 12 THR HA H 12 4.359 4.359 4.278 0.081 18518
8134 1 13 . 1 1 12 12 THR C C 12 174.989 174.989 176.160 -1.171 18518
8135 1 13 . 1 1 12 12 THR CA C 12 61.748 61.748 62.513 -0.765 18518
8136 1 13 . 1 1 12 12 THR CB C 12 71.068 71.068 70.052 1.016 18518
8137 1 13 . 1 1 12 12 THR H H 12 8.953 8.953 8.660 0.293 18518
8138 1 13 . 1 1 13 13 PHE N N 13 123.200 123.200 122.859 0.341 18518
8139 1 13 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.217 -0.189 18518
8140 1 13 . 1 1 13 13 PHE C C 13 176.029 176.029 176.981 -0.952 18518
8141 1 13 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.292 0.572 18518
8142 1 13 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.296 0.264 18518
8143 1 13 . 1 1 13 13 PHE H H 13 9.284 9.284 8.919 0.365 18518
8144 1 13 . 1 1 14 14 GLU N N 14 115.414 115.414 117.950 -2.536 18518
8145 1 13 . 1 1 14 14 GLU HA H 14 3.794 3.794 3.765 0.029 18518
8146 1 13 . 1 1 14 14 GLU C C 14 180.081 180.081 178.726 1.355 18518
8147 1 13 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.995 0.624 18518
8148 1 13 . 1 1 14 14 GLU CB C 14 28.852 28.852 28.815 0.037 18518
8149 1 13 . 1 1 14 14 GLU H H 14 8.973 8.973 8.799 0.174 18518
8150 1 13 . 1 1 15 15 GLN N N 15 119.276 119.276 117.902 1.374 18518
8151 1 13 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.075 -0.075 18518
8152 1 13 . 1 1 15 15 GLN C C 15 177.978 177.978 178.821 -0.843 18518
8153 1 13 . 1 1 15 15 GLN CA C 15 58.835 58.835 59.368 -0.533 18518
8154 1 13 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.232 1.138 18518
8155 1 13 . 1 1 15 15 GLN H H 15 7.756 7.756 8.544 -0.788 18518
8156 1 13 . 1 1 16 16 ARG N N 16 121.336 121.336 121.077 0.259 18518
8157 1 13 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.144 0.126 18518
8158 1 13 . 1 1 16 16 ARG C C 16 177.416 177.416 178.417 -1.001 18518
8159 1 13 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.939 1.436 18518
8160 1 13 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.344 0.261 18518
8161 1 13 . 1 1 16 16 ARG H H 16 8.645 8.645 7.997 0.648 18518
8162 1 13 . 1 1 17 17 VAL N N 17 117.630 117.630 120.205 -2.575 18518
8163 1 13 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.644 0.213 18518
8164 1 13 . 1 1 17 17 VAL C C 17 179.748 179.748 177.088 2.660 18518
8165 1 13 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.659 0.067 18518
8166 1 13 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.445 0.749 18518
8167 1 13 . 1 1 17 17 VAL H H 17 8.373 8.373 8.189 0.184 18518
8168 1 13 . 1 1 18 18 GLU N N 18 120.864 120.864 119.630 1.234 18518
8169 1 13 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.894 0.408 18518
8170 1 13 . 1 1 18 18 GLU C C 18 177.728 177.728 178.032 -0.304 18518
8171 1 13 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.910 -1.424 18518
8172 1 13 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.295 0.087 18518
8173 1 13 . 1 1 18 18 GLU H H 18 7.368 7.368 8.298 -0.930 18518
8174 1 13 . 1 1 19 19 ASP N N 19 121.425 121.425 120.280 1.145 18518
8175 1 13 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.355 0.079 18518
8176 1 13 . 1 1 19 19 ASP C C 19 179.978 179.978 178.394 1.584 18518
8177 1 13 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.406 0.016 18518
8178 1 13 . 1 1 19 19 ASP CB C 19 41.287 41.287 41.074 0.213 18518
8179 1 13 . 1 1 19 19 ASP H H 19 8.671 8.671 7.891 0.780 18518
8180 1 13 . 1 1 20 20 VAL N N 20 119.730 119.730 120.240 -0.510 18518
8181 1 13 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.305 -0.100 18518
8182 1 13 . 1 1 20 20 VAL C C 20 176.284 176.284 177.930 -1.646 18518
8183 1 13 . 1 1 20 20 VAL CA C 20 66.315 66.315 66.332 -0.017 18518
8184 1 13 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.038 0.069 18518
8185 1 13 . 1 1 20 20 VAL H H 20 7.999 7.999 8.171 -0.172 18518
8186 1 13 . 1 1 21 21 ARG N N 21 121.455 121.455 119.483 1.972 18518
8187 1 13 . 1 1 21 21 ARG HA H 21 3.814 3.814 4.018 -0.204 18518
8188 1 13 . 1 1 21 21 ARG C C 21 180.120 180.120 178.917 1.203 18518
8189 1 13 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.887 0.943 18518
8190 1 13 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.013 0.933 18518
8191 1 13 . 1 1 21 21 ARG H H 21 8.098 8.098 7.773 0.325 18518
8192 1 13 . 1 1 22 22 LEU N N 22 117.826 117.826 120.903 -3.077 18518
8193 1 13 . 1 1 22 22 LEU HA H 22 4.049 4.049 3.925 0.124 18518
8194 1 13 . 1 1 22 22 LEU C C 22 180.115 180.115 179.246 0.869 18518
8195 1 13 . 1 1 22 22 LEU CA C 22 57.790 57.790 58.032 -0.242 18518
8196 1 13 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.750 0.392 18518
8197 1 13 . 1 1 22 22 LEU H H 22 8.207 8.207 8.237 -0.030 18518
8198 1 13 . 1 1 23 23 ILE N N 23 121.450 121.450 119.187 2.263 18518
8199 1 13 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.672 0.341 18518
8200 1 13 . 1 1 23 23 ILE C C 23 178.149 178.149 178.401 -0.252 18518
8201 1 13 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.222 -2.051 18518
8202 1 13 . 1 1 23 23 ILE CB C 23 38.106 38.106 36.769 1.337 18518
8203 1 13 . 1 1 23 23 ILE H H 23 8.105 8.105 8.342 -0.237 18518
8204 1 13 . 1 1 24 24 ARG N N 24 121.139 121.139 119.546 1.593 18518
8205 1 13 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.021 -0.034 18518
8206 1 13 . 1 1 24 24 ARG C C 24 178.702 178.702 178.928 -0.226 18518
8207 1 13 . 1 1 24 24 ARG CA C 24 57.718 57.718 59.647 -1.929 18518
8208 1 13 . 1 1 24 24 ARG CB C 24 28.769 28.769 30.002 -1.233 18518
8209 1 13 . 1 1 24 24 ARG H H 24 8.601 8.601 8.422 0.179 18518
8210 1 13 . 1 1 25 25 GLU N N 25 118.054 118.054 117.332 0.722 18518
8211 1 13 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.170 -0.144 18518
8212 1 13 . 1 1 25 25 GLU C C 25 178.492 178.492 178.350 0.142 18518
8213 1 13 . 1 1 25 25 GLU CA C 25 58.780 58.780 57.978 0.802 18518
8214 1 13 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.399 0.602 18518
8215 1 13 . 1 1 25 25 GLU H H 25 7.423 7.423 7.780 -0.357 18518
8216 1 13 . 1 1 26 26 GLN N N 26 116.350 116.350 116.647 -0.297 18518
8217 1 13 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.036 -0.100 18518
8218 1 13 . 1 1 26 26 GLN C C 26 176.305 176.305 176.790 -0.485 18518
8219 1 13 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.273 0.230 18518
8220 1 13 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.442 0.765 18518
8221 1 13 . 1 1 26 26 GLN H H 26 7.524 7.524 7.948 -0.424 18518
8222 1 13 . 1 1 27 27 HIS N N 27 116.017 116.017 118.243 -2.226 18518
8223 1 13 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.117 -0.187 18518
8224 1 13 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.852 0.202 18518
8225 1 13 . 1 1 27 27 HIS CB C 27 30.747 30.747 30.875 -0.128 18518
8226 1 13 . 1 1 27 27 HIS H H 27 8.284 8.284 8.181 0.103 18518
8227 1 13 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.629 -0.048 18518
8228 1 13 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.510 0.409 18518
8229 1 13 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.281 0.175 18518
8230 1 13 . 1 1 29 29 THR N N 29 107.011 107.011 106.387 0.624 18518
8231 1 13 . 1 1 29 29 THR HA H 29 4.599 4.599 4.385 0.214 18518
8232 1 13 . 1 1 29 29 THR C C 29 172.884 172.884 173.760 -0.876 18518
8233 1 13 . 1 1 29 29 THR CA C 29 60.810 60.810 61.670 -0.860 18518
8234 1 13 . 1 1 29 29 THR CB C 29 68.531 68.531 68.538 -0.007 18518
8235 1 13 . 1 1 29 29 THR H H 29 7.890 7.890 8.375 -0.485 18518
8236 1 13 . 1 1 30 30 LYS N N 30 117.679 117.679 121.450 -3.771 18518
8237 1 13 . 1 1 30 30 LYS HA H 30 4.858 4.858 5.030 -0.172 18518
8238 1 13 . 1 1 30 30 LYS C C 30 174.310 174.310 174.832 -0.522 18518
8239 1 13 . 1 1 30 30 LYS CA C 30 53.751 53.751 53.911 -0.161 18518
8240 1 13 . 1 1 30 30 LYS CB C 30 35.804 35.804 35.834 -0.030 18518
8241 1 13 . 1 1 30 30 LYS H H 30 7.441 7.441 7.669 -0.228 18518
8242 1 13 . 1 1 31 31 ILE N N 31 122.849 122.849 123.319 -0.470 18518
8243 1 13 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.313 -0.208 18518
8244 1 13 . 1 1 31 31 ILE CA C 31 54.801 54.801 55.956 -1.155 18518
8245 1 13 . 1 1 31 31 ILE CB C 31 38.265 38.265 37.199 1.066 18518
8246 1 13 . 1 1 31 31 ILE H H 31 9.304 9.304 8.797 0.507 18518
8247 1 13 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.632 0.527 18518
8248 1 13 . 1 1 32 32 PRO C C 32 174.164 174.164 175.684 -1.520 18518
8249 1 13 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.192 -0.689 18518
8250 1 13 . 1 1 32 32 PRO CB C 32 31.145 31.145 31.008 0.137 18518
8251 1 13 . 1 1 33 33 VAL N N 33 125.606 125.606 125.358 0.248 18518
8252 1 13 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.022 0.191 18518
8253 1 13 . 1 1 33 33 VAL C C 33 173.654 173.654 173.795 -0.141 18518
8254 1 13 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.462 0.582 18518
8255 1 13 . 1 1 33 33 VAL CB C 33 35.604 35.604 36.428 -0.824 18518
8256 1 13 . 1 1 33 33 VAL H H 33 9.424 9.424 9.036 0.388 18518
8257 1 13 . 1 1 34 34 ILE N N 34 128.241 128.241 126.950 1.291 18518
8258 1 13 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.809 0.024 18518
8259 1 13 . 1 1 34 34 ILE C C 34 175.605 175.605 174.785 0.820 18518
8260 1 13 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.417 -1.652 18518
8261 1 13 . 1 1 34 34 ILE CB C 34 36.799 36.799 38.615 -1.816 18518
8262 1 13 . 1 1 34 34 ILE H H 34 8.721 8.721 8.653 0.068 18518
8263 1 13 . 1 1 35 35 ILE N N 35 125.650 125.650 127.798 -2.148 18518
8264 1 13 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.566 0.270 18518
8265 1 13 . 1 1 35 35 ILE C C 35 174.887 174.887 174.387 0.500 18518
8266 1 13 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.200 0.745 18518
8267 1 13 . 1 1 35 35 ILE CB C 35 39.210 39.210 39.116 0.094 18518
8268 1 13 . 1 1 35 35 ILE H H 35 9.034 9.034 8.977 0.057 18518
8269 1 13 . 1 1 36 36 GLU N N 36 122.657 122.657 127.630 -4.973 18518
8270 1 13 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.844 0.017 18518
8271 1 13 . 1 1 36 36 GLU C C 36 173.848 173.848 174.612 -0.764 18518
8272 1 13 . 1 1 36 36 GLU CA C 36 53.932 53.932 53.982 -0.050 18518
8273 1 13 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.036 1.246 18518
8274 1 13 . 1 1 36 36 GLU H H 36 8.303 8.303 8.652 -0.349 18518
8275 1 13 . 1 1 37 37 ARG N N 37 123.228 123.228 124.924 -1.696 18518
8276 1 13 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.334 -0.608 18518
8277 1 13 . 1 1 37 37 ARG C C 37 176.359 176.359 175.628 0.731 18518
8278 1 13 . 1 1 37 37 ARG CA C 37 56.359 56.359 55.846 0.513 18518
8279 1 13 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.993 0.348 18518
8280 1 13 . 1 1 37 37 ARG H H 37 8.856 8.856 8.450 0.406 18518
8281 1 13 . 1 1 38 38 TYR N N 38 128.981 128.981 127.762 1.219 18518
8282 1 13 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.123 0.229 18518
8283 1 13 . 1 1 38 38 TYR C C 38 177.316 177.316 176.400 0.916 18518
8284 1 13 . 1 1 38 38 TYR CA C 38 57.712 57.712 58.550 -0.838 18518
8285 1 13 . 1 1 38 38 TYR CB C 38 39.472 39.472 39.965 -0.493 18518
8286 1 13 . 1 1 38 38 TYR H H 38 8.628 8.628 8.434 0.194 18518
8287 1 13 . 1 1 39 39 LYS N N 39 130.635 130.635 126.507 4.128 18518
8288 1 13 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.795 0.027 18518
8289 1 13 . 1 1 39 39 LYS CA C 39 58.887 58.887 57.992 0.895 18518
8290 1 13 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.924 -0.153 18518
8291 1 13 . 1 1 39 39 LYS H H 39 8.594 8.594 8.056 0.538 18518
8292 1 13 . 1 1 40 40 GLY C C 40 173.447 173.447 174.590 -1.143 18518
8293 1 13 . 1 1 40 40 GLY CA C 40 44.663 44.663 44.238 0.425 18518
8294 1 13 . 1 1 40 40 GLY H H 40 5.188 5.188 6.441 -1.253 18518
8295 1 13 . 1 1 41 41 GLU N N 41 122.836 122.836 121.237 1.599 18518
8296 1 13 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.361 -0.104 18518
8297 1 13 . 1 1 41 41 GLU C C 41 176.524 176.524 175.925 0.599 18518
8298 1 13 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.409 0.116 18518
8299 1 13 . 1 1 41 41 GLU CB C 41 30.985 30.985 30.402 0.583 18518
8300 1 13 . 1 1 41 41 GLU H H 41 7.380 7.380 7.651 -0.271 18518
8301 1 13 . 1 1 42 42 LYS N N 42 124.040 124.040 122.562 1.478 18518
8302 1 13 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.490 0.185 18518
8303 1 13 . 1 1 42 42 LYS C C 42 177.538 177.538 177.432 0.106 18518
8304 1 13 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.892 -1.052 18518
8305 1 13 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.869 1.110 18518
8306 1 13 . 1 1 42 42 LYS H H 42 9.034 9.034 8.428 0.606 18518
8307 1 13 . 1 1 43 43 GLN N N 43 119.259 119.259 117.668 1.591 18518
8308 1 13 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.304 0.238 18518
8309 1 13 . 1 1 43 43 GLN C C 43 177.336 177.336 176.252 1.084 18518
8310 1 13 . 1 1 43 43 GLN CA C 43 57.673 57.673 57.018 0.655 18518
8311 1 13 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.012 0.770 18518
8312 1 13 . 1 1 43 43 GLN H H 43 8.435 8.435 8.455 -0.020 18518
8313 1 13 . 1 1 44 44 LEU N N 44 120.760 120.760 123.761 -3.001 18518
8314 1 13 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.755 -0.060 18518
8315 1 13 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.620 0.625 18518
8316 1 13 . 1 1 44 44 LEU CB C 44 43.596 43.596 41.606 1.990 18518
8317 1 13 . 1 1 44 44 LEU H H 44 9.126 9.126 8.392 0.734 18518
8318 1 13 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.591 0.126 18518
8319 1 13 . 1 1 45 45 PRO C C 45 175.797 175.797 176.679 -0.882 18518
8320 1 13 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.364 -0.253 18518
8321 1 13 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.500 0.092 18518
8322 1 13 . 1 1 46 46 VAL N N 46 119.052 119.052 122.730 -3.678 18518
8323 1 13 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.138 -0.271 18518
8324 1 13 . 1 1 46 46 VAL C C 46 175.640 175.640 175.711 -0.071 18518
8325 1 13 . 1 1 46 46 VAL CA C 46 62.944 62.944 61.841 1.103 18518
8326 1 13 . 1 1 46 46 VAL CB C 46 32.799 32.799 32.947 -0.148 18518
8327 1 13 . 1 1 46 46 VAL H H 46 8.543 8.543 8.100 0.443 18518
8328 1 13 . 1 1 47 47 LEU N N 47 130.203 130.203 124.624 5.579 18518
8329 1 13 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.536 -0.227 18518
8330 1 13 . 1 1 47 47 LEU C C 47 176.198 176.198 177.545 -1.347 18518
8331 1 13 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.476 -0.470 18518
8332 1 13 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.597 1.235 18518
8333 1 13 . 1 1 47 47 LEU H H 47 7.799 7.799 8.653 -0.854 18518
8334 1 13 . 1 1 48 48 ASP N N 48 122.403 122.403 121.294 1.109 18518
8335 1 13 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.485 -0.222 18518
8336 1 13 . 1 1 48 48 ASP C C 48 175.294 175.294 175.111 0.183 18518
8337 1 13 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.693 0.139 18518
8338 1 13 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.328 -1.144 18518
8339 1 13 . 1 1 48 48 ASP H H 48 8.780 8.780 8.835 -0.055 18518
8340 1 13 . 1 1 49 49 LYS N N 49 119.569 119.569 115.278 4.291 18518
8341 1 13 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.568 0.017 18518
8342 1 13 . 1 1 49 49 LYS C C 49 174.678 174.678 175.061 -0.383 18518
8343 1 13 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.608 -1.956 18518
8344 1 13 . 1 1 49 49 LYS CB C 49 35.945 35.945 33.788 2.157 18518
8345 1 13 . 1 1 49 49 LYS H H 49 7.280 7.280 7.740 -0.460 18518
8346 1 13 . 1 1 50 50 THR N N 50 110.862 110.862 109.502 1.360 18518
8347 1 13 . 1 1 50 50 THR HA H 50 4.811 4.811 4.829 -0.018 18518
8348 1 13 . 1 1 50 50 THR C C 50 172.425 172.425 174.572 -2.147 18518
8349 1 13 . 1 1 50 50 THR CA C 50 62.645 62.645 61.938 0.707 18518
8350 1 13 . 1 1 50 50 THR CB C 50 71.648 71.648 70.008 1.640 18518
8351 1 13 . 1 1 50 50 THR H H 50 8.042 8.042 8.330 -0.288 18518
8352 1 13 . 1 1 51 51 LYS N N 51 120.008 120.008 122.777 -2.769 18518
8353 1 13 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.679 -0.054 18518
8354 1 13 . 1 1 51 51 LYS C C 51 175.082 175.082 175.799 -0.717 18518
8355 1 13 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.714 -2.010 18518
8356 1 13 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.164 -0.788 18518
8357 1 13 . 1 1 51 51 LYS H H 51 7.119 7.119 7.780 -0.661 18518
8358 1 13 . 1 1 52 52 PHE N N 52 122.640 122.640 124.640 -2.000 18518
8359 1 13 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.784 0.553 18518
8360 1 13 . 1 1 52 52 PHE C C 52 174.213 174.213 173.807 0.406 18518
8361 1 13 . 1 1 52 52 PHE CA C 52 56.611 56.611 57.029 -0.418 18518
8362 1 13 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.598 -0.458 18518
8363 1 13 . 1 1 52 52 PHE H H 52 9.709 9.709 9.282 0.427 18518
8364 1 13 . 1 1 53 53 LEU N N 53 122.157 122.157 122.547 -0.390 18518
8365 1 13 . 1 1 53 53 LEU HA H 53 4.947 4.947 5.302 -0.355 18518
8366 1 13 . 1 1 53 53 LEU C C 53 175.769 175.769 175.202 0.567 18518
8367 1 13 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.508 -0.551 18518
8368 1 13 . 1 1 53 53 LEU CB C 53 44.415 44.415 45.744 -1.329 18518
8369 1 13 . 1 1 53 53 LEU H H 53 8.959 8.959 8.442 0.517 18518
8370 1 13 . 1 1 54 54 VAL N N 54 124.919 124.919 123.990 0.929 18518
8371 1 13 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.675 -0.116 18518
8372 1 13 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.131 0.999 18518
8373 1 13 . 1 1 54 54 VAL CB C 54 34.968 34.968 36.547 -1.579 18518
8374 1 13 . 1 1 54 54 VAL H H 54 8.922 8.922 8.490 0.432 18518
8375 1 13 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.911 -0.470 18518
8376 1 13 . 1 1 55 55 PRO C C 55 176.594 176.594 177.946 -1.352 18518
8377 1 13 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.358 1.957 18518
8378 1 13 . 1 1 55 55 PRO CB C 55 32.665 32.665 31.687 0.978 18518
8379 1 13 . 1 1 56 56 ASP N N 56 120.522 120.522 123.707 -3.185 18518
8380 1 13 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.231 -0.369 18518
8381 1 13 . 1 1 56 56 ASP C C 56 175.809 175.809 176.611 -0.802 18518
8382 1 13 . 1 1 56 56 ASP CA C 56 56.749 56.749 57.698 -0.949 18518
8383 1 13 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.601 -0.091 18518
8384 1 13 . 1 1 56 56 ASP H H 56 8.347 8.347 8.365 -0.018 18518
8385 1 13 . 1 1 57 57 HIS N N 57 113.482 113.482 113.855 -0.373 18518
8386 1 13 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.756 -0.036 18518
8387 1 13 . 1 1 57 57 HIS C C 57 176.507 176.507 175.618 0.889 18518
8388 1 13 . 1 1 57 57 HIS CA C 57 55.589 55.589 55.472 0.117 18518
8389 1 13 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.523 1.120 18518
8390 1 13 . 1 1 57 57 HIS H H 57 7.557 7.557 7.921 -0.364 18518
8391 1 13 . 1 1 58 58 VAL N N 58 123.279 123.279 121.920 1.359 18518
8392 1 13 . 1 1 58 58 VAL HA H 58 3.836 3.836 3.917 -0.081 18518
8393 1 13 . 1 1 58 58 VAL C C 58 175.019 175.019 175.115 -0.096 18518
8394 1 13 . 1 1 58 58 VAL CA C 58 62.823 62.823 62.163 0.660 18518
8395 1 13 . 1 1 58 58 VAL CB C 58 32.310 32.310 32.971 -0.661 18518
8396 1 13 . 1 1 58 58 VAL H H 58 7.345 7.345 7.405 -0.060 18518
8397 1 13 . 1 1 59 59 ASN N N 59 123.781 123.781 122.810 0.971 18518
8398 1 13 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.022 0.104 18518
8399 1 13 . 1 1 59 59 ASN C C 59 176.558 176.558 176.433 0.125 18518
8400 1 13 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.886 -0.401 18518
8401 1 13 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.587 -0.480 18518
8402 1 13 . 1 1 59 59 ASN H H 59 8.735 8.735 8.276 0.459 18518
8403 1 13 . 1 1 60 60 MET N N 60 117.453 117.453 118.127 -0.674 18518
8404 1 13 . 1 1 60 60 MET HA H 60 4.395 4.395 4.194 0.201 18518
8405 1 13 . 1 1 60 60 MET C C 60 178.144 178.144 178.392 -0.248 18518
8406 1 13 . 1 1 60 60 MET CA C 60 57.097 57.097 56.753 0.344 18518
8407 1 13 . 1 1 60 60 MET CB C 60 30.140 30.140 31.005 -0.865 18518
8408 1 13 . 1 1 60 60 MET H H 60 8.227 8.227 8.255 -0.028 18518
8409 1 13 . 1 1 61 61 SER N N 61 114.216 114.216 115.595 -1.379 18518
8410 1 13 . 1 1 61 61 SER HA H 61 4.111 4.111 4.095 0.016 18518
8411 1 13 . 1 1 61 61 SER C C 61 177.335 177.335 176.758 0.577 18518
8412 1 13 . 1 1 61 61 SER CA C 61 61.590 61.590 62.550 -0.960 18518
8413 1 13 . 1 1 61 61 SER CB C 61 62.402 62.402 62.909 -0.507 18518
8414 1 13 . 1 1 61 61 SER H H 61 8.464 8.464 8.071 0.393 18518
8415 1 13 . 1 1 62 62 GLU N N 62 123.004 123.004 121.360 1.644 18518
8416 1 13 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.067 -0.020 18518
8417 1 13 . 1 1 62 62 GLU C C 62 178.686 178.686 178.699 -0.013 18518
8418 1 13 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.993 -0.368 18518
8419 1 13 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.412 0.242 18518
8420 1 13 . 1 1 62 62 GLU H H 62 7.994 7.994 7.685 0.309 18518
8421 1 13 . 1 1 63 63 LEU N N 63 120.818 120.818 121.807 -0.989 18518
8422 1 13 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.927 0.038 18518
8423 1 13 . 1 1 63 63 LEU C C 63 178.046 178.046 178.814 -0.768 18518
8424 1 13 . 1 1 63 63 LEU CA C 63 57.920 57.920 58.316 -0.397 18518
8425 1 13 . 1 1 63 63 LEU CB C 63 41.624 41.624 42.032 -0.408 18518
8426 1 13 . 1 1 63 63 LEU H H 63 8.130 8.130 7.803 0.327 18518
8427 1 13 . 1 1 64 64 ILE N N 64 118.528 118.528 118.730 -0.202 18518
8428 1 13 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.586 -0.217 18518
8429 1 13 . 1 1 64 64 ILE C C 64 177.127 177.127 177.589 -0.462 18518
8430 1 13 . 1 1 64 64 ILE CA C 64 66.678 66.678 65.754 0.924 18518
8431 1 13 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.780 0.664 18518
8432 1 13 . 1 1 64 64 ILE H H 64 8.488 8.488 8.444 0.044 18518
8433 1 13 . 1 1 65 65 LYS N N 65 118.336 118.336 120.845 -2.509 18518
8434 1 13 . 1 1 65 65 LYS HA H 65 3.701 3.701 3.964 -0.263 18518
8435 1 13 . 1 1 65 65 LYS C C 65 179.291 179.291 179.211 0.080 18518
8436 1 13 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.979 0.461 18518
8437 1 13 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.377 -0.006 18518
8438 1 13 . 1 1 65 65 LYS H H 65 7.347 7.347 7.745 -0.398 18518
8439 1 13 . 1 1 66 66 ILE N N 66 120.171 120.171 119.901 0.270 18518
8440 1 13 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.718 -0.140 18518
8441 1 13 . 1 1 66 66 ILE C C 66 178.873 178.873 178.243 0.630 18518
8442 1 13 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.224 -0.064 18518
8443 1 13 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.788 0.845 18518
8444 1 13 . 1 1 66 66 ILE H H 66 7.901 7.901 8.412 -0.511 18518
8445 1 13 . 1 1 67 67 ILE N N 67 121.185 121.185 120.527 0.658 18518
8446 1 13 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.591 -0.145 18518
8447 1 13 . 1 1 67 67 ILE C C 67 177.150 177.150 177.857 -0.707 18518
8448 1 13 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.741 -1.935 18518
8449 1 13 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.265 -2.270 18518
8450 1 13 . 1 1 67 67 ILE H H 67 8.290 8.290 7.833 0.457 18518
8451 1 13 . 1 1 68 68 ARG N N 68 119.173 119.173 118.775 0.398 18518
8452 1 13 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.757 -0.826 18518
8453 1 13 . 1 1 68 68 ARG C C 68 178.496 178.496 178.622 -0.126 18518
8454 1 13 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.580 1.056 18518
8455 1 13 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.768 0.672 18518
8456 1 13 . 1 1 68 68 ARG H H 68 8.438 8.438 8.331 0.107 18518
8457 1 13 . 1 1 69 69 ARG N N 69 116.511 116.511 120.172 -3.661 18518
8458 1 13 . 1 1 69 69 ARG HA H 69 4.134 4.134 3.975 0.159 18518
8459 1 13 . 1 1 69 69 ARG C C 69 180.262 180.262 179.046 1.216 18518
8460 1 13 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.627 -0.920 18518
8461 1 13 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.221 -0.269 18518
8462 1 13 . 1 1 69 69 ARG H H 69 7.497 7.497 8.388 -0.891 18518
8463 1 13 . 1 1 70 70 ARG N N 70 123.297 123.297 119.462 3.835 18518
8464 1 13 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.142 -0.126 18518
8465 1 13 . 1 1 70 70 ARG C C 70 178.700 178.700 178.233 0.467 18518
8466 1 13 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.651 0.808 18518
8467 1 13 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.620 0.692 18518
8468 1 13 . 1 1 70 70 ARG H H 70 8.075 8.075 7.953 0.122 18518
8469 1 13 . 1 1 71 71 LEU N N 71 116.829 116.829 118.494 -1.665 18518
8470 1 13 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.192 -0.127 18518
8471 1 13 . 1 1 71 71 LEU C C 71 174.956 174.956 176.364 -1.408 18518
8472 1 13 . 1 1 71 71 LEU CA C 71 55.126 55.126 55.372 -0.246 18518
8473 1 13 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.093 1.153 18518
8474 1 13 . 1 1 71 71 LEU H H 71 7.719 7.719 7.833 -0.114 18518
8475 1 13 . 1 1 72 72 GLN N N 72 114.991 114.991 113.867 1.124 18518
8476 1 13 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.852 -0.016 18518
8477 1 13 . 1 1 72 72 GLN C C 72 175.683 175.683 175.320 0.363 18518
8478 1 13 . 1 1 72 72 GLN CA C 72 56.325 56.325 55.964 0.361 18518
8479 1 13 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.921 0.083 18518
8480 1 13 . 1 1 72 72 GLN H H 72 7.744 7.744 7.595 0.149 18518
8481 1 13 . 1 1 73 73 LEU N N 73 115.045 115.045 119.232 -4.187 18518
8482 1 13 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.062 0.174 18518
8483 1 13 . 1 1 73 73 LEU C C 73 178.762 178.762 177.406 1.356 18518
8484 1 13 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.295 -0.909 18518
8485 1 13 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.879 0.212 18518
8486 1 13 . 1 1 73 73 LEU H H 73 7.500 7.500 7.568 -0.068 18518
8487 1 13 . 1 1 74 74 ASN N N 74 121.700 121.700 122.071 -0.371 18518
8488 1 13 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.613 0.077 18518
8489 1 13 . 1 1 74 74 ASN C C 74 176.617 176.617 175.572 1.045 18518
8490 1 13 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.728 -1.043 18518
8491 1 13 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.272 0.326 18518
8492 1 13 . 1 1 74 74 ASN H H 74 9.045 9.045 8.523 0.522 18518
8493 1 13 . 1 1 75 75 ALA N N 75 123.952 123.952 122.124 1.828 18518
8494 1 13 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.332 -0.368 18518
8495 1 13 . 1 1 75 75 ALA C C 75 178.131 178.131 177.648 0.483 18518
8496 1 13 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.568 1.300 18518
8497 1 13 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.547 -0.828 18518
8498 1 13 . 1 1 75 75 ALA H H 75 8.784 8.784 8.475 0.309 18518
8499 1 13 . 1 1 76 76 ASN N N 76 112.295 112.295 115.817 -3.522 18518
8500 1 13 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.671 -0.091 18518
8501 1 13 . 1 1 76 76 ASN C C 76 175.448 175.448 175.041 0.407 18518
8502 1 13 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.632 -0.418 18518
8503 1 13 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.537 -0.217 18518
8504 1 13 . 1 1 76 76 ASN H H 76 8.391 8.391 8.472 -0.081 18518
8505 1 13 . 1 1 77 77 GLN N N 77 120.577 120.577 118.692 1.885 18518
8506 1 13 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.562 -0.289 18518
8507 1 13 . 1 1 77 77 GLN C C 77 175.045 175.045 173.656 1.389 18518
8508 1 13 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.867 0.938 18518
8509 1 13 . 1 1 77 77 GLN CB C 77 30.157 30.157 31.208 -1.051 18518
8510 1 13 . 1 1 77 77 GLN H H 77 7.552 7.552 7.468 0.084 18518
8511 1 13 . 1 1 78 78 ALA N N 78 130.670 130.670 123.610 7.060 18518
8512 1 13 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.541 -0.370 18518
8513 1 13 . 1 1 78 78 ALA C C 78 176.512 176.512 175.825 0.687 18518
8514 1 13 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.597 1.245 18518
8515 1 13 . 1 1 78 78 ALA CB C 78 20.060 20.060 20.816 -0.756 18518
8516 1 13 . 1 1 78 78 ALA H H 78 8.799 8.799 8.435 0.364 18518
8517 1 13 . 1 1 79 79 PHE N N 79 119.325 119.325 116.566 2.759 18518
8518 1 13 . 1 1 79 79 PHE HA H 79 4.434 4.434 4.763 -0.329 18518
8519 1 13 . 1 1 79 79 PHE C C 79 171.726 171.726 172.841 -1.115 18518
8520 1 13 . 1 1 79 79 PHE CA C 79 59.145 59.145 56.639 2.506 18518
8521 1 13 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.086 1.085 18518
8522 1 13 . 1 1 79 79 PHE H H 79 7.664 7.664 7.922 -0.258 18518
8523 1 13 . 1 1 80 80 PHE N N 80 126.314 126.314 117.928 8.386 18518
8524 1 13 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.413 -0.021 18518
8525 1 13 . 1 1 80 80 PHE C C 80 177.169 177.169 173.538 3.631 18518
8526 1 13 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.570 0.083 18518
8527 1 13 . 1 1 80 80 PHE CB C 80 41.933 41.933 42.617 -0.685 18518
8528 1 13 . 1 1 80 80 PHE H H 80 8.508 8.508 9.121 -0.613 18518
8529 1 13 . 1 1 81 81 LEU N N 81 121.426 121.426 124.065 -2.639 18518
8530 1 13 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.159 -0.308 18518
8531 1 13 . 1 1 81 81 LEU C C 81 174.488 174.488 175.023 -0.535 18518
8532 1 13 . 1 1 81 81 LEU CA C 81 53.197 53.197 54.214 -1.017 18518
8533 1 13 . 1 1 81 81 LEU CB C 81 45.100 45.100 43.617 1.483 18518
8534 1 13 . 1 1 81 81 LEU H H 81 8.229 8.229 8.515 -0.286 18518
8535 1 13 . 1 1 82 82 LEU N N 82 125.155 125.155 127.639 -2.484 18518
8536 1 13 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.687 0.146 18518
8537 1 13 . 1 1 82 82 LEU C C 82 177.166 177.166 175.704 1.462 18518
8538 1 13 . 1 1 82 82 LEU CA C 82 54.197 54.197 52.420 1.777 18518
8539 1 13 . 1 1 82 82 LEU CB C 82 43.442 43.442 43.476 -0.034 18518
8540 1 13 . 1 1 82 82 LEU H H 82 9.400 9.400 9.128 0.272 18518
8541 1 13 . 1 1 83 83 VAL N N 83 123.886 123.886 122.603 1.283 18518
8542 1 13 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.494 -0.115 18518
8543 1 13 . 1 1 83 83 VAL C C 83 175.810 175.810 176.933 -1.123 18518
8544 1 13 . 1 1 83 83 VAL CA C 83 61.677 61.677 61.923 -0.246 18518
8545 1 13 . 1 1 83 83 VAL CB C 83 33.758 33.758 32.334 1.424 18518
8546 1 13 . 1 1 83 83 VAL H H 83 8.721 8.721 8.678 0.043 18518
8547 1 13 . 1 1 84 84 ASN N N 84 126.474 126.474 128.533 -2.059 18518
8548 1 13 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.392 0.004 18518
8549 1 13 . 1 1 84 84 ASN C C 84 175.164 175.164 175.030 0.134 18518
8550 1 13 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.882 -0.144 18518
8551 1 13 . 1 1 84 84 ASN CB C 84 37.950 37.950 37.995 -0.045 18518
8552 1 13 . 1 1 84 84 ASN H H 84 9.707 9.707 9.256 0.451 18518
8553 1 13 . 1 1 85 85 GLY N N 85 101.296 101.296 104.800 -3.504 18518
8554 1 13 . 1 1 85 85 GLY C C 85 173.680 173.680 173.351 0.329 18518
8555 1 13 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.790 0.813 18518
8556 1 13 . 1 1 85 85 GLY H H 85 8.644 8.644 8.329 0.315 18518
8557 1 13 . 1 1 86 86 HIS N N 86 117.238 117.238 119.282 -2.044 18518
8558 1 13 . 1 1 86 86 HIS HA H 86 5.017 5.017 5.008 0.009 18518
8559 1 13 . 1 1 86 86 HIS C C 86 173.841 173.841 174.289 -0.448 18518
8560 1 13 . 1 1 86 86 HIS CA C 86 53.796 53.796 54.297 -0.500 18518
8561 1 13 . 1 1 86 86 HIS CB C 86 31.280 31.280 32.846 -1.566 18518
8562 1 13 . 1 1 86 86 HIS H H 86 7.918 7.918 8.426 -0.508 18518
8563 1 13 . 1 1 87 87 SER N N 87 118.179 118.179 119.814 -1.635 18518
8564 1 13 . 1 1 87 87 SER HA H 87 4.699 4.699 4.467 0.232 18518
8565 1 13 . 1 1 87 87 SER C C 87 175.904 175.904 174.666 1.238 18518
8566 1 13 . 1 1 87 87 SER CA C 87 58.271 58.271 59.533 -1.262 18518
8567 1 13 . 1 1 87 87 SER CB C 87 63.735 63.735 62.852 0.882 18518
8568 1 13 . 1 1 87 87 SER H H 87 8.977 8.977 8.899 0.078 18518
8569 1 13 . 1 1 88 88 MET N N 88 125.472 125.472 122.879 2.593 18518
8570 1 13 . 1 1 88 88 MET HA H 88 4.830 4.830 4.707 0.123 18518
8571 1 13 . 1 1 88 88 MET C C 88 176.419 176.419 174.736 1.683 18518
8572 1 13 . 1 1 88 88 MET CA C 88 54.899 54.899 55.294 -0.395 18518
8573 1 13 . 1 1 88 88 MET CB C 88 33.336 33.336 33.496 -0.160 18518
8574 1 13 . 1 1 88 88 MET H H 88 9.184 9.184 8.343 0.841 18518
8575 1 13 . 1 1 89 89 VAL N N 89 120.747 120.747 118.761 1.986 18518
8576 1 13 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.363 -0.131 18518
8577 1 13 . 1 1 89 89 VAL C C 89 175.958 175.958 174.329 1.629 18518
8578 1 13 . 1 1 89 89 VAL CA C 89 63.154 63.154 60.792 2.362 18518
8579 1 13 . 1 1 89 89 VAL CB C 89 31.878 31.878 34.441 -2.563 18518
8580 1 13 . 1 1 89 89 VAL H H 89 8.233 8.233 7.599 0.634 18518
8581 1 13 . 1 1 90 90 SER N N 90 117.362 117.362 118.584 -1.222 18518
8582 1 13 . 1 1 90 90 SER HA H 90 4.590 4.590 4.809 -0.219 18518
8583 1 13 . 1 1 90 90 SER C C 90 175.741 175.741 175.010 0.731 18518
8584 1 13 . 1 1 90 90 SER CA C 90 57.717 57.717 56.726 0.991 18518
8585 1 13 . 1 1 90 90 SER CB C 90 63.223 63.223 65.320 -2.097 18518
8586 1 13 . 1 1 90 90 SER H H 90 8.482 8.482 8.077 0.405 18518
8587 1 13 . 1 1 91 91 VAL N N 91 120.466 120.466 124.204 -3.738 18518
8588 1 13 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.869 0.178 18518
8589 1 13 . 1 1 91 91 VAL C C 91 176.329 176.329 176.171 0.158 18518
8590 1 13 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.469 -0.977 18518
8591 1 13 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.738 0.830 18518
8592 1 13 . 1 1 91 91 VAL H H 91 8.188 8.188 8.781 -0.593 18518
8593 1 13 . 1 1 92 92 SER N N 92 116.398 116.398 112.295 4.103 18518
8594 1 13 . 1 1 92 92 SER HA H 92 4.636 4.636 4.627 0.009 18518
8595 1 13 . 1 1 92 92 SER C C 92 174.159 174.159 173.931 0.228 18518
8596 1 13 . 1 1 92 92 SER CA C 92 57.805 57.805 57.885 -0.080 18518
8597 1 13 . 1 1 92 92 SER CB C 92 63.046 63.046 63.679 -0.633 18518
8598 1 13 . 1 1 92 92 SER H H 92 8.370 8.370 8.133 0.237 18518
8599 1 13 . 1 1 93 93 THR N N 93 119.211 119.211 120.365 -1.154 18518
8600 1 13 . 1 1 93 93 THR HA H 93 4.484 4.484 4.635 -0.151 18518
8601 1 13 . 1 1 93 93 THR CA C 93 60.884 60.884 61.066 -0.182 18518
8602 1 13 . 1 1 93 93 THR CB C 93 70.609 70.609 68.830 1.779 18518
8603 1 13 . 1 1 93 93 THR H H 93 7.416 7.416 7.669 -0.253 18518
8604 1 13 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.576 -0.136 18518
8605 1 13 . 1 1 94 94 PRO C C 94 178.775 178.775 177.358 1.417 18518
8606 1 13 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.374 0.569 18518
8607 1 13 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.462 0.187 18518
8608 1 13 . 1 1 95 95 ILE N N 95 124.174 124.174 123.436 0.738 18518
8609 1 13 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.830 0.119 18518
8610 1 13 . 1 1 95 95 ILE C C 95 176.498 176.498 177.464 -0.966 18518
8611 1 13 . 1 1 95 95 ILE CA C 95 63.904 63.904 62.202 1.702 18518
8612 1 13 . 1 1 95 95 ILE CB C 95 38.182 38.182 37.972 0.210 18518
8613 1 13 . 1 1 95 95 ILE H H 95 9.305 9.305 8.537 0.768 18518
8614 1 13 . 1 1 96 96 SER N N 96 116.920 116.920 116.596 0.324 18518
8615 1 13 . 1 1 96 96 SER HA H 96 4.029 4.029 4.236 -0.207 18518
8616 1 13 . 1 1 96 96 SER C C 96 176.574 176.574 176.096 0.478 18518
8617 1 13 . 1 1 96 96 SER CA C 96 61.356 61.356 62.517 -1.161 18518
8618 1 13 . 1 1 96 96 SER CB C 96 61.723 61.723 62.929 -1.206 18518
8619 1 13 . 1 1 96 96 SER H H 96 8.335 8.335 7.919 0.416 18518
8620 1 13 . 1 1 97 97 GLU N N 97 123.255 123.255 121.174 2.081 18518
8621 1 13 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.176 0.102 18518
8622 1 13 . 1 1 97 97 GLU C C 97 179.716 179.716 179.009 0.707 18518
8623 1 13 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.941 -0.149 18518
8624 1 13 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.286 0.276 18518
8625 1 13 . 1 1 97 97 GLU H H 97 7.376 7.376 7.803 -0.427 18518
8626 1 13 . 1 1 98 98 VAL N N 98 121.137 121.137 120.779 0.358 18518
8627 1 13 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.704 0.098 18518
8628 1 13 . 1 1 98 98 VAL C C 98 177.637 177.637 177.967 -0.330 18518
8629 1 13 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.662 -0.838 18518
8630 1 13 . 1 1 98 98 VAL CB C 98 32.154 32.154 31.168 0.986 18518
8631 1 13 . 1 1 98 98 VAL H H 98 7.387 7.387 7.889 -0.502 18518
8632 1 13 . 1 1 99 99 TYR N N 99 118.927 118.927 121.469 -2.542 18518
8633 1 13 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.165 -0.175 18518
8634 1 13 . 1 1 99 99 TYR C C 99 176.081 176.081 177.372 -1.291 18518
8635 1 13 . 1 1 99 99 TYR CA C 99 62.223 62.223 60.109 2.114 18518
8636 1 13 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.172 0.810 18518
8637 1 13 . 1 1 99 99 TYR H H 99 9.048 9.048 8.511 0.537 18518
8638 1 13 . 1 1 100 100 GLU N N 100 113.894 113.894 116.265 -2.371 18518
8639 1 13 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.701 0.144 18518
8640 1 13 . 1 1 100 100 GLU C C 100 177.989 177.989 178.871 -0.882 18518
8641 1 13 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.813 0.274 18518
8642 1 13 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.727 0.655 18518
8643 1 13 . 1 1 100 100 GLU H H 100 7.422 7.422 8.284 -0.862 18518
8644 1 13 . 1 1 101 101 SER N N 101 108.991 108.991 116.008 -7.017 18518
8645 1 13 . 1 1 101 101 SER HA H 101 4.524 4.524 4.370 0.154 18518
8646 1 13 . 1 1 101 101 SER C C 101 176.628 176.628 175.907 0.721 18518
8647 1 13 . 1 1 101 101 SER CA C 101 60.349 60.349 60.915 -0.566 18518
8648 1 13 . 1 1 101 101 SER CB C 101 64.741 64.741 63.464 1.277 18518
8649 1 13 . 1 1 101 101 SER H H 101 7.424 7.424 7.899 -0.475 18518
8650 1 13 . 1 1 102 102 GLU N N 102 116.533 116.533 118.975 -2.442 18518
8651 1 13 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.521 0.223 18518
8652 1 13 . 1 1 102 102 GLU C C 102 176.774 176.774 176.468 0.306 18518
8653 1 13 . 1 1 102 102 GLU CA C 102 55.581 55.581 55.517 0.064 18518
8654 1 13 . 1 1 102 102 GLU CB C 102 30.697 30.697 30.509 0.188 18518
8655 1 13 . 1 1 102 102 GLU H H 102 8.487 8.487 7.948 0.539 18518
8656 1 13 . 1 1 103 103 LYS N N 103 118.370 118.370 121.167 -2.797 18518
8657 1 13 . 1 1 103 103 LYS HA H 103 4.178 4.178 4.123 0.055 18518
8658 1 13 . 1 1 103 103 LYS C C 103 175.018 175.018 176.823 -1.805 18518
8659 1 13 . 1 1 103 103 LYS CA C 103 57.329 57.329 57.179 0.150 18518
8660 1 13 . 1 1 103 103 LYS CB C 103 32.186 32.186 32.218 -0.032 18518
8661 1 13 . 1 1 103 103 LYS H H 103 7.831 7.831 7.920 -0.089 18518
8662 1 13 . 1 1 104 104 ASP N N 104 123.500 123.500 124.064 -0.564 18518
8663 1 13 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.726 0.029 18518
8664 1 13 . 1 1 104 104 ASP C C 104 177.383 177.383 177.352 0.031 18518
8665 1 13 . 1 1 104 104 ASP CA C 104 53.846 53.846 54.187 -0.341 18518
8666 1 13 . 1 1 104 104 ASP CB C 104 43.411 43.411 43.299 0.112 18518
8667 1 13 . 1 1 104 104 ASP H H 104 9.041 9.041 8.242 0.799 18518
8668 1 13 . 1 1 105 105 GLU N N 105 125.448 125.448 121.324 4.124 18518
8669 1 13 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.134 0.046 18518
8670 1 13 . 1 1 105 105 GLU C C 105 177.519 177.519 177.415 0.104 18518
8671 1 13 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.752 0.777 18518
8672 1 13 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.853 0.191 18518
8673 1 13 . 1 1 105 105 GLU H H 105 8.906 8.906 8.701 0.205 18518
8674 1 13 . 1 1 106 106 ASP N N 106 118.824 118.824 117.526 1.298 18518
8675 1 13 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.657 -0.478 18518
8676 1 13 . 1 1 106 106 ASP C C 106 176.223 176.223 177.060 -0.837 18518
8677 1 13 . 1 1 106 106 ASP CA C 106 54.756 54.756 55.120 -0.364 18518
8678 1 13 . 1 1 106 106 ASP CB C 106 39.999 39.999 42.031 -2.031 18518
8679 1 13 . 1 1 106 106 ASP H H 106 10.036 10.036 8.663 1.373 18518
8680 1 13 . 1 1 107 107 GLY N N 107 105.866 105.866 106.939 -1.073 18518
8681 1 13 . 1 1 107 107 GLY C C 107 175.136 175.136 173.799 1.337 18518
8682 1 13 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.613 -0.391 18518
8683 1 13 . 1 1 107 107 GLY H H 107 8.001 8.001 7.775 0.226 18518
8684 1 13 . 1 1 108 108 PHE N N 108 123.820 123.820 120.985 2.835 18518
8685 1 13 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.841 -0.179 18518
8686 1 13 . 1 1 108 108 PHE C C 108 174.899 174.899 174.490 0.409 18518
8687 1 13 . 1 1 108 108 PHE CA C 108 60.238 60.238 55.699 4.539 18518
8688 1 13 . 1 1 108 108 PHE CB C 108 40.365 40.365 40.633 -0.268 18518
8689 1 13 . 1 1 108 108 PHE H H 108 9.912 9.912 7.846 2.066 18518
8690 1 13 . 1 1 109 109 LEU N N 109 120.130 120.130 127.312 -7.182 18518
8691 1 13 . 1 1 109 109 LEU HA H 109 5.030 5.030 5.156 -0.126 18518
8692 1 13 . 1 1 109 109 LEU C C 109 173.916 173.916 174.665 -0.749 18518
8693 1 13 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.223 0.201 18518
8694 1 13 . 1 1 109 109 LEU CB C 109 45.203 45.203 43.578 1.625 18518
8695 1 13 . 1 1 109 109 LEU H H 109 7.997 7.997 8.725 -0.728 18518
8696 1 13 . 1 1 110 110 TYR N N 110 126.579 126.579 127.145 -0.566 18518
8697 1 13 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.795 0.208 18518
8698 1 13 . 1 1 110 110 TYR C C 110 176.671 176.671 175.626 1.045 18518
8699 1 13 . 1 1 110 110 TYR CA C 110 59.058 59.058 57.923 1.135 18518
8700 1 13 . 1 1 110 110 TYR CB C 110 39.556 39.556 40.636 -1.080 18518
8701 1 13 . 1 1 110 110 TYR H H 110 9.377 9.377 8.703 0.674 18518
8702 1 13 . 1 1 111 111 MET N N 111 119.240 119.240 121.749 -2.509 18518
8703 1 13 . 1 1 111 111 MET HA H 111 5.486 5.486 5.293 0.193 18518
8704 1 13 . 1 1 111 111 MET C C 111 175.695 175.695 174.561 1.134 18518
8705 1 13 . 1 1 111 111 MET CA C 111 54.124 54.124 54.699 -0.575 18518
8706 1 13 . 1 1 111 111 MET CB C 111 36.960 36.960 37.554 -0.595 18518
8707 1 13 . 1 1 111 111 MET H H 111 9.658 9.658 9.043 0.615 18518
8708 1 13 . 1 1 112 112 VAL N N 112 119.865 119.865 118.415 1.450 18518
8709 1 13 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.460 0.503 18518
8710 1 13 . 1 1 112 112 VAL C C 112 175.058 175.058 174.319 0.739 18518
8711 1 13 . 1 1 112 112 VAL CA C 112 58.911 58.911 60.318 -1.407 18518
8712 1 13 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.009 1.042 18518
8713 1 13 . 1 1 112 112 VAL H H 112 8.794 8.794 9.021 -0.227 18518
8714 1 13 . 1 1 113 113 TYR N N 113 119.664 119.664 120.492 -0.828 18518
8715 1 13 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.871 0.247 18518
8716 1 13 . 1 1 113 113 TYR C C 113 173.375 173.375 173.630 -0.255 18518
8717 1 13 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.241 -1.088 18518
8718 1 13 . 1 1 113 113 TYR CB C 113 43.312 43.312 42.081 1.231 18518
8719 1 13 . 1 1 113 113 TYR H H 113 8.315 8.315 8.594 -0.279 18518
8720 1 13 . 1 1 114 114 ALA N N 114 119.763 119.763 123.065 -3.302 18518
8721 1 13 . 1 1 114 114 ALA HA H 114 4.800 4.800 5.011 -0.211 18518
8722 1 13 . 1 1 114 114 ALA C C 114 176.216 176.216 175.254 0.962 18518
8723 1 13 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.835 -0.703 18518
8724 1 13 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.265 2.331 18518
8725 1 13 . 1 1 114 114 ALA H H 114 8.465 8.465 8.986 -0.521 18518
8726 1 13 . 1 1 115 115 SER N N 115 114.763 114.763 116.032 -1.269 18518
8727 1 13 . 1 1 115 115 SER HA H 115 4.496 4.496 4.968 -0.472 18518
8728 1 13 . 1 1 115 115 SER C C 115 172.671 172.671 173.619 -0.948 18518
8729 1 13 . 1 1 115 115 SER CA C 115 58.651 58.651 57.503 1.148 18518
8730 1 13 . 1 1 115 115 SER CB C 115 63.526 63.526 61.553 1.973 18518
8731 1 13 . 1 1 115 115 SER H H 115 9.915 9.915 8.954 0.961 18518
8732 1 13 . 1 1 116 116 GLN N N 116 116.611 116.611 123.510 -6.899 18518
8733 1 13 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.266 0.218 18518
8734 1 13 . 1 1 116 116 GLN C C 116 172.733 172.733 173.228 -0.495 18518
8735 1 13 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.482 -1.556 18518
8736 1 13 . 1 1 116 116 GLN CB C 116 32.358 32.358 31.133 1.225 18518
8737 1 13 . 1 1 116 116 GLN H H 116 7.219 7.219 7.927 -0.708 18518
8738 1 13 . 1 1 117 117 GLU N N 117 117.623 117.623 120.587 -2.964 18518
8739 1 13 . 1 1 117 117 GLU HA H 117 3.287 3.287 2.512 0.775 18518
8740 1 13 . 1 1 117 117 GLU C C 117 175.168 175.168 175.441 -0.273 18518
8741 1 13 . 1 1 117 117 GLU CA C 117 56.882 56.882 56.634 0.248 18518
8742 1 13 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.549 0.973 18518
8743 1 13 . 1 1 117 117 GLU H H 117 7.882 7.882 8.198 -0.316 18518
8744 1 13 . 1 1 118 118 THR N N 118 109.820 109.820 111.439 -1.619 18518
8745 1 13 . 1 1 118 118 THR HA H 118 4.066 4.066 4.211 -0.145 18518
8746 1 13 . 1 1 118 118 THR C C 118 172.355 172.355 173.583 -1.228 18518
8747 1 13 . 1 1 118 118 THR CA C 118 60.029 60.029 60.460 -0.431 18518
8748 1 13 . 1 1 118 118 THR CB C 118 70.480 70.480 69.350 1.130 18518
8749 1 13 . 1 1 118 118 THR H H 118 6.992 6.992 7.229 -0.237 18518
8750 1 14 . 1 1 2 2 ALA HA H 2 4.336 4.336 5.225 -0.889 18518
8751 1 14 . 1 1 2 2 ALA C C 2 177.974 177.974 176.227 1.747 18518
8752 1 14 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.366 1.419 18518
8753 1 14 . 1 1 2 2 ALA CB C 2 19.444 19.444 21.260 -1.816 18518
8754 1 14 . 1 1 3 3 MET N N 3 119.311 119.311 120.676 -1.365 18518
8755 1 14 . 1 1 3 3 MET HA H 3 4.451 4.451 4.643 -0.192 18518
8756 1 14 . 1 1 3 3 MET C C 3 176.913 176.913 175.873 1.040 18518
8757 1 14 . 1 1 3 3 MET CA C 3 55.679 55.679 55.133 0.546 18518
8758 1 14 . 1 1 3 3 MET CB C 3 32.590 32.590 34.819 -2.229 18518
8759 1 14 . 1 1 3 3 MET H H 3 8.638 8.638 8.523 0.115 18518
8760 1 14 . 1 1 4 4 GLY N N 4 110.281 110.281 110.319 -0.038 18518
8761 1 14 . 1 1 4 4 GLY C C 4 174.180 174.180 174.175 0.005 18518
8762 1 14 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.571 0.924 18518
8763 1 14 . 1 1 4 4 GLY H H 4 8.552 8.552 8.509 0.043 18518
8764 1 14 . 1 1 5 5 LYS N N 5 120.818 120.818 122.113 -1.295 18518
8765 1 14 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.326 0.183 18518
8766 1 14 . 1 1 5 5 LYS C C 5 177.605 177.605 176.948 0.657 18518
8767 1 14 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.685 0.449 18518
8768 1 14 . 1 1 5 5 LYS CB C 5 34.813 34.813 32.932 1.881 18518
8769 1 14 . 1 1 5 5 LYS H H 5 8.133 8.133 8.364 -0.231 18518
8770 1 14 . 1 1 6 6 THR N N 6 114.781 114.781 118.574 -3.793 18518
8771 1 14 . 1 1 6 6 THR HA H 6 4.421 4.421 4.331 0.090 18518
8772 1 14 . 1 1 6 6 THR C C 6 175.524 175.524 175.913 -0.389 18518
8773 1 14 . 1 1 6 6 THR CA C 6 61.127 61.127 61.623 -0.496 18518
8774 1 14 . 1 1 6 6 THR CB C 6 69.926 69.926 69.889 0.037 18518
8775 1 14 . 1 1 6 6 THR H H 6 8.483 8.483 8.354 0.129 18518
8776 1 14 . 1 1 7 7 PHE N N 7 125.552 125.552 121.778 3.774 18518
8777 1 14 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.060 -0.055 18518
8778 1 14 . 1 1 7 7 PHE C C 7 177.397 177.397 177.012 0.385 18518
8779 1 14 . 1 1 7 7 PHE CA C 7 63.393 63.393 60.971 2.422 18518
8780 1 14 . 1 1 7 7 PHE CB C 7 39.567 39.567 37.627 1.940 18518
8781 1 14 . 1 1 7 7 PHE H H 7 10.245 10.245 8.947 1.298 18518
8782 1 14 . 1 1 8 8 LYS N N 8 114.053 114.053 117.448 -3.395 18518
8783 1 14 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.938 -0.103 18518
8784 1 14 . 1 1 8 8 LYS C C 8 175.520 175.520 178.566 -3.046 18518
8785 1 14 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.467 1.526 18518
8786 1 14 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.364 2.325 18518
8787 1 14 . 1 1 8 8 LYS H H 8 8.775 8.775 6.934 1.841 18518
8788 1 14 . 1 1 9 9 GLN N N 9 113.516 113.516 118.059 -4.543 18518
8789 1 14 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.191 -0.042 18518
8790 1 14 . 1 1 9 9 GLN C C 9 177.615 177.615 177.543 0.072 18518
8791 1 14 . 1 1 9 9 GLN CA C 9 56.819 56.819 57.418 -0.599 18518
8792 1 14 . 1 1 9 9 GLN CB C 9 30.019 30.019 28.967 1.052 18518
8793 1 14 . 1 1 9 9 GLN H H 9 7.355 7.355 7.755 -0.400 18518
8794 1 14 . 1 1 10 10 ARG N N 10 118.294 118.294 117.036 1.258 18518
8795 1 14 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.169 0.133 18518
8796 1 14 . 1 1 10 10 ARG C C 10 179.380 179.380 177.392 1.988 18518
8797 1 14 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.800 -0.532 18518
8798 1 14 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.394 1.248 18518
8799 1 14 . 1 1 10 10 ARG H H 10 7.936 7.936 7.637 0.299 18518
8800 1 14 . 1 1 11 11 ARG N N 11 121.137 121.137 120.792 0.345 18518
8801 1 14 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.964 -0.284 18518
8802 1 14 . 1 1 11 11 ARG CA C 11 53.453 53.453 54.126 -0.673 18518
8803 1 14 . 1 1 11 11 ARG CB C 11 32.938 32.938 31.558 1.380 18518
8804 1 14 . 1 1 11 11 ARG H H 11 7.390 7.390 7.761 -0.371 18518
8805 1 14 . 1 1 12 12 THR N N 12 116.819 116.819 122.027 -5.208 18518
8806 1 14 . 1 1 12 12 THR HA H 12 4.359 4.359 4.250 0.109 18518
8807 1 14 . 1 1 12 12 THR C C 12 174.989 174.989 175.754 -0.765 18518
8808 1 14 . 1 1 12 12 THR CA C 12 61.748 61.748 64.105 -2.357 18518
8809 1 14 . 1 1 12 12 THR CB C 12 71.068 71.068 69.587 1.481 18518
8810 1 14 . 1 1 12 12 THR H H 12 8.953 8.953 8.645 0.308 18518
8811 1 14 . 1 1 13 13 PHE N N 13 123.200 123.200 123.787 -0.587 18518
8812 1 14 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.148 -0.120 18518
8813 1 14 . 1 1 13 13 PHE C C 13 176.029 176.029 177.416 -1.387 18518
8814 1 14 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.914 -0.050 18518
8815 1 14 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.211 0.349 18518
8816 1 14 . 1 1 13 13 PHE H H 13 9.284 9.284 8.849 0.435 18518
8817 1 14 . 1 1 14 14 GLU N N 14 115.414 115.414 118.273 -2.859 18518
8818 1 14 . 1 1 14 14 GLU HA H 14 3.794 3.794 4.127 -0.333 18518
8819 1 14 . 1 1 14 14 GLU C C 14 180.081 180.081 179.151 0.930 18518
8820 1 14 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.978 0.641 18518
8821 1 14 . 1 1 14 14 GLU CB C 14 28.852 28.852 29.043 -0.191 18518
8822 1 14 . 1 1 14 14 GLU H H 14 8.973 8.973 8.829 0.144 18518
8823 1 14 . 1 1 15 15 GLN N N 15 119.276 119.276 118.532 0.744 18518
8824 1 14 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.100 -0.100 18518
8825 1 14 . 1 1 15 15 GLN C C 15 177.978 177.978 178.640 -0.662 18518
8826 1 14 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.908 -0.073 18518
8827 1 14 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.436 0.935 18518
8828 1 14 . 1 1 15 15 GLN H H 15 7.756 7.756 8.525 -0.769 18518
8829 1 14 . 1 1 16 16 ARG N N 16 121.336 121.336 119.910 1.426 18518
8830 1 14 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.170 0.100 18518
8831 1 14 . 1 1 16 16 ARG C C 16 177.416 177.416 178.640 -1.224 18518
8832 1 14 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.749 1.626 18518
8833 1 14 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.469 0.136 18518
8834 1 14 . 1 1 16 16 ARG H H 16 8.645 8.645 8.067 0.578 18518
8835 1 14 . 1 1 17 17 VAL N N 17 117.630 117.630 116.617 1.013 18518
8836 1 14 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.819 0.038 18518
8837 1 14 . 1 1 17 17 VAL C C 17 179.748 179.748 178.037 1.711 18518
8838 1 14 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.487 0.239 18518
8839 1 14 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.431 0.763 18518
8840 1 14 . 1 1 17 17 VAL H H 17 8.373 8.373 7.958 0.415 18518
8841 1 14 . 1 1 18 18 GLU N N 18 120.864 120.864 120.324 0.540 18518
8842 1 14 . 1 1 18 18 GLU HA H 18 4.302 4.302 4.011 0.291 18518
8843 1 14 . 1 1 18 18 GLU C C 18 177.728 177.728 178.225 -0.497 18518
8844 1 14 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.529 -1.043 18518
8845 1 14 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.596 -0.214 18518
8846 1 14 . 1 1 18 18 GLU H H 18 7.368 7.368 8.255 -0.887 18518
8847 1 14 . 1 1 19 19 ASP N N 19 121.425 121.425 120.310 1.115 18518
8848 1 14 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.431 0.003 18518
8849 1 14 . 1 1 19 19 ASP C C 19 179.978 179.978 178.465 1.513 18518
8850 1 14 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.551 -0.129 18518
8851 1 14 . 1 1 19 19 ASP CB C 19 41.287 41.287 41.290 -0.003 18518
8852 1 14 . 1 1 19 19 ASP H H 19 8.671 8.671 7.917 0.754 18518
8853 1 14 . 1 1 20 20 VAL N N 20 119.730 119.730 117.411 2.319 18518
8854 1 14 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.462 -0.257 18518
8855 1 14 . 1 1 20 20 VAL C C 20 176.284 176.284 177.665 -1.381 18518
8856 1 14 . 1 1 20 20 VAL CA C 20 66.315 66.315 65.855 0.460 18518
8857 1 14 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.143 -0.036 18518
8858 1 14 . 1 1 20 20 VAL H H 20 7.999 7.999 8.211 -0.212 18518
8859 1 14 . 1 1 21 21 ARG N N 21 121.455 121.455 119.188 2.267 18518
8860 1 14 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.948 -0.134 18518
8861 1 14 . 1 1 21 21 ARG C C 21 180.120 180.120 178.479 1.641 18518
8862 1 14 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.798 1.032 18518
8863 1 14 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.181 0.765 18518
8864 1 14 . 1 1 21 21 ARG H H 21 8.098 8.098 7.753 0.345 18518
8865 1 14 . 1 1 22 22 LEU N N 22 117.826 117.826 121.653 -3.827 18518
8866 1 14 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.048 0.001 18518
8867 1 14 . 1 1 22 22 LEU C C 22 180.115 180.115 178.426 1.689 18518
8868 1 14 . 1 1 22 22 LEU CA C 22 57.790 57.790 57.917 -0.127 18518
8869 1 14 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.535 0.607 18518
8870 1 14 . 1 1 22 22 LEU H H 22 8.207 8.207 7.809 0.398 18518
8871 1 14 . 1 1 23 23 ILE N N 23 121.450 121.450 119.186 2.264 18518
8872 1 14 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.595 0.418 18518
8873 1 14 . 1 1 23 23 ILE C C 23 178.149 178.149 178.339 -0.190 18518
8874 1 14 . 1 1 23 23 ILE CA C 23 62.171 62.171 65.387 -3.216 18518
8875 1 14 . 1 1 23 23 ILE CB C 23 38.106 38.106 37.634 0.472 18518
8876 1 14 . 1 1 23 23 ILE H H 23 8.105 8.105 8.433 -0.328 18518
8877 1 14 . 1 1 24 24 ARG N N 24 121.139 121.139 118.879 2.260 18518
8878 1 14 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.063 -0.076 18518
8879 1 14 . 1 1 24 24 ARG C C 24 178.702 178.702 178.852 -0.150 18518
8880 1 14 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.794 -1.076 18518
8881 1 14 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.857 -1.087 18518
8882 1 14 . 1 1 24 24 ARG H H 24 8.601 8.601 8.411 0.190 18518
8883 1 14 . 1 1 25 25 GLU N N 25 118.054 118.054 119.718 -1.664 18518
8884 1 14 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.160 -0.134 18518
8885 1 14 . 1 1 25 25 GLU C C 25 178.492 178.492 178.852 -0.360 18518
8886 1 14 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.623 0.157 18518
8887 1 14 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.509 0.492 18518
8888 1 14 . 1 1 25 25 GLU H H 25 7.423 7.423 7.803 -0.380 18518
8889 1 14 . 1 1 26 26 GLN N N 26 116.350 116.350 116.803 -0.453 18518
8890 1 14 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.018 -0.082 18518
8891 1 14 . 1 1 26 26 GLN C C 26 176.305 176.305 176.656 -0.351 18518
8892 1 14 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.686 -0.183 18518
8893 1 14 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.738 0.469 18518
8894 1 14 . 1 1 26 26 GLN H H 26 7.524 7.524 8.038 -0.514 18518
8895 1 14 . 1 1 27 27 HIS N N 27 116.017 116.017 118.149 -2.132 18518
8896 1 14 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.060 -0.130 18518
8897 1 14 . 1 1 27 27 HIS CA C 27 53.054 53.054 53.230 -0.176 18518
8898 1 14 . 1 1 27 27 HIS CB C 27 30.747 30.747 31.595 -0.848 18518
8899 1 14 . 1 1 27 27 HIS H H 27 8.284 8.284 7.985 0.299 18518
8900 1 14 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.597 -0.016 18518
8901 1 14 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.469 0.450 18518
8902 1 14 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.204 0.251 18518
8903 1 14 . 1 1 29 29 THR N N 29 107.011 107.011 108.645 -1.634 18518
8904 1 14 . 1 1 29 29 THR HA H 29 4.599 4.599 4.629 -0.030 18518
8905 1 14 . 1 1 29 29 THR C C 29 172.884 172.884 174.316 -1.432 18518
8906 1 14 . 1 1 29 29 THR CA C 29 60.810 60.810 61.255 -0.445 18518
8907 1 14 . 1 1 29 29 THR CB C 29 68.531 68.531 68.738 -0.207 18518
8908 1 14 . 1 1 29 29 THR H H 29 7.890 7.890 8.398 -0.508 18518
8909 1 14 . 1 1 30 30 LYS N N 30 117.679 117.679 121.467 -3.788 18518
8910 1 14 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.969 -0.111 18518
8911 1 14 . 1 1 30 30 LYS C C 30 174.310 174.310 174.790 -0.480 18518
8912 1 14 . 1 1 30 30 LYS CA C 30 53.751 53.751 53.879 -0.128 18518
8913 1 14 . 1 1 30 30 LYS CB C 30 35.804 35.804 35.548 0.256 18518
8914 1 14 . 1 1 30 30 LYS H H 30 7.441 7.441 7.548 -0.107 18518
8915 1 14 . 1 1 31 31 ILE N N 31 122.849 122.849 123.441 -0.592 18518
8916 1 14 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.356 -0.251 18518
8917 1 14 . 1 1 31 31 ILE CA C 31 54.801 54.801 56.343 -1.542 18518
8918 1 14 . 1 1 31 31 ILE CB C 31 38.265 38.265 38.145 0.120 18518
8919 1 14 . 1 1 31 31 ILE H H 31 9.304 9.304 9.031 0.273 18518
8920 1 14 . 1 1 32 32 PRO HA H 32 5.159 5.159 5.058 0.101 18518
8921 1 14 . 1 1 32 32 PRO C C 32 174.164 174.164 175.755 -1.591 18518
8922 1 14 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.146 -0.643 18518
8923 1 14 . 1 1 32 32 PRO CB C 32 31.145 31.145 31.215 -0.070 18518
8924 1 14 . 1 1 33 33 VAL N N 33 125.606 125.606 125.769 -0.163 18518
8925 1 14 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.022 0.191 18518
8926 1 14 . 1 1 33 33 VAL C C 33 173.654 173.654 173.672 -0.018 18518
8927 1 14 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.137 0.907 18518
8928 1 14 . 1 1 33 33 VAL CB C 33 35.604 35.604 36.265 -0.661 18518
8929 1 14 . 1 1 33 33 VAL H H 33 9.424 9.424 8.524 0.900 18518
8930 1 14 . 1 1 34 34 ILE N N 34 128.241 128.241 128.389 -0.148 18518
8931 1 14 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.895 -0.062 18518
8932 1 14 . 1 1 34 34 ILE C C 34 175.605 175.605 174.987 0.618 18518
8933 1 14 . 1 1 34 34 ILE CA C 34 56.765 56.765 59.649 -2.884 18518
8934 1 14 . 1 1 34 34 ILE CB C 34 36.799 36.799 39.695 -2.896 18518
8935 1 14 . 1 1 34 34 ILE H H 34 8.721 8.721 9.144 -0.423 18518
8936 1 14 . 1 1 35 35 ILE N N 35 125.650 125.650 127.909 -2.259 18518
8937 1 14 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.745 0.090 18518
8938 1 14 . 1 1 35 35 ILE C C 35 174.887 174.887 174.553 0.334 18518
8939 1 14 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.148 0.797 18518
8940 1 14 . 1 1 35 35 ILE CB C 35 39.210 39.210 39.013 0.197 18518
8941 1 14 . 1 1 35 35 ILE H H 35 9.034 9.034 8.719 0.315 18518
8942 1 14 . 1 1 36 36 GLU N N 36 122.657 122.657 127.871 -5.214 18518
8943 1 14 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.883 -0.022 18518
8944 1 14 . 1 1 36 36 GLU C C 36 173.848 173.848 174.554 -0.706 18518
8945 1 14 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.122 -0.190 18518
8946 1 14 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.057 1.225 18518
8947 1 14 . 1 1 36 36 GLU H H 36 8.303 8.303 8.787 -0.484 18518
8948 1 14 . 1 1 37 37 ARG N N 37 123.228 123.228 123.952 -0.724 18518
8949 1 14 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.275 -0.549 18518
8950 1 14 . 1 1 37 37 ARG C C 37 176.359 176.359 175.677 0.682 18518
8951 1 14 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.218 0.141 18518
8952 1 14 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.906 0.435 18518
8953 1 14 . 1 1 37 37 ARG H H 37 8.856 8.856 8.493 0.363 18518
8954 1 14 . 1 1 38 38 TYR N N 38 128.981 128.981 127.602 1.379 18518
8955 1 14 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.372 -0.020 18518
8956 1 14 . 1 1 38 38 TYR C C 38 177.316 177.316 176.512 0.804 18518
8957 1 14 . 1 1 38 38 TYR CA C 38 57.712 57.712 57.817 -0.105 18518
8958 1 14 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.325 -0.854 18518
8959 1 14 . 1 1 38 38 TYR H H 38 8.628 8.628 8.203 0.425 18518
8960 1 14 . 1 1 39 39 LYS N N 39 130.635 130.635 125.605 5.030 18518
8961 1 14 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.871 -0.049 18518
8962 1 14 . 1 1 39 39 LYS CA C 39 58.887 58.887 57.874 1.013 18518
8963 1 14 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.991 -0.220 18518
8964 1 14 . 1 1 39 39 LYS H H 39 8.594 8.594 8.189 0.405 18518
8965 1 14 . 1 1 40 40 GLY C C 40 173.447 173.447 173.700 -0.253 18518
8966 1 14 . 1 1 40 40 GLY CA C 40 44.663 44.663 44.010 0.653 18518
8967 1 14 . 1 1 40 40 GLY H H 40 5.188 5.188 6.457 -1.269 18518
8968 1 14 . 1 1 41 41 GLU N N 41 122.836 122.836 120.595 2.241 18518
8969 1 14 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.428 -0.171 18518
8970 1 14 . 1 1 41 41 GLU C C 41 176.524 176.524 175.129 1.395 18518
8971 1 14 . 1 1 41 41 GLU CA C 41 56.525 56.525 55.029 1.496 18518
8972 1 14 . 1 1 41 41 GLU CB C 41 30.985 30.985 29.478 1.507 18518
8973 1 14 . 1 1 41 41 GLU H H 41 7.380 7.380 7.749 -0.369 18518
8974 1 14 . 1 1 42 42 LYS N N 42 124.040 124.040 126.380 -2.340 18518
8975 1 14 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.411 0.264 18518
8976 1 14 . 1 1 42 42 LYS C C 42 177.538 177.538 177.242 0.296 18518
8977 1 14 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.682 -0.842 18518
8978 1 14 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.379 1.600 18518
8979 1 14 . 1 1 42 42 LYS H H 42 9.034 9.034 8.825 0.209 18518
8980 1 14 . 1 1 43 43 GLN N N 43 119.259 119.259 117.976 1.283 18518
8981 1 14 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.378 0.164 18518
8982 1 14 . 1 1 43 43 GLN C C 43 177.336 177.336 176.273 1.063 18518
8983 1 14 . 1 1 43 43 GLN CA C 43 57.673 57.673 56.500 1.173 18518
8984 1 14 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.246 0.536 18518
8985 1 14 . 1 1 43 43 GLN H H 43 8.435 8.435 8.994 -0.559 18518
8986 1 14 . 1 1 44 44 LEU N N 44 120.760 120.760 124.088 -3.328 18518
8987 1 14 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.733 -0.038 18518
8988 1 14 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.779 0.466 18518
8989 1 14 . 1 1 44 44 LEU CB C 44 43.596 43.596 41.233 2.363 18518
8990 1 14 . 1 1 44 44 LEU H H 44 9.126 9.126 8.524 0.603 18518
8991 1 14 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.537 0.180 18518
8992 1 14 . 1 1 45 45 PRO C C 45 175.797 175.797 176.799 -1.002 18518
8993 1 14 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.236 -0.125 18518
8994 1 14 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.430 0.162 18518
8995 1 14 . 1 1 46 46 VAL N N 46 119.052 119.052 120.990 -1.938 18518
8996 1 14 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.217 -0.350 18518
8997 1 14 . 1 1 46 46 VAL C C 46 175.640 175.640 176.058 -0.418 18518
8998 1 14 . 1 1 46 46 VAL CA C 46 62.944 62.944 62.076 0.868 18518
8999 1 14 . 1 1 46 46 VAL CB C 46 32.799 32.799 33.037 -0.238 18518
9000 1 14 . 1 1 46 46 VAL H H 46 8.543 8.543 8.160 0.383 18518
9001 1 14 . 1 1 47 47 LEU N N 47 130.203 130.203 125.909 4.294 18518
9002 1 14 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.473 -0.164 18518
9003 1 14 . 1 1 47 47 LEU C C 47 176.198 176.198 176.987 -0.789 18518
9004 1 14 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.482 -0.476 18518
9005 1 14 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.277 1.555 18518
9006 1 14 . 1 1 47 47 LEU H H 47 7.799 7.799 8.761 -0.962 18518
9007 1 14 . 1 1 48 48 ASP N N 48 122.403 122.403 119.893 2.510 18518
9008 1 14 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.613 -0.350 18518
9009 1 14 . 1 1 48 48 ASP C C 48 175.294 175.294 175.665 -0.371 18518
9010 1 14 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.732 0.100 18518
9011 1 14 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.404 -1.220 18518
9012 1 14 . 1 1 48 48 ASP H H 48 8.780 8.780 8.500 0.280 18518
9013 1 14 . 1 1 49 49 LYS N N 49 119.569 119.569 116.845 2.724 18518
9014 1 14 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.470 0.115 18518
9015 1 14 . 1 1 49 49 LYS C C 49 174.678 174.678 175.526 -0.848 18518
9016 1 14 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.383 -1.731 18518
9017 1 14 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.551 1.394 18518
9018 1 14 . 1 1 49 49 LYS H H 49 7.280 7.280 7.496 -0.216 18518
9019 1 14 . 1 1 50 50 THR N N 50 110.862 110.862 111.380 -0.518 18518
9020 1 14 . 1 1 50 50 THR HA H 50 4.811 4.811 4.801 0.010 18518
9021 1 14 . 1 1 50 50 THR C C 50 172.425 172.425 174.407 -1.982 18518
9022 1 14 . 1 1 50 50 THR CA C 50 62.645 62.645 62.549 0.096 18518
9023 1 14 . 1 1 50 50 THR CB C 50 71.648 71.648 70.255 1.393 18518
9024 1 14 . 1 1 50 50 THR H H 50 8.042 8.042 8.302 -0.260 18518
9025 1 14 . 1 1 51 51 LYS N N 51 120.008 120.008 121.937 -1.929 18518
9026 1 14 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.229 0.396 18518
9027 1 14 . 1 1 51 51 LYS C C 51 175.082 175.082 176.018 -0.936 18518
9028 1 14 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.500 -1.796 18518
9029 1 14 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.139 -0.763 18518
9030 1 14 . 1 1 51 51 LYS H H 51 7.119 7.119 7.362 -0.243 18518
9031 1 14 . 1 1 52 52 PHE N N 52 122.640 122.640 121.619 1.021 18518
9032 1 14 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.722 0.615 18518
9033 1 14 . 1 1 52 52 PHE C C 52 174.213 174.213 174.325 -0.112 18518
9034 1 14 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.933 -0.322 18518
9035 1 14 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.551 -0.411 18518
9036 1 14 . 1 1 52 52 PHE H H 52 9.709 9.709 9.217 0.492 18518
9037 1 14 . 1 1 53 53 LEU N N 53 122.157 122.157 122.705 -0.548 18518
9038 1 14 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.975 -0.028 18518
9039 1 14 . 1 1 53 53 LEU C C 53 175.769 175.769 175.826 -0.057 18518
9040 1 14 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.981 -1.024 18518
9041 1 14 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.612 0.803 18518
9042 1 14 . 1 1 53 53 LEU H H 53 8.959 8.959 8.512 0.447 18518
9043 1 14 . 1 1 54 54 VAL N N 54 124.919 124.919 125.860 -0.941 18518
9044 1 14 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.579 -0.020 18518
9045 1 14 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.876 0.254 18518
9046 1 14 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.734 1.234 18518
9047 1 14 . 1 1 54 54 VAL H H 54 8.922 8.922 8.461 0.461 18518
9048 1 14 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.829 -0.388 18518
9049 1 14 . 1 1 55 55 PRO C C 55 176.594 176.594 177.932 -1.338 18518
9050 1 14 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.033 2.282 18518
9051 1 14 . 1 1 55 55 PRO CB C 55 32.665 32.665 31.826 0.840 18518
9052 1 14 . 1 1 56 56 ASP N N 56 120.522 120.522 123.265 -2.743 18518
9053 1 14 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.172 -0.310 18518
9054 1 14 . 1 1 56 56 ASP C C 56 175.809 175.809 177.136 -1.327 18518
9055 1 14 . 1 1 56 56 ASP CA C 56 56.749 56.749 56.935 -0.186 18518
9056 1 14 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.590 -0.081 18518
9057 1 14 . 1 1 56 56 ASP H H 56 8.347 8.347 8.415 -0.068 18518
9058 1 14 . 1 1 57 57 HIS N N 57 113.482 113.482 115.835 -2.353 18518
9059 1 14 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.528 0.192 18518
9060 1 14 . 1 1 57 57 HIS C C 57 176.507 176.507 175.473 1.034 18518
9061 1 14 . 1 1 57 57 HIS CA C 57 55.589 55.589 56.421 -0.832 18518
9062 1 14 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.675 0.968 18518
9063 1 14 . 1 1 57 57 HIS H H 57 7.557 7.557 8.143 -0.586 18518
9064 1 14 . 1 1 58 58 VAL N N 58 123.279 123.279 121.342 1.937 18518
9065 1 14 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.263 -0.427 18518
9066 1 14 . 1 1 58 58 VAL C C 58 175.019 175.019 174.973 0.046 18518
9067 1 14 . 1 1 58 58 VAL CA C 58 62.823 62.823 61.006 1.817 18518
9068 1 14 . 1 1 58 58 VAL CB C 58 32.310 32.310 33.697 -1.387 18518
9069 1 14 . 1 1 58 58 VAL H H 58 7.345 7.345 7.306 0.039 18518
9070 1 14 . 1 1 59 59 ASN N N 59 123.781 123.781 124.470 -0.689 18518
9071 1 14 . 1 1 59 59 ASN HA H 59 5.126 5.126 4.862 0.264 18518
9072 1 14 . 1 1 59 59 ASN C C 59 176.558 176.558 176.319 0.239 18518
9073 1 14 . 1 1 59 59 ASN CA C 59 51.485 51.485 52.725 -1.240 18518
9074 1 14 . 1 1 59 59 ASN CB C 59 40.107 40.107 39.479 0.628 18518
9075 1 14 . 1 1 59 59 ASN H H 59 8.735 8.735 8.636 0.099 18518
9076 1 14 . 1 1 60 60 MET N N 60 117.453 117.453 118.383 -0.930 18518
9077 1 14 . 1 1 60 60 MET HA H 60 4.395 4.395 4.156 0.239 18518
9078 1 14 . 1 1 60 60 MET C C 60 178.144 178.144 178.230 -0.086 18518
9079 1 14 . 1 1 60 60 MET CA C 60 57.097 57.097 58.224 -1.127 18518
9080 1 14 . 1 1 60 60 MET CB C 60 30.140 30.140 31.121 -0.981 18518
9081 1 14 . 1 1 60 60 MET H H 60 8.227 8.227 8.250 -0.023 18518
9082 1 14 . 1 1 61 61 SER N N 61 114.216 114.216 114.981 -0.765 18518
9083 1 14 . 1 1 61 61 SER HA H 61 4.111 4.111 4.078 0.033 18518
9084 1 14 . 1 1 61 61 SER C C 61 177.335 177.335 176.974 0.361 18518
9085 1 14 . 1 1 61 61 SER CA C 61 61.590 61.590 62.460 -0.870 18518
9086 1 14 . 1 1 61 61 SER CB C 61 62.402 62.402 62.836 -0.434 18518
9087 1 14 . 1 1 61 61 SER H H 61 8.464 8.464 8.684 -0.220 18518
9088 1 14 . 1 1 62 62 GLU N N 62 123.004 123.004 121.243 1.761 18518
9089 1 14 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.117 -0.070 18518
9090 1 14 . 1 1 62 62 GLU C C 62 178.686 178.686 178.908 -0.222 18518
9091 1 14 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.807 -0.182 18518
9092 1 14 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.350 0.304 18518
9093 1 14 . 1 1 62 62 GLU H H 62 7.994 7.994 7.663 0.331 18518
9094 1 14 . 1 1 63 63 LEU N N 63 120.818 120.818 121.858 -1.040 18518
9095 1 14 . 1 1 63 63 LEU HA H 63 3.965 3.965 4.005 -0.040 18518
9096 1 14 . 1 1 63 63 LEU C C 63 178.046 178.046 178.760 -0.714 18518
9097 1 14 . 1 1 63 63 LEU CA C 63 57.920 57.920 58.250 -0.330 18518
9098 1 14 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.572 0.052 18518
9099 1 14 . 1 1 63 63 LEU H H 63 8.130 8.130 7.785 0.345 18518
9100 1 14 . 1 1 64 64 ILE N N 64 118.528 118.528 119.603 -1.075 18518
9101 1 14 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.617 -0.248 18518
9102 1 14 . 1 1 64 64 ILE C C 64 177.127 177.127 177.735 -0.608 18518
9103 1 14 . 1 1 64 64 ILE CA C 64 66.678 66.678 65.849 0.829 18518
9104 1 14 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.645 0.799 18518
9105 1 14 . 1 1 64 64 ILE H H 64 8.488 8.488 8.678 -0.190 18518
9106 1 14 . 1 1 65 65 LYS N N 65 118.336 118.336 120.490 -2.154 18518
9107 1 14 . 1 1 65 65 LYS HA H 65 3.701 3.701 4.045 -0.344 18518
9108 1 14 . 1 1 65 65 LYS C C 65 179.291 179.291 179.204 0.087 18518
9109 1 14 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.580 0.860 18518
9110 1 14 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.131 0.240 18518
9111 1 14 . 1 1 65 65 LYS H H 65 7.347 7.347 7.748 -0.401 18518
9112 1 14 . 1 1 66 66 ILE N N 66 120.171 120.171 120.808 -0.637 18518
9113 1 14 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.716 -0.138 18518
9114 1 14 . 1 1 66 66 ILE C C 66 178.873 178.873 178.183 0.690 18518
9115 1 14 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.488 -0.328 18518
9116 1 14 . 1 1 66 66 ILE CB C 66 38.633 38.633 38.036 0.597 18518
9117 1 14 . 1 1 66 66 ILE H H 66 7.901 7.901 8.138 -0.237 18518
9118 1 14 . 1 1 67 67 ILE N N 67 121.185 121.185 120.719 0.466 18518
9119 1 14 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.561 -0.115 18518
9120 1 14 . 1 1 67 67 ILE C C 67 177.150 177.150 177.627 -0.477 18518
9121 1 14 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.483 -1.677 18518
9122 1 14 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.352 -2.357 18518
9123 1 14 . 1 1 67 67 ILE H H 67 8.290 8.290 8.169 0.121 18518
9124 1 14 . 1 1 68 68 ARG N N 68 119.173 119.173 119.045 0.128 18518
9125 1 14 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.780 -0.849 18518
9126 1 14 . 1 1 68 68 ARG C C 68 178.496 178.496 178.752 -0.256 18518
9127 1 14 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.918 0.718 18518
9128 1 14 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.959 0.482 18518
9129 1 14 . 1 1 68 68 ARG H H 68 8.438 8.438 8.402 0.036 18518
9130 1 14 . 1 1 69 69 ARG N N 69 116.511 116.511 118.799 -2.288 18518
9131 1 14 . 1 1 69 69 ARG HA H 69 4.134 4.134 3.957 0.177 18518
9132 1 14 . 1 1 69 69 ARG C C 69 180.262 180.262 178.596 1.666 18518
9133 1 14 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.358 -0.651 18518
9134 1 14 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.238 -0.285 18518
9135 1 14 . 1 1 69 69 ARG H H 69 7.497 7.497 8.127 -0.630 18518
9136 1 14 . 1 1 70 70 ARG N N 70 123.297 123.297 118.100 5.197 18518
9137 1 14 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.120 -0.104 18518
9138 1 14 . 1 1 70 70 ARG C C 70 178.700 178.700 178.577 0.123 18518
9139 1 14 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.550 0.910 18518
9140 1 14 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.865 0.447 18518
9141 1 14 . 1 1 70 70 ARG H H 70 8.075 8.075 7.824 0.251 18518
9142 1 14 . 1 1 71 71 LEU N N 71 116.829 116.829 118.539 -1.710 18518
9143 1 14 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.161 -0.096 18518
9144 1 14 . 1 1 71 71 LEU C C 71 174.956 174.956 176.672 -1.716 18518
9145 1 14 . 1 1 71 71 LEU CA C 71 55.126 55.126 55.705 -0.579 18518
9146 1 14 . 1 1 71 71 LEU CB C 71 43.246 43.246 41.219 2.027 18518
9147 1 14 . 1 1 71 71 LEU H H 71 7.719 7.719 8.190 -0.471 18518
9148 1 14 . 1 1 72 72 GLN N N 72 114.991 114.991 113.072 1.919 18518
9149 1 14 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.901 -0.065 18518
9150 1 14 . 1 1 72 72 GLN C C 72 175.683 175.683 175.131 0.552 18518
9151 1 14 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.094 0.231 18518
9152 1 14 . 1 1 72 72 GLN CB C 72 26.004 26.004 26.356 -0.352 18518
9153 1 14 . 1 1 72 72 GLN H H 72 7.744 7.744 7.635 0.109 18518
9154 1 14 . 1 1 73 73 LEU N N 73 115.045 115.045 118.859 -3.814 18518
9155 1 14 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.060 0.176 18518
9156 1 14 . 1 1 73 73 LEU C C 73 178.762 178.762 177.324 1.438 18518
9157 1 14 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.285 -0.899 18518
9158 1 14 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.678 0.413 18518
9159 1 14 . 1 1 73 73 LEU H H 73 7.500 7.500 7.391 0.109 18518
9160 1 14 . 1 1 74 74 ASN N N 74 121.700 121.700 123.009 -1.309 18518
9161 1 14 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.506 0.184 18518
9162 1 14 . 1 1 74 74 ASN C C 74 176.617 176.617 175.857 0.760 18518
9163 1 14 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.895 -1.210 18518
9164 1 14 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.759 -0.161 18518
9165 1 14 . 1 1 74 74 ASN H H 74 9.045 9.045 8.335 0.710 18518
9166 1 14 . 1 1 75 75 ALA N N 75 123.952 123.952 122.836 1.116 18518
9167 1 14 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.321 -0.357 18518
9168 1 14 . 1 1 75 75 ALA C C 75 178.131 178.131 177.376 0.755 18518
9169 1 14 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.177 1.691 18518
9170 1 14 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.330 -0.612 18518
9171 1 14 . 1 1 75 75 ALA H H 75 8.784 8.784 8.632 0.152 18518
9172 1 14 . 1 1 76 76 ASN N N 76 112.295 112.295 116.065 -3.770 18518
9173 1 14 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.632 -0.052 18518
9174 1 14 . 1 1 76 76 ASN C C 76 175.448 175.448 175.444 0.004 18518
9175 1 14 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.657 -0.443 18518
9176 1 14 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.804 -0.484 18518
9177 1 14 . 1 1 76 76 ASN H H 76 8.391 8.391 8.218 0.173 18518
9178 1 14 . 1 1 77 77 GLN N N 77 120.577 120.577 118.874 1.703 18518
9179 1 14 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.525 -0.252 18518
9180 1 14 . 1 1 77 77 GLN C C 77 175.045 175.045 174.174 0.871 18518
9181 1 14 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.989 0.816 18518
9182 1 14 . 1 1 77 77 GLN CB C 77 30.157 30.157 30.422 -0.265 18518
9183 1 14 . 1 1 77 77 GLN H H 77 7.552 7.552 7.523 0.029 18518
9184 1 14 . 1 1 78 78 ALA N N 78 130.670 130.670 124.689 5.981 18518
9185 1 14 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.571 -0.400 18518
9186 1 14 . 1 1 78 78 ALA C C 78 176.512 176.512 175.701 0.811 18518
9187 1 14 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.392 1.450 18518
9188 1 14 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.206 -1.146 18518
9189 1 14 . 1 1 78 78 ALA H H 78 8.799 8.799 8.585 0.214 18518
9190 1 14 . 1 1 79 79 PHE N N 79 119.325 119.325 115.149 4.176 18518
9191 1 14 . 1 1 79 79 PHE HA H 79 4.434 4.434 4.826 -0.392 18518
9192 1 14 . 1 1 79 79 PHE C C 79 171.726 171.726 172.938 -1.212 18518
9193 1 14 . 1 1 79 79 PHE CA C 79 59.145 59.145 56.880 2.265 18518
9194 1 14 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.414 0.757 18518
9195 1 14 . 1 1 79 79 PHE H H 79 7.664 7.664 7.855 -0.191 18518
9196 1 14 . 1 1 80 80 PHE N N 80 126.314 126.314 120.322 5.992 18518
9197 1 14 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.562 -0.170 18518
9198 1 14 . 1 1 80 80 PHE C C 80 177.169 177.169 173.539 3.630 18518
9199 1 14 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.742 -0.089 18518
9200 1 14 . 1 1 80 80 PHE CB C 80 41.933 41.933 42.805 -0.872 18518
9201 1 14 . 1 1 80 80 PHE H H 80 8.508 8.508 9.403 -0.895 18518
9202 1 14 . 1 1 81 81 LEU N N 81 121.426 121.426 122.864 -1.438 18518
9203 1 14 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.157 -0.306 18518
9204 1 14 . 1 1 81 81 LEU C C 81 174.488 174.488 175.216 -0.728 18518
9205 1 14 . 1 1 81 81 LEU CA C 81 53.197 53.197 53.911 -0.714 18518
9206 1 14 . 1 1 81 81 LEU CB C 81 45.100 45.100 43.960 1.140 18518
9207 1 14 . 1 1 81 81 LEU H H 81 8.229 8.229 8.718 -0.489 18518
9208 1 14 . 1 1 82 82 LEU N N 82 125.155 125.155 127.022 -1.867 18518
9209 1 14 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.489 0.344 18518
9210 1 14 . 1 1 82 82 LEU C C 82 177.166 177.166 175.520 1.646 18518
9211 1 14 . 1 1 82 82 LEU CA C 82 54.197 54.197 54.083 0.114 18518
9212 1 14 . 1 1 82 82 LEU CB C 82 43.442 43.442 43.404 0.038 18518
9213 1 14 . 1 1 82 82 LEU H H 82 9.400 9.400 9.089 0.311 18518
9214 1 14 . 1 1 83 83 VAL N N 83 123.886 123.886 121.503 2.383 18518
9215 1 14 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.120 0.259 18518
9216 1 14 . 1 1 83 83 VAL C C 83 175.810 175.810 176.027 -0.217 18518
9217 1 14 . 1 1 83 83 VAL CA C 83 61.677 61.677 62.031 -0.354 18518
9218 1 14 . 1 1 83 83 VAL CB C 83 33.758 33.758 32.304 1.454 18518
9219 1 14 . 1 1 83 83 VAL H H 83 8.721 8.721 8.473 0.248 18518
9220 1 14 . 1 1 84 84 ASN N N 84 126.474 126.474 125.377 1.097 18518
9221 1 14 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.479 -0.083 18518
9222 1 14 . 1 1 84 84 ASN C C 84 175.164 175.164 175.045 0.119 18518
9223 1 14 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.758 -0.020 18518
9224 1 14 . 1 1 84 84 ASN CB C 84 37.950 37.950 38.015 -0.065 18518
9225 1 14 . 1 1 84 84 ASN H H 84 9.707 9.707 9.568 0.139 18518
9226 1 14 . 1 1 85 85 GLY N N 85 101.296 101.296 104.172 -2.876 18518
9227 1 14 . 1 1 85 85 GLY C C 85 173.680 173.680 173.193 0.487 18518
9228 1 14 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.895 0.708 18518
9229 1 14 . 1 1 85 85 GLY H H 85 8.644 8.644 8.338 0.306 18518
9230 1 14 . 1 1 86 86 HIS N N 86 117.238 117.238 116.290 0.948 18518
9231 1 14 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.685 0.332 18518
9232 1 14 . 1 1 86 86 HIS C C 86 173.841 173.841 174.167 -0.326 18518
9233 1 14 . 1 1 86 86 HIS CA C 86 53.796 53.796 53.028 0.768 18518
9234 1 14 . 1 1 86 86 HIS CB C 86 31.280 31.280 31.411 -0.131 18518
9235 1 14 . 1 1 86 86 HIS H H 86 7.918 7.918 8.050 -0.132 18518
9236 1 14 . 1 1 87 87 SER N N 87 118.179 118.179 120.662 -2.483 18518
9237 1 14 . 1 1 87 87 SER HA H 87 4.699 4.699 4.474 0.225 18518
9238 1 14 . 1 1 87 87 SER C C 87 175.904 175.904 174.318 1.586 18518
9239 1 14 . 1 1 87 87 SER CA C 87 58.271 58.271 58.231 0.040 18518
9240 1 14 . 1 1 87 87 SER CB C 87 63.735 63.735 61.877 1.859 18518
9241 1 14 . 1 1 87 87 SER H H 87 8.977 8.977 8.844 0.133 18518
9242 1 14 . 1 1 88 88 MET N N 88 125.472 125.472 124.050 1.422 18518
9243 1 14 . 1 1 88 88 MET HA H 88 4.830 4.830 4.703 0.127 18518
9244 1 14 . 1 1 88 88 MET C C 88 176.419 176.419 175.042 1.377 18518
9245 1 14 . 1 1 88 88 MET CA C 88 54.899 54.899 54.982 -0.083 18518
9246 1 14 . 1 1 88 88 MET CB C 88 33.336 33.336 33.226 0.110 18518
9247 1 14 . 1 1 88 88 MET H H 88 9.184 9.184 8.038 1.146 18518
9248 1 14 . 1 1 89 89 VAL N N 89 120.747 120.747 122.006 -1.259 18518
9249 1 14 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.252 -0.020 18518
9250 1 14 . 1 1 89 89 VAL C C 89 175.958 175.958 175.866 0.092 18518
9251 1 14 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.489 1.665 18518
9252 1 14 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.768 -1.890 18518
9253 1 14 . 1 1 89 89 VAL H H 89 8.233 8.233 7.570 0.663 18518
9254 1 14 . 1 1 90 90 SER N N 90 117.362 117.362 119.685 -2.323 18518
9255 1 14 . 1 1 90 90 SER HA H 90 4.590 4.590 4.666 -0.076 18518
9256 1 14 . 1 1 90 90 SER C C 90 175.741 175.741 176.220 -0.479 18518
9257 1 14 . 1 1 90 90 SER CA C 90 57.717 57.717 57.700 0.017 18518
9258 1 14 . 1 1 90 90 SER CB C 90 63.223 63.223 64.162 -0.938 18518
9259 1 14 . 1 1 90 90 SER H H 90 8.482 8.482 8.638 -0.156 18518
9260 1 14 . 1 1 91 91 VAL N N 91 120.466 120.466 119.942 0.524 18518
9261 1 14 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.814 0.233 18518
9262 1 14 . 1 1 91 91 VAL C C 91 176.329 176.329 176.445 -0.116 18518
9263 1 14 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.728 -1.236 18518
9264 1 14 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.864 0.704 18518
9265 1 14 . 1 1 91 91 VAL H H 91 8.188 8.188 8.596 -0.408 18518
9266 1 14 . 1 1 92 92 SER N N 92 116.398 116.398 113.819 2.579 18518
9267 1 14 . 1 1 92 92 SER HA H 92 4.636 4.636 4.496 0.140 18518
9268 1 14 . 1 1 92 92 SER C C 92 174.159 174.159 175.094 -0.935 18518
9269 1 14 . 1 1 92 92 SER CA C 92 57.805 57.805 59.350 -1.546 18518
9270 1 14 . 1 1 92 92 SER CB C 92 63.046 63.046 63.210 -0.164 18518
9271 1 14 . 1 1 92 92 SER H H 92 8.370 8.370 8.135 0.235 18518
9272 1 14 . 1 1 93 93 THR N N 93 119.211 119.211 120.805 -1.594 18518
9273 1 14 . 1 1 93 93 THR HA H 93 4.484 4.484 4.375 0.109 18518
9274 1 14 . 1 1 93 93 THR CA C 93 60.884 60.884 62.190 -1.306 18518
9275 1 14 . 1 1 93 93 THR CB C 93 70.609 70.609 68.938 1.671 18518
9276 1 14 . 1 1 93 93 THR H H 93 7.416 7.416 7.363 0.053 18518
9277 1 14 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.555 -0.115 18518
9278 1 14 . 1 1 94 94 PRO C C 94 178.775 178.775 176.704 2.071 18518
9279 1 14 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.626 0.317 18518
9280 1 14 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.397 0.252 18518
9281 1 14 . 1 1 95 95 ILE N N 95 124.174 124.174 124.746 -0.572 18518
9282 1 14 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.801 0.148 18518
9283 1 14 . 1 1 95 95 ILE C C 95 176.498 176.498 177.030 -0.532 18518
9284 1 14 . 1 1 95 95 ILE CA C 95 63.904 63.904 62.066 1.838 18518
9285 1 14 . 1 1 95 95 ILE CB C 95 38.182 38.182 37.962 0.220 18518
9286 1 14 . 1 1 95 95 ILE H H 95 9.305 9.305 8.175 1.130 18518
9287 1 14 . 1 1 96 96 SER N N 96 116.920 116.920 116.134 0.786 18518
9288 1 14 . 1 1 96 96 SER HA H 96 4.029 4.029 4.069 -0.040 18518
9289 1 14 . 1 1 96 96 SER C C 96 176.574 176.574 176.200 0.374 18518
9290 1 14 . 1 1 96 96 SER CA C 96 61.356 61.356 62.597 -1.241 18518
9291 1 14 . 1 1 96 96 SER CB C 96 61.723 61.723 62.867 -1.144 18518
9292 1 14 . 1 1 96 96 SER H H 96 8.335 8.335 8.415 -0.080 18518
9293 1 14 . 1 1 97 97 GLU N N 97 123.255 123.255 121.463 1.792 18518
9294 1 14 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.171 0.107 18518
9295 1 14 . 1 1 97 97 GLU C C 97 179.716 179.716 179.038 0.678 18518
9296 1 14 . 1 1 97 97 GLU CA C 97 58.792 58.792 59.031 -0.239 18518
9297 1 14 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.146 0.416 18518
9298 1 14 . 1 1 97 97 GLU H H 97 7.376 7.376 7.787 -0.411 18518
9299 1 14 . 1 1 98 98 VAL N N 98 121.137 121.137 121.004 0.133 18518
9300 1 14 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.598 0.204 18518
9301 1 14 . 1 1 98 98 VAL C C 98 177.637 177.637 177.894 -0.257 18518
9302 1 14 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.830 -1.006 18518
9303 1 14 . 1 1 98 98 VAL CB C 98 32.154 32.154 31.644 0.510 18518
9304 1 14 . 1 1 98 98 VAL H H 98 7.387 7.387 7.753 -0.366 18518
9305 1 14 . 1 1 99 99 TYR N N 99 118.927 118.927 121.301 -2.374 18518
9306 1 14 . 1 1 99 99 TYR HA H 99 3.990 3.990 3.985 0.005 18518
9307 1 14 . 1 1 99 99 TYR C C 99 176.081 176.081 176.852 -0.771 18518
9308 1 14 . 1 1 99 99 TYR CA C 99 62.223 62.223 61.928 0.295 18518
9309 1 14 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.593 0.389 18518
9310 1 14 . 1 1 99 99 TYR H H 99 9.048 9.048 8.394 0.654 18518
9311 1 14 . 1 1 100 100 GLU N N 100 113.894 113.894 117.012 -3.118 18518
9312 1 14 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.881 -0.035 18518
9313 1 14 . 1 1 100 100 GLU C C 100 177.989 177.989 178.576 -0.587 18518
9314 1 14 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.683 0.404 18518
9315 1 14 . 1 1 100 100 GLU CB C 100 29.382 29.382 29.226 0.156 18518
9316 1 14 . 1 1 100 100 GLU H H 100 7.422 7.422 8.159 -0.737 18518
9317 1 14 . 1 1 101 101 SER N N 101 108.991 108.991 114.870 -5.879 18518
9318 1 14 . 1 1 101 101 SER HA H 101 4.524 4.524 4.369 0.155 18518
9319 1 14 . 1 1 101 101 SER C C 101 176.628 176.628 175.374 1.254 18518
9320 1 14 . 1 1 101 101 SER CA C 101 60.349 60.349 60.689 -0.340 18518
9321 1 14 . 1 1 101 101 SER CB C 101 64.741 64.741 63.900 0.841 18518
9322 1 14 . 1 1 101 101 SER H H 101 7.424 7.424 7.830 -0.406 18518
9323 1 14 . 1 1 102 102 GLU N N 102 116.533 116.533 119.181 -2.648 18518
9324 1 14 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.608 0.136 18518
9325 1 14 . 1 1 102 102 GLU C C 102 176.774 176.774 175.528 1.246 18518
9326 1 14 . 1 1 102 102 GLU CA C 102 55.581 55.581 55.180 0.401 18518
9327 1 14 . 1 1 102 102 GLU CB C 102 30.697 30.697 30.314 0.384 18518
9328 1 14 . 1 1 102 102 GLU H H 102 8.487 8.487 7.839 0.648 18518
9329 1 14 . 1 1 103 103 LYS N N 103 118.370 118.370 119.882 -1.512 18518
9330 1 14 . 1 1 103 103 LYS HA H 103 4.178 4.178 3.742 0.436 18518
9331 1 14 . 1 1 103 103 LYS C C 103 175.018 175.018 176.636 -1.618 18518
9332 1 14 . 1 1 103 103 LYS CA C 103 57.329 57.329 56.668 0.661 18518
9333 1 14 . 1 1 103 103 LYS CB C 103 32.186 32.186 31.170 1.016 18518
9334 1 14 . 1 1 103 103 LYS H H 103 7.831 7.831 7.533 0.298 18518
9335 1 14 . 1 1 104 104 ASP N N 104 123.500 123.500 124.442 -0.942 18518
9336 1 14 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.561 0.194 18518
9337 1 14 . 1 1 104 104 ASP C C 104 177.383 177.383 177.762 -0.379 18518
9338 1 14 . 1 1 104 104 ASP CA C 104 53.846 53.846 54.010 -0.164 18518
9339 1 14 . 1 1 104 104 ASP CB C 104 43.411 43.411 42.570 0.841 18518
9340 1 14 . 1 1 104 104 ASP H H 104 9.041 9.041 7.943 1.098 18518
9341 1 14 . 1 1 105 105 GLU N N 105 125.448 125.448 119.021 6.427 18518
9342 1 14 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.083 0.097 18518
9343 1 14 . 1 1 105 105 GLU C C 105 177.519 177.519 176.923 0.596 18518
9344 1 14 . 1 1 105 105 GLU CA C 105 59.529 59.529 59.040 0.489 18518
9345 1 14 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.628 0.416 18518
9346 1 14 . 1 1 105 105 GLU H H 105 8.906 8.906 8.774 0.132 18518
9347 1 14 . 1 1 106 106 ASP N N 106 118.824 118.824 119.156 -0.332 18518
9348 1 14 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.548 -0.369 18518
9349 1 14 . 1 1 106 106 ASP C C 106 176.223 176.223 176.790 -0.567 18518
9350 1 14 . 1 1 106 106 ASP CA C 106 54.756 54.756 54.775 -0.019 18518
9351 1 14 . 1 1 106 106 ASP CB C 106 39.999 39.999 40.899 -0.900 18518
9352 1 14 . 1 1 106 106 ASP H H 106 10.036 10.036 8.347 1.689 18518
9353 1 14 . 1 1 107 107 GLY N N 107 105.866 105.866 106.129 -0.263 18518
9354 1 14 . 1 1 107 107 GLY C C 107 175.136 175.136 174.321 0.815 18518
9355 1 14 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.062 0.160 18518
9356 1 14 . 1 1 107 107 GLY H H 107 8.001 8.001 7.840 0.161 18518
9357 1 14 . 1 1 108 108 PHE N N 108 123.820 123.820 120.164 3.656 18518
9358 1 14 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.463 0.199 18518
9359 1 14 . 1 1 108 108 PHE C C 108 174.899 174.899 174.893 0.006 18518
9360 1 14 . 1 1 108 108 PHE CA C 108 60.238 60.238 58.268 1.970 18518
9361 1 14 . 1 1 108 108 PHE CB C 108 40.365 40.365 39.803 0.562 18518
9362 1 14 . 1 1 108 108 PHE H H 108 9.912 9.912 7.663 2.249 18518
9363 1 14 . 1 1 109 109 LEU N N 109 120.130 120.130 122.199 -2.069 18518
9364 1 14 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.659 0.371 18518
9365 1 14 . 1 1 109 109 LEU C C 109 173.916 173.916 174.839 -0.923 18518
9366 1 14 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.501 -0.077 18518
9367 1 14 . 1 1 109 109 LEU CB C 109 45.203 45.203 43.644 1.559 18518
9368 1 14 . 1 1 109 109 LEU H H 109 7.997 7.997 8.565 -0.568 18518
9369 1 14 . 1 1 110 110 TYR N N 110 126.579 126.579 126.101 0.478 18518
9370 1 14 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.622 0.381 18518
9371 1 14 . 1 1 110 110 TYR C C 110 176.671 176.671 175.024 1.647 18518
9372 1 14 . 1 1 110 110 TYR CA C 110 59.058 59.058 58.330 0.729 18518
9373 1 14 . 1 1 110 110 TYR CB C 110 39.556 39.556 38.615 0.941 18518
9374 1 14 . 1 1 110 110 TYR H H 110 9.377 9.377 8.896 0.481 18518
9375 1 14 . 1 1 111 111 MET N N 111 119.240 119.240 121.770 -2.530 18518
9376 1 14 . 1 1 111 111 MET HA H 111 5.486 5.486 5.296 0.190 18518
9377 1 14 . 1 1 111 111 MET C C 111 175.695 175.695 174.552 1.143 18518
9378 1 14 . 1 1 111 111 MET CA C 111 54.124 54.124 54.700 -0.576 18518
9379 1 14 . 1 1 111 111 MET CB C 111 36.960 36.960 37.624 -0.664 18518
9380 1 14 . 1 1 111 111 MET H H 111 9.658 9.658 9.276 0.382 18518
9381 1 14 . 1 1 112 112 VAL N N 112 119.865 119.865 119.221 0.644 18518
9382 1 14 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.463 0.500 18518
9383 1 14 . 1 1 112 112 VAL C C 112 175.058 175.058 174.505 0.553 18518
9384 1 14 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.625 -0.714 18518
9385 1 14 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.412 0.639 18518
9386 1 14 . 1 1 112 112 VAL H H 112 8.794 8.794 9.088 -0.294 18518
9387 1 14 . 1 1 113 113 TYR N N 113 119.664 119.664 119.918 -0.254 18518
9388 1 14 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.806 0.311 18518
9389 1 14 . 1 1 113 113 TYR C C 113 173.375 173.375 173.341 0.034 18518
9390 1 14 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.354 -1.201 18518
9391 1 14 . 1 1 113 113 TYR CB C 113 43.312 43.312 42.027 1.285 18518
9392 1 14 . 1 1 113 113 TYR H H 113 8.315 8.315 8.548 -0.233 18518
9393 1 14 . 1 1 114 114 ALA N N 114 119.763 119.763 122.970 -3.207 18518
9394 1 14 . 1 1 114 114 ALA HA H 114 4.800 4.800 5.006 -0.206 18518
9395 1 14 . 1 1 114 114 ALA C C 114 176.216 176.216 175.263 0.953 18518
9396 1 14 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.913 -0.782 18518
9397 1 14 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.232 2.364 18518
9398 1 14 . 1 1 114 114 ALA H H 114 8.465 8.465 9.095 -0.630 18518
9399 1 14 . 1 1 115 115 SER N N 115 114.763 114.763 115.958 -1.195 18518
9400 1 14 . 1 1 115 115 SER HA H 115 4.496 4.496 4.881 -0.385 18518
9401 1 14 . 1 1 115 115 SER C C 115 172.671 172.671 173.835 -1.164 18518
9402 1 14 . 1 1 115 115 SER CA C 115 58.651 58.651 57.722 0.929 18518
9403 1 14 . 1 1 115 115 SER CB C 115 63.526 63.526 62.194 1.332 18518
9404 1 14 . 1 1 115 115 SER H H 115 9.915 9.915 9.175 0.740 18518
9405 1 14 . 1 1 116 116 GLN N N 116 116.611 116.611 123.977 -7.366 18518
9406 1 14 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.556 -0.072 18518
9407 1 14 . 1 1 116 116 GLN C C 116 172.733 172.733 174.001 -1.268 18518
9408 1 14 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.985 -2.059 18518
9409 1 14 . 1 1 116 116 GLN CB C 116 32.358 32.358 31.551 0.807 18518
9410 1 14 . 1 1 116 116 GLN H H 116 7.219 7.219 8.238 -1.019 18518
9411 1 14 . 1 1 117 117 GLU N N 117 117.623 117.623 121.102 -3.479 18518
9412 1 14 . 1 1 117 117 GLU HA H 117 3.287 3.287 2.768 0.519 18518
9413 1 14 . 1 1 117 117 GLU C C 117 175.168 175.168 175.640 -0.472 18518
9414 1 14 . 1 1 117 117 GLU CA C 117 56.882 56.882 56.669 0.213 18518
9415 1 14 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.802 0.720 18518
9416 1 14 . 1 1 117 117 GLU H H 117 7.882 7.882 8.635 -0.753 18518
9417 1 14 . 1 1 118 118 THR N N 118 109.820 109.820 109.610 0.210 18518
9418 1 14 . 1 1 118 118 THR HA H 118 4.066 4.066 4.497 -0.431 18518
9419 1 14 . 1 1 118 118 THR C C 118 172.355 172.355 174.121 -1.766 18518
9420 1 14 . 1 1 118 118 THR CA C 118 60.029 60.029 60.966 -0.937 18518
9421 1 14 . 1 1 118 118 THR CB C 118 70.480 70.480 69.764 0.716 18518
9422 1 14 . 1 1 118 118 THR H H 118 6.992 6.992 7.378 -0.386 18518
9423 1 15 . 1 1 2 2 ALA HA H 2 4.336 4.336 5.339 -1.003 18518
9424 1 15 . 1 1 2 2 ALA C C 2 177.974 177.974 176.604 1.370 18518
9425 1 15 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.090 1.696 18518
9426 1 15 . 1 1 2 2 ALA CB C 2 19.444 19.444 20.873 -1.429 18518
9427 1 15 . 1 1 3 3 MET N N 3 119.311 119.311 120.034 -0.723 18518
9428 1 15 . 1 1 3 3 MET HA H 3 4.451 4.451 4.719 -0.268 18518
9429 1 15 . 1 1 3 3 MET C C 3 176.913 176.913 176.045 0.868 18518
9430 1 15 . 1 1 3 3 MET CA C 3 55.679 55.679 55.036 0.643 18518
9431 1 15 . 1 1 3 3 MET CB C 3 32.590 32.590 35.500 -2.910 18518
9432 1 15 . 1 1 3 3 MET H H 3 8.638 8.638 8.585 0.053 18518
9433 1 15 . 1 1 4 4 GLY N N 4 110.281 110.281 110.490 -0.209 18518
9434 1 15 . 1 1 4 4 GLY C C 4 174.180 174.180 173.857 0.323 18518
9435 1 15 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.971 0.524 18518
9436 1 15 . 1 1 4 4 GLY H H 4 8.552 8.552 8.610 -0.058 18518
9437 1 15 . 1 1 5 5 LYS N N 5 120.818 120.818 127.063 -6.245 18518
9438 1 15 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.296 0.213 18518
9439 1 15 . 1 1 5 5 LYS C C 5 177.605 177.605 176.819 0.786 18518
9440 1 15 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.683 0.451 18518
9441 1 15 . 1 1 5 5 LYS CB C 5 34.813 34.813 32.188 2.625 18518
9442 1 15 . 1 1 5 5 LYS H H 5 8.133 8.133 8.230 -0.097 18518
9443 1 15 . 1 1 6 6 THR N N 6 114.781 114.781 121.364 -6.583 18518
9444 1 15 . 1 1 6 6 THR HA H 6 4.421 4.421 4.346 0.075 18518
9445 1 15 . 1 1 6 6 THR C C 6 175.524 175.524 175.540 -0.016 18518
9446 1 15 . 1 1 6 6 THR CA C 6 61.127 61.127 62.145 -1.018 18518
9447 1 15 . 1 1 6 6 THR CB C 6 69.926 69.926 69.920 0.006 18518
9448 1 15 . 1 1 6 6 THR H H 6 8.483 8.483 7.955 0.528 18518
9449 1 15 . 1 1 7 7 PHE N N 7 125.552 125.552 125.005 0.547 18518
9450 1 15 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.111 -0.106 18518
9451 1 15 . 1 1 7 7 PHE C C 7 177.397 177.397 176.601 0.796 18518
9452 1 15 . 1 1 7 7 PHE CA C 7 63.393 63.393 61.488 1.905 18518
9453 1 15 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.756 0.811 18518
9454 1 15 . 1 1 7 7 PHE H H 7 10.245 10.245 9.002 1.243 18518
9455 1 15 . 1 1 8 8 LYS N N 8 114.053 114.053 117.885 -3.832 18518
9456 1 15 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.351 0.484 18518
9457 1 15 . 1 1 8 8 LYS C C 8 175.520 175.520 178.167 -2.647 18518
9458 1 15 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.555 1.438 18518
9459 1 15 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.463 2.226 18518
9460 1 15 . 1 1 8 8 LYS H H 8 8.775 8.775 7.413 1.362 18518
9461 1 15 . 1 1 9 9 GLN N N 9 113.516 113.516 117.533 -4.017 18518
9462 1 15 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.075 0.074 18518
9463 1 15 . 1 1 9 9 GLN C C 9 177.615 177.615 178.047 -0.432 18518
9464 1 15 . 1 1 9 9 GLN CA C 9 56.819 56.819 58.377 -1.558 18518
9465 1 15 . 1 1 9 9 GLN CB C 9 30.019 30.019 29.046 0.973 18518
9466 1 15 . 1 1 9 9 GLN H H 9 7.355 7.355 7.455 -0.100 18518
9467 1 15 . 1 1 10 10 ARG N N 10 118.294 118.294 116.892 1.402 18518
9468 1 15 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.248 0.054 18518
9469 1 15 . 1 1 10 10 ARG C C 10 179.380 179.380 177.187 2.193 18518
9470 1 15 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.304 -0.036 18518
9471 1 15 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.689 0.953 18518
9472 1 15 . 1 1 10 10 ARG H H 10 7.936 7.936 7.814 0.122 18518
9473 1 15 . 1 1 11 11 ARG N N 11 121.137 121.137 120.045 1.092 18518
9474 1 15 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.706 -0.026 18518
9475 1 15 . 1 1 11 11 ARG CA C 11 53.453 53.453 53.782 -0.329 18518
9476 1 15 . 1 1 11 11 ARG CB C 11 32.938 32.938 31.131 1.807 18518
9477 1 15 . 1 1 11 11 ARG H H 11 7.390 7.390 7.860 -0.470 18518
9478 1 15 . 1 1 12 12 THR N N 12 116.819 116.819 119.940 -3.121 18518
9479 1 15 . 1 1 12 12 THR HA H 12 4.359 4.359 4.293 0.066 18518
9480 1 15 . 1 1 12 12 THR C C 12 174.989 174.989 175.924 -0.935 18518
9481 1 15 . 1 1 12 12 THR CA C 12 61.748 61.748 62.715 -0.967 18518
9482 1 15 . 1 1 12 12 THR CB C 12 71.068 71.068 70.125 0.943 18518
9483 1 15 . 1 1 12 12 THR H H 12 8.953 8.953 8.753 0.200 18518
9484 1 15 . 1 1 13 13 PHE N N 13 123.200 123.200 123.608 -0.408 18518
9485 1 15 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.177 -0.149 18518
9486 1 15 . 1 1 13 13 PHE C C 13 176.029 176.029 176.967 -0.938 18518
9487 1 15 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.759 0.105 18518
9488 1 15 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.352 0.207 18518
9489 1 15 . 1 1 13 13 PHE H H 13 9.284 9.284 8.989 0.295 18518
9490 1 15 . 1 1 14 14 GLU N N 14 115.414 115.414 117.573 -2.159 18518
9491 1 15 . 1 1 14 14 GLU HA H 14 3.794 3.794 3.984 -0.190 18518
9492 1 15 . 1 1 14 14 GLU C C 14 180.081 180.081 178.969 1.112 18518
9493 1 15 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.555 1.064 18518
9494 1 15 . 1 1 14 14 GLU CB C 14 28.852 28.852 29.084 -0.232 18518
9495 1 15 . 1 1 14 14 GLU H H 14 8.973 8.973 8.843 0.130 18518
9496 1 15 . 1 1 15 15 GLN N N 15 119.276 119.276 118.650 0.626 18518
9497 1 15 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.146 -0.146 18518
9498 1 15 . 1 1 15 15 GLN C C 15 177.978 177.978 178.280 -0.302 18518
9499 1 15 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.402 0.433 18518
9500 1 15 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.074 1.296 18518
9501 1 15 . 1 1 15 15 GLN H H 15 7.756 7.756 7.650 0.106 18518
9502 1 15 . 1 1 16 16 ARG N N 16 121.336 121.336 120.799 0.537 18518
9503 1 15 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.329 -0.059 18518
9504 1 15 . 1 1 16 16 ARG C C 16 177.416 177.416 178.883 -1.467 18518
9505 1 15 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.913 1.462 18518
9506 1 15 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.349 0.256 18518
9507 1 15 . 1 1 16 16 ARG H H 16 8.645 8.645 8.072 0.573 18518
9508 1 15 . 1 1 17 17 VAL N N 17 117.630 117.630 119.954 -2.324 18518
9509 1 15 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.587 0.270 18518
9510 1 15 . 1 1 17 17 VAL C C 17 179.748 179.748 178.039 1.709 18518
9511 1 15 . 1 1 17 17 VAL CA C 17 65.726 65.726 66.831 -1.105 18518
9512 1 15 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.546 0.648 18518
9513 1 15 . 1 1 17 17 VAL H H 17 8.373 8.373 8.023 0.350 18518
9514 1 15 . 1 1 18 18 GLU N N 18 120.864 120.864 119.942 0.922 18518
9515 1 15 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.929 0.373 18518
9516 1 15 . 1 1 18 18 GLU C C 18 177.728 177.728 178.642 -0.914 18518
9517 1 15 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.915 -1.429 18518
9518 1 15 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.477 -0.095 18518
9519 1 15 . 1 1 18 18 GLU H H 18 7.368 7.368 7.937 -0.569 18518
9520 1 15 . 1 1 19 19 ASP N N 19 121.425 121.425 120.563 0.862 18518
9521 1 15 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.390 0.044 18518
9522 1 15 . 1 1 19 19 ASP C C 19 179.978 179.978 178.961 1.017 18518
9523 1 15 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.470 -0.048 18518
9524 1 15 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.629 0.658 18518
9525 1 15 . 1 1 19 19 ASP H H 19 8.671 8.671 8.533 0.138 18518
9526 1 15 . 1 1 20 20 VAL N N 20 119.730 119.730 120.104 -0.374 18518
9527 1 15 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.415 -0.210 18518
9528 1 15 . 1 1 20 20 VAL C C 20 176.284 176.284 177.063 -0.779 18518
9529 1 15 . 1 1 20 20 VAL CA C 20 66.315 66.315 65.583 0.732 18518
9530 1 15 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.170 -0.063 18518
9531 1 15 . 1 1 20 20 VAL H H 20 7.999 7.999 7.967 0.032 18518
9532 1 15 . 1 1 21 21 ARG N N 21 121.455 121.455 119.978 1.477 18518
9533 1 15 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.925 -0.111 18518
9534 1 15 . 1 1 21 21 ARG C C 21 180.120 180.120 178.631 1.489 18518
9535 1 15 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.921 0.909 18518
9536 1 15 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.166 0.780 18518
9537 1 15 . 1 1 21 21 ARG H H 21 8.098 8.098 7.972 0.126 18518
9538 1 15 . 1 1 22 22 LEU N N 22 117.826 117.826 121.657 -3.831 18518
9539 1 15 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.038 0.011 18518
9540 1 15 . 1 1 22 22 LEU C C 22 180.115 180.115 178.454 1.661 18518
9541 1 15 . 1 1 22 22 LEU CA C 22 57.790 57.790 57.968 -0.178 18518
9542 1 15 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.458 0.684 18518
9543 1 15 . 1 1 22 22 LEU H H 22 8.207 8.207 8.322 -0.115 18518
9544 1 15 . 1 1 23 23 ILE N N 23 121.450 121.450 119.530 1.920 18518
9545 1 15 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.715 0.298 18518
9546 1 15 . 1 1 23 23 ILE C C 23 178.149 178.149 178.055 0.094 18518
9547 1 15 . 1 1 23 23 ILE CA C 23 62.171 62.171 63.597 -1.426 18518
9548 1 15 . 1 1 23 23 ILE CB C 23 38.106 38.106 37.099 1.007 18518
9549 1 15 . 1 1 23 23 ILE H H 23 8.105 8.105 7.945 0.160 18518
9550 1 15 . 1 1 24 24 ARG N N 24 121.139 121.139 118.653 2.486 18518
9551 1 15 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.049 -0.062 18518
9552 1 15 . 1 1 24 24 ARG C C 24 178.702 178.702 179.007 -0.305 18518
9553 1 15 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.837 -1.119 18518
9554 1 15 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.677 -0.908 18518
9555 1 15 . 1 1 24 24 ARG H H 24 8.601 8.601 8.164 0.437 18518
9556 1 15 . 1 1 25 25 GLU N N 25 118.054 118.054 119.182 -1.128 18518
9557 1 15 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.140 -0.114 18518
9558 1 15 . 1 1 25 25 GLU C C 25 178.492 178.492 178.120 0.372 18518
9559 1 15 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.390 0.390 18518
9560 1 15 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.481 0.520 18518
9561 1 15 . 1 1 25 25 GLU H H 25 7.423 7.423 7.800 -0.377 18518
9562 1 15 . 1 1 26 26 GLN N N 26 116.350 116.350 116.982 -0.632 18518
9563 1 15 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.012 -0.076 18518
9564 1 15 . 1 1 26 26 GLN C C 26 176.305 176.305 176.793 -0.488 18518
9565 1 15 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.412 0.091 18518
9566 1 15 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.266 0.941 18518
9567 1 15 . 1 1 26 26 GLN H H 26 7.524 7.524 7.727 -0.203 18518
9568 1 15 . 1 1 27 27 HIS N N 27 116.017 116.017 118.241 -2.224 18518
9569 1 15 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.161 -0.231 18518
9570 1 15 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.688 0.366 18518
9571 1 15 . 1 1 27 27 HIS CB C 27 30.747 30.747 30.719 0.028 18518
9572 1 15 . 1 1 27 27 HIS H H 27 8.284 8.284 8.237 0.047 18518
9573 1 15 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.613 -0.032 18518
9574 1 15 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.237 0.682 18518
9575 1 15 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.066 0.389 18518
9576 1 15 . 1 1 29 29 THR N N 29 107.011 107.011 106.665 0.346 18518
9577 1 15 . 1 1 29 29 THR HA H 29 4.599 4.599 4.650 -0.051 18518
9578 1 15 . 1 1 29 29 THR C C 29 172.884 172.884 173.970 -1.086 18518
9579 1 15 . 1 1 29 29 THR CA C 29 60.810 60.810 61.328 -0.518 18518
9580 1 15 . 1 1 29 29 THR CB C 29 68.531 68.531 69.051 -0.520 18518
9581 1 15 . 1 1 29 29 THR H H 29 7.890 7.890 8.230 -0.340 18518
9582 1 15 . 1 1 30 30 LYS N N 30 117.679 117.679 121.822 -4.143 18518
9583 1 15 . 1 1 30 30 LYS HA H 30 4.858 4.858 5.053 -0.195 18518
9584 1 15 . 1 1 30 30 LYS C C 30 174.310 174.310 175.054 -0.744 18518
9585 1 15 . 1 1 30 30 LYS CA C 30 53.751 53.751 54.026 -0.276 18518
9586 1 15 . 1 1 30 30 LYS CB C 30 35.804 35.804 35.889 -0.085 18518
9587 1 15 . 1 1 30 30 LYS H H 30 7.441 7.441 7.778 -0.337 18518
9588 1 15 . 1 1 31 31 ILE N N 31 122.849 122.849 123.657 -0.808 18518
9589 1 15 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.349 -0.244 18518
9590 1 15 . 1 1 31 31 ILE CA C 31 54.801 54.801 58.210 -3.409 18518
9591 1 15 . 1 1 31 31 ILE CB C 31 38.265 38.265 39.417 -1.152 18518
9592 1 15 . 1 1 31 31 ILE H H 31 9.304 9.304 9.046 0.258 18518
9593 1 15 . 1 1 32 32 PRO HA H 32 5.159 5.159 5.059 0.100 18518
9594 1 15 . 1 1 32 32 PRO C C 32 174.164 174.164 176.454 -2.290 18518
9595 1 15 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.280 -0.777 18518
9596 1 15 . 1 1 32 32 PRO CB C 32 31.145 31.145 30.568 0.577 18518
9597 1 15 . 1 1 33 33 VAL N N 33 125.606 125.606 120.063 5.543 18518
9598 1 15 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.207 0.006 18518
9599 1 15 . 1 1 33 33 VAL C C 33 173.654 173.654 174.192 -0.538 18518
9600 1 15 . 1 1 33 33 VAL CA C 33 60.044 60.044 58.985 1.059 18518
9601 1 15 . 1 1 33 33 VAL CB C 33 35.604 35.604 35.298 0.306 18518
9602 1 15 . 1 1 33 33 VAL H H 33 9.424 9.424 8.730 0.694 18518
9603 1 15 . 1 1 34 34 ILE N N 34 128.241 128.241 125.706 2.535 18518
9604 1 15 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.693 0.140 18518
9605 1 15 . 1 1 34 34 ILE C C 34 175.605 175.605 174.974 0.631 18518
9606 1 15 . 1 1 34 34 ILE CA C 34 56.765 56.765 57.946 -1.181 18518
9607 1 15 . 1 1 34 34 ILE CB C 34 36.799 36.799 37.038 -0.239 18518
9608 1 15 . 1 1 34 34 ILE H H 34 8.721 8.721 9.033 -0.312 18518
9609 1 15 . 1 1 35 35 ILE N N 35 125.650 125.650 128.807 -3.157 18518
9610 1 15 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.596 0.240 18518
9611 1 15 . 1 1 35 35 ILE C C 35 174.887 174.887 174.768 0.119 18518
9612 1 15 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.507 0.438 18518
9613 1 15 . 1 1 35 35 ILE CB C 35 39.210 39.210 39.356 -0.146 18518
9614 1 15 . 1 1 35 35 ILE H H 35 9.034 9.034 8.819 0.215 18518
9615 1 15 . 1 1 36 36 GLU N N 36 122.657 122.657 126.873 -4.216 18518
9616 1 15 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.905 -0.044 18518
9617 1 15 . 1 1 36 36 GLU C C 36 173.848 173.848 174.845 -0.997 18518
9618 1 15 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.186 -0.254 18518
9619 1 15 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.350 0.932 18518
9620 1 15 . 1 1 36 36 GLU H H 36 8.303 8.303 8.529 -0.226 18518
9621 1 15 . 1 1 37 37 ARG N N 37 123.228 123.228 127.149 -3.921 18518
9622 1 15 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.822 -1.096 18518
9623 1 15 . 1 1 37 37 ARG C C 37 176.359 176.359 175.519 0.840 18518
9624 1 15 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.566 -0.207 18518
9625 1 15 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.607 0.734 18518
9626 1 15 . 1 1 37 37 ARG H H 37 8.856 8.856 8.787 0.069 18518
9627 1 15 . 1 1 38 38 TYR N N 38 128.981 128.981 127.664 1.317 18518
9628 1 15 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.345 0.007 18518
9629 1 15 . 1 1 38 38 TYR C C 38 177.316 177.316 176.644 0.672 18518
9630 1 15 . 1 1 38 38 TYR CA C 38 57.712 57.712 58.139 -0.427 18518
9631 1 15 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.301 -0.829 18518
9632 1 15 . 1 1 38 38 TYR H H 38 8.628 8.628 8.315 0.313 18518
9633 1 15 . 1 1 39 39 LYS N N 39 130.635 130.635 124.069 6.566 18518
9634 1 15 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.861 -0.039 18518
9635 1 15 . 1 1 39 39 LYS CA C 39 58.887 58.887 58.172 0.715 18518
9636 1 15 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.895 -0.124 18518
9637 1 15 . 1 1 39 39 LYS H H 39 8.594 8.594 7.666 0.928 18518
9638 1 15 . 1 1 40 40 GLY C C 40 173.447 173.447 173.361 0.086 18518
9639 1 15 . 1 1 40 40 GLY CA C 40 44.663 44.663 44.254 0.409 18518
9640 1 15 . 1 1 40 40 GLY H H 40 5.188 5.188 6.742 -1.554 18518
9641 1 15 . 1 1 41 41 GLU N N 41 122.836 122.836 120.802 2.034 18518
9642 1 15 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.228 0.029 18518
9643 1 15 . 1 1 41 41 GLU C C 41 176.524 176.524 175.817 0.707 18518
9644 1 15 . 1 1 41 41 GLU CA C 41 56.525 56.525 57.003 -0.478 18518
9645 1 15 . 1 1 41 41 GLU CB C 41 30.985 30.985 29.041 1.944 18518
9646 1 15 . 1 1 41 41 GLU H H 41 7.380 7.380 7.306 0.074 18518
9647 1 15 . 1 1 42 42 LYS N N 42 124.040 124.040 124.570 -0.530 18518
9648 1 15 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.470 0.205 18518
9649 1 15 . 1 1 42 42 LYS C C 42 177.538 177.538 176.707 0.831 18518
9650 1 15 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.532 -0.692 18518
9651 1 15 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.001 1.978 18518
9652 1 15 . 1 1 42 42 LYS H H 42 9.034 9.034 8.470 0.564 18518
9653 1 15 . 1 1 43 43 GLN N N 43 119.259 119.259 118.738 0.521 18518
9654 1 15 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.410 0.132 18518
9655 1 15 . 1 1 43 43 GLN C C 43 177.336 177.336 175.981 1.355 18518
9656 1 15 . 1 1 43 43 GLN CA C 43 57.673 57.673 56.310 1.363 18518
9657 1 15 . 1 1 43 43 GLN CB C 43 30.782 30.782 29.015 1.767 18518
9658 1 15 . 1 1 43 43 GLN H H 43 8.435 8.435 8.411 0.024 18518
9659 1 15 . 1 1 44 44 LEU N N 44 120.760 120.760 123.220 -2.460 18518
9660 1 15 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.709 -0.014 18518
9661 1 15 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.002 1.243 18518
9662 1 15 . 1 1 44 44 LEU CB C 44 43.596 43.596 42.199 1.397 18518
9663 1 15 . 1 1 44 44 LEU H H 44 9.126 9.126 7.661 1.465 18518
9664 1 15 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.601 0.116 18518
9665 1 15 . 1 1 45 45 PRO C C 45 175.797 175.797 176.098 -0.301 18518
9666 1 15 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.361 -0.250 18518
9667 1 15 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.230 0.362 18518
9668 1 15 . 1 1 46 46 VAL N N 46 119.052 119.052 121.148 -2.096 18518
9669 1 15 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.585 -0.718 18518
9670 1 15 . 1 1 46 46 VAL C C 46 175.640 175.640 177.122 -1.482 18518
9671 1 15 . 1 1 46 46 VAL CA C 46 62.944 62.944 61.830 1.114 18518
9672 1 15 . 1 1 46 46 VAL CB C 46 32.799 32.799 32.244 0.555 18518
9673 1 15 . 1 1 46 46 VAL H H 46 8.543 8.543 8.330 0.213 18518
9674 1 15 . 1 1 47 47 LEU N N 47 130.203 130.203 127.350 2.853 18518
9675 1 15 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.248 0.061 18518
9676 1 15 . 1 1 47 47 LEU C C 47 176.198 176.198 177.654 -1.456 18518
9677 1 15 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.229 -0.223 18518
9678 1 15 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.658 1.174 18518
9679 1 15 . 1 1 47 47 LEU H H 47 7.799 7.799 8.460 -0.661 18518
9680 1 15 . 1 1 48 48 ASP N N 48 122.403 122.403 123.710 -1.307 18518
9681 1 15 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.513 -0.250 18518
9682 1 15 . 1 1 48 48 ASP C C 48 175.294 175.294 175.650 -0.356 18518
9683 1 15 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.615 0.217 18518
9684 1 15 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.361 -1.177 18518
9685 1 15 . 1 1 48 48 ASP H H 48 8.780 8.780 8.621 0.159 18518
9686 1 15 . 1 1 49 49 LYS N N 49 119.569 119.569 115.989 3.580 18518
9687 1 15 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.455 0.130 18518
9688 1 15 . 1 1 49 49 LYS C C 49 174.678 174.678 175.202 -0.524 18518
9689 1 15 . 1 1 49 49 LYS CA C 49 53.652 53.652 54.788 -1.136 18518
9690 1 15 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.026 1.919 18518
9691 1 15 . 1 1 49 49 LYS H H 49 7.280 7.280 7.530 -0.250 18518
9692 1 15 . 1 1 50 50 THR N N 50 110.862 110.862 114.200 -3.338 18518
9693 1 15 . 1 1 50 50 THR HA H 50 4.811 4.811 4.727 0.084 18518
9694 1 15 . 1 1 50 50 THR C C 50 172.425 172.425 173.957 -1.532 18518
9695 1 15 . 1 1 50 50 THR CA C 50 62.645 62.645 62.735 -0.090 18518
9696 1 15 . 1 1 50 50 THR CB C 50 71.648 71.648 70.363 1.285 18518
9697 1 15 . 1 1 50 50 THR H H 50 8.042 8.042 8.142 -0.100 18518
9698 1 15 . 1 1 51 51 LYS N N 51 120.008 120.008 121.679 -1.671 18518
9699 1 15 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.447 0.178 18518
9700 1 15 . 1 1 51 51 LYS C C 51 175.082 175.082 175.816 -0.734 18518
9701 1 15 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.119 -1.415 18518
9702 1 15 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.055 -0.679 18518
9703 1 15 . 1 1 51 51 LYS H H 51 7.119 7.119 7.306 -0.187 18518
9704 1 15 . 1 1 52 52 PHE N N 52 122.640 122.640 123.542 -0.902 18518
9705 1 15 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.729 0.608 18518
9706 1 15 . 1 1 52 52 PHE C C 52 174.213 174.213 174.316 -0.103 18518
9707 1 15 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.660 -0.049 18518
9708 1 15 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.336 -0.196 18518
9709 1 15 . 1 1 52 52 PHE H H 52 9.709 9.709 9.182 0.527 18518
9710 1 15 . 1 1 53 53 LEU N N 53 122.157 122.157 122.418 -0.261 18518
9711 1 15 . 1 1 53 53 LEU HA H 53 4.947 4.947 5.061 -0.114 18518
9712 1 15 . 1 1 53 53 LEU C C 53 175.769 175.769 175.852 -0.083 18518
9713 1 15 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.768 -0.811 18518
9714 1 15 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.739 0.676 18518
9715 1 15 . 1 1 53 53 LEU H H 53 8.959 8.959 8.432 0.527 18518
9716 1 15 . 1 1 54 54 VAL N N 54 124.919 124.919 125.061 -0.142 18518
9717 1 15 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.556 0.003 18518
9718 1 15 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.461 0.669 18518
9719 1 15 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.463 1.505 18518
9720 1 15 . 1 1 54 54 VAL H H 54 8.922 8.922 8.774 0.148 18518
9721 1 15 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.735 -0.294 18518
9722 1 15 . 1 1 55 55 PRO C C 55 176.594 176.594 177.822 -1.228 18518
9723 1 15 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.077 2.239 18518
9724 1 15 . 1 1 55 55 PRO CB C 55 32.665 32.665 31.453 1.212 18518
9725 1 15 . 1 1 56 56 ASP N N 56 120.522 120.522 122.540 -2.018 18518
9726 1 15 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.257 -0.395 18518
9727 1 15 . 1 1 56 56 ASP C C 56 175.809 175.809 176.412 -0.603 18518
9728 1 15 . 1 1 56 56 ASP CA C 56 56.749 56.749 56.085 0.664 18518
9729 1 15 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.479 0.031 18518
9730 1 15 . 1 1 56 56 ASP H H 56 8.347 8.347 8.637 -0.290 18518
9731 1 15 . 1 1 57 57 HIS N N 57 113.482 113.482 113.372 0.110 18518
9732 1 15 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.814 -0.094 18518
9733 1 15 . 1 1 57 57 HIS C C 57 176.507 176.507 175.439 1.068 18518
9734 1 15 . 1 1 57 57 HIS CA C 57 55.589 55.589 55.394 0.195 18518
9735 1 15 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.981 0.662 18518
9736 1 15 . 1 1 57 57 HIS H H 57 7.557 7.557 7.579 -0.022 18518
9737 1 15 . 1 1 58 58 VAL N N 58 123.279 123.279 121.492 1.787 18518
9738 1 15 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.172 -0.336 18518
9739 1 15 . 1 1 58 58 VAL C C 58 175.019 175.019 174.280 0.739 18518
9740 1 15 . 1 1 58 58 VAL CA C 58 62.823 62.823 59.893 2.930 18518
9741 1 15 . 1 1 58 58 VAL CB C 58 32.310 32.310 34.587 -2.277 18518
9742 1 15 . 1 1 58 58 VAL H H 58 7.345 7.345 7.548 -0.203 18518
9743 1 15 . 1 1 59 59 ASN N N 59 123.781 123.781 121.401 2.380 18518
9744 1 15 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.055 0.071 18518
9745 1 15 . 1 1 59 59 ASN C C 59 176.558 176.558 176.311 0.247 18518
9746 1 15 . 1 1 59 59 ASN CA C 59 51.485 51.485 52.051 -0.566 18518
9747 1 15 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.356 -0.249 18518
9748 1 15 . 1 1 59 59 ASN H H 59 8.735 8.735 8.280 0.455 18518
9749 1 15 . 1 1 60 60 MET N N 60 117.453 117.453 119.043 -1.590 18518
9750 1 15 . 1 1 60 60 MET HA H 60 4.395 4.395 4.028 0.367 18518
9751 1 15 . 1 1 60 60 MET C C 60 178.144 178.144 178.177 -0.033 18518
9752 1 15 . 1 1 60 60 MET CA C 60 57.097 57.097 59.763 -2.666 18518
9753 1 15 . 1 1 60 60 MET CB C 60 30.140 30.140 32.173 -2.033 18518
9754 1 15 . 1 1 60 60 MET H H 60 8.227 8.227 8.632 -0.405 18518
9755 1 15 . 1 1 61 61 SER N N 61 114.216 114.216 116.210 -1.994 18518
9756 1 15 . 1 1 61 61 SER HA H 61 4.111 4.111 4.043 0.068 18518
9757 1 15 . 1 1 61 61 SER C C 61 177.335 177.335 176.889 0.446 18518
9758 1 15 . 1 1 61 61 SER CA C 61 61.590 61.590 61.769 -0.179 18518
9759 1 15 . 1 1 61 61 SER CB C 61 62.402 62.402 62.608 -0.206 18518
9760 1 15 . 1 1 61 61 SER H H 61 8.464 8.464 8.416 0.048 18518
9761 1 15 . 1 1 62 62 GLU N N 62 123.004 123.004 121.006 1.998 18518
9762 1 15 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.135 -0.088 18518
9763 1 15 . 1 1 62 62 GLU C C 62 178.686 178.686 178.766 -0.080 18518
9764 1 15 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.755 -0.130 18518
9765 1 15 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.415 0.239 18518
9766 1 15 . 1 1 62 62 GLU H H 62 7.994 7.994 7.627 0.367 18518
9767 1 15 . 1 1 63 63 LEU N N 63 120.818 120.818 121.987 -1.169 18518
9768 1 15 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.998 -0.033 18518
9769 1 15 . 1 1 63 63 LEU C C 63 178.046 178.046 178.600 -0.554 18518
9770 1 15 . 1 1 63 63 LEU CA C 63 57.920 57.920 58.053 -0.133 18518
9771 1 15 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.331 0.293 18518
9772 1 15 . 1 1 63 63 LEU H H 63 8.130 8.130 7.783 0.347 18518
9773 1 15 . 1 1 64 64 ILE N N 64 118.528 118.528 119.487 -0.959 18518
9774 1 15 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.454 -0.085 18518
9775 1 15 . 1 1 64 64 ILE C C 64 177.127 177.127 177.913 -0.786 18518
9776 1 15 . 1 1 64 64 ILE CA C 64 66.678 66.678 66.026 0.652 18518
9777 1 15 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.418 1.026 18518
9778 1 15 . 1 1 64 64 ILE H H 64 8.488 8.488 8.546 -0.058 18518
9779 1 15 . 1 1 65 65 LYS N N 65 118.336 118.336 120.526 -2.190 18518
9780 1 15 . 1 1 65 65 LYS HA H 65 3.701 3.701 3.961 -0.260 18518
9781 1 15 . 1 1 65 65 LYS C C 65 179.291 179.291 179.181 0.110 18518
9782 1 15 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.947 0.493 18518
9783 1 15 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.340 0.031 18518
9784 1 15 . 1 1 65 65 LYS H H 65 7.347 7.347 7.766 -0.419 18518
9785 1 15 . 1 1 66 66 ILE N N 66 120.171 120.171 120.271 -0.100 18518
9786 1 15 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.665 -0.087 18518
9787 1 15 . 1 1 66 66 ILE C C 66 178.873 178.873 178.173 0.700 18518
9788 1 15 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.525 -0.365 18518
9789 1 15 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.991 0.642 18518
9790 1 15 . 1 1 66 66 ILE H H 66 7.901 7.901 8.251 -0.350 18518
9791 1 15 . 1 1 67 67 ILE N N 67 121.185 121.185 120.392 0.793 18518
9792 1 15 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.562 -0.116 18518
9793 1 15 . 1 1 67 67 ILE C C 67 177.150 177.150 177.928 -0.778 18518
9794 1 15 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.548 -1.742 18518
9795 1 15 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.321 -2.326 18518
9796 1 15 . 1 1 67 67 ILE H H 67 8.290 8.290 8.245 0.045 18518
9797 1 15 . 1 1 68 68 ARG N N 68 119.173 119.173 118.949 0.224 18518
9798 1 15 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.802 -0.871 18518
9799 1 15 . 1 1 68 68 ARG C C 68 178.496 178.496 178.692 -0.196 18518
9800 1 15 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.711 0.925 18518
9801 1 15 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.722 0.718 18518
9802 1 15 . 1 1 68 68 ARG H H 68 8.438 8.438 8.432 0.006 18518
9803 1 15 . 1 1 69 69 ARG N N 69 116.511 116.511 120.279 -3.768 18518
9804 1 15 . 1 1 69 69 ARG HA H 69 4.134 4.134 4.006 0.128 18518
9805 1 15 . 1 1 69 69 ARG C C 69 180.262 180.262 179.097 1.165 18518
9806 1 15 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.584 -0.877 18518
9807 1 15 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.099 -0.146 18518
9808 1 15 . 1 1 69 69 ARG H H 69 7.497 7.497 8.337 -0.840 18518
9809 1 15 . 1 1 70 70 ARG N N 70 123.297 123.297 119.639 3.658 18518
9810 1 15 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.090 -0.074 18518
9811 1 15 . 1 1 70 70 ARG C C 70 178.700 178.700 178.292 0.408 18518
9812 1 15 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.704 0.756 18518
9813 1 15 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.606 0.706 18518
9814 1 15 . 1 1 70 70 ARG H H 70 8.075 8.075 7.881 0.194 18518
9815 1 15 . 1 1 71 71 LEU N N 71 116.829 116.829 118.811 -1.982 18518
9816 1 15 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.251 -0.186 18518
9817 1 15 . 1 1 71 71 LEU C C 71 174.956 174.956 175.883 -0.927 18518
9818 1 15 . 1 1 71 71 LEU CA C 71 55.126 55.126 55.054 0.072 18518
9819 1 15 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.399 0.847 18518
9820 1 15 . 1 1 71 71 LEU H H 71 7.719 7.719 7.905 -0.186 18518
9821 1 15 . 1 1 72 72 GLN N N 72 114.991 114.991 114.805 0.186 18518
9822 1 15 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.937 -0.101 18518
9823 1 15 . 1 1 72 72 GLN C C 72 175.683 175.683 175.325 0.358 18518
9824 1 15 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.387 -0.062 18518
9825 1 15 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.686 0.319 18518
9826 1 15 . 1 1 72 72 GLN H H 72 7.744 7.744 7.506 0.238 18518
9827 1 15 . 1 1 73 73 LEU N N 73 115.045 115.045 119.493 -4.448 18518
9828 1 15 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.044 0.192 18518
9829 1 15 . 1 1 73 73 LEU C C 73 178.762 178.762 177.129 1.633 18518
9830 1 15 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.354 -0.968 18518
9831 1 15 . 1 1 73 73 LEU CB C 73 42.091 42.091 42.004 0.087 18518
9832 1 15 . 1 1 73 73 LEU H H 73 7.500 7.500 7.977 -0.477 18518
9833 1 15 . 1 1 74 74 ASN N N 74 121.700 121.700 122.355 -0.655 18518
9834 1 15 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.560 0.130 18518
9835 1 15 . 1 1 74 74 ASN C C 74 176.617 176.617 175.741 0.876 18518
9836 1 15 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.600 -0.915 18518
9837 1 15 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.682 -0.084 18518
9838 1 15 . 1 1 74 74 ASN H H 74 9.045 9.045 8.557 0.488 18518
9839 1 15 . 1 1 75 75 ALA N N 75 123.952 123.952 121.338 2.614 18518
9840 1 15 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.323 -0.359 18518
9841 1 15 . 1 1 75 75 ALA C C 75 178.131 178.131 177.599 0.532 18518
9842 1 15 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.525 1.343 18518
9843 1 15 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.719 -1.001 18518
9844 1 15 . 1 1 75 75 ALA H H 75 8.784 8.784 8.419 0.365 18518
9845 1 15 . 1 1 76 76 ASN N N 76 112.295 112.295 116.018 -3.723 18518
9846 1 15 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.553 0.027 18518
9847 1 15 . 1 1 76 76 ASN C C 76 175.448 175.448 175.524 -0.076 18518
9848 1 15 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.970 -0.756 18518
9849 1 15 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.758 -0.438 18518
9850 1 15 . 1 1 76 76 ASN H H 76 8.391 8.391 8.262 0.129 18518
9851 1 15 . 1 1 77 77 GLN N N 77 120.577 120.577 118.374 2.203 18518
9852 1 15 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.619 -0.346 18518
9853 1 15 . 1 1 77 77 GLN C C 77 175.045 175.045 174.124 0.921 18518
9854 1 15 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.813 0.992 18518
9855 1 15 . 1 1 77 77 GLN CB C 77 30.157 30.157 30.395 -0.239 18518
9856 1 15 . 1 1 77 77 GLN H H 77 7.552 7.552 7.464 0.088 18518
9857 1 15 . 1 1 78 78 ALA N N 78 130.670 130.670 123.659 7.011 18518
9858 1 15 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.619 -0.448 18518
9859 1 15 . 1 1 78 78 ALA C C 78 176.512 176.512 175.276 1.236 18518
9860 1 15 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.166 1.677 18518
9861 1 15 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.647 -1.587 18518
9862 1 15 . 1 1 78 78 ALA H H 78 8.799 8.799 8.801 -0.002 18518
9863 1 15 . 1 1 79 79 PHE N N 79 119.325 119.325 117.385 1.940 18518
9864 1 15 . 1 1 79 79 PHE HA H 79 4.434 4.434 5.498 -1.064 18518
9865 1 15 . 1 1 79 79 PHE C C 79 171.726 171.726 172.844 -1.118 18518
9866 1 15 . 1 1 79 79 PHE CA C 79 59.145 59.145 54.219 4.926 18518
9867 1 15 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.879 0.292 18518
9868 1 15 . 1 1 79 79 PHE H H 79 7.664 7.664 8.311 -0.647 18518
9869 1 15 . 1 1 80 80 PHE N N 80 126.314 126.314 118.020 8.294 18518
9870 1 15 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.838 -0.446 18518
9871 1 15 . 1 1 80 80 PHE C C 80 177.169 177.169 173.278 3.891 18518
9872 1 15 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.327 0.326 18518
9873 1 15 . 1 1 80 80 PHE CB C 80 41.933 41.933 42.847 -0.914 18518
9874 1 15 . 1 1 80 80 PHE H H 80 8.508 8.508 9.137 -0.629 18518
9875 1 15 . 1 1 81 81 LEU N N 81 121.426 121.426 121.898 -0.472 18518
9876 1 15 . 1 1 81 81 LEU HA H 81 4.851 4.851 4.876 -0.025 18518
9877 1 15 . 1 1 81 81 LEU C C 81 174.488 174.488 175.046 -0.558 18518
9878 1 15 . 1 1 81 81 LEU CA C 81 53.197 53.197 53.707 -0.510 18518
9879 1 15 . 1 1 81 81 LEU CB C 81 45.100 45.100 44.246 0.854 18518
9880 1 15 . 1 1 81 81 LEU H H 81 8.229 8.229 8.665 -0.436 18518
9881 1 15 . 1 1 82 82 LEU N N 82 125.155 125.155 128.938 -3.783 18518
9882 1 15 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.588 0.245 18518
9883 1 15 . 1 1 82 82 LEU C C 82 177.166 177.166 175.338 1.828 18518
9884 1 15 . 1 1 82 82 LEU CA C 82 54.197 54.197 54.231 -0.034 18518
9885 1 15 . 1 1 82 82 LEU CB C 82 43.442 43.442 43.541 -0.099 18518
9886 1 15 . 1 1 82 82 LEU H H 82 9.400 9.400 9.293 0.107 18518
9887 1 15 . 1 1 83 83 VAL N N 83 123.886 123.886 124.374 -0.488 18518
9888 1 15 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.205 0.174 18518
9889 1 15 . 1 1 83 83 VAL C C 83 175.810 175.810 176.784 -0.974 18518
9890 1 15 . 1 1 83 83 VAL CA C 83 61.677 61.677 62.332 -0.655 18518
9891 1 15 . 1 1 83 83 VAL CB C 83 33.758 33.758 31.445 2.313 18518
9892 1 15 . 1 1 83 83 VAL H H 83 8.721 8.721 8.734 -0.013 18518
9893 1 15 . 1 1 84 84 ASN N N 84 126.474 126.474 126.713 -0.239 18518
9894 1 15 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.578 -0.182 18518
9895 1 15 . 1 1 84 84 ASN C C 84 175.164 175.164 174.922 0.242 18518
9896 1 15 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.923 -0.185 18518
9897 1 15 . 1 1 84 84 ASN CB C 84 37.950 37.950 37.877 0.073 18518
9898 1 15 . 1 1 84 84 ASN H H 84 9.707 9.707 9.621 0.086 18518
9899 1 15 . 1 1 85 85 GLY N N 85 101.296 101.296 103.976 -2.680 18518
9900 1 15 . 1 1 85 85 GLY C C 85 173.680 173.680 173.070 0.610 18518
9901 1 15 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.675 0.929 18518
9902 1 15 . 1 1 85 85 GLY H H 85 8.644 8.644 8.209 0.435 18518
9903 1 15 . 1 1 86 86 HIS N N 86 117.238 117.238 119.244 -2.006 18518
9904 1 15 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.644 0.373 18518
9905 1 15 . 1 1 86 86 HIS C C 86 173.841 173.841 173.852 -0.011 18518
9906 1 15 . 1 1 86 86 HIS CA C 86 53.796 53.796 54.296 -0.500 18518
9907 1 15 . 1 1 86 86 HIS CB C 86 31.280 31.280 31.883 -0.603 18518
9908 1 15 . 1 1 86 86 HIS H H 86 7.918 7.918 8.250 -0.332 18518
9909 1 15 . 1 1 87 87 SER N N 87 118.179 118.179 119.499 -1.320 18518
9910 1 15 . 1 1 87 87 SER HA H 87 4.699 4.699 4.654 0.045 18518
9911 1 15 . 1 1 87 87 SER C C 87 175.904 175.904 174.598 1.306 18518
9912 1 15 . 1 1 87 87 SER CA C 87 58.271 58.271 57.818 0.453 18518
9913 1 15 . 1 1 87 87 SER CB C 87 63.735 63.735 62.451 1.284 18518
9914 1 15 . 1 1 87 87 SER H H 87 8.977 8.977 8.683 0.294 18518
9915 1 15 . 1 1 88 88 MET N N 88 125.472 125.472 121.083 4.389 18518
9916 1 15 . 1 1 88 88 MET HA H 88 4.830 4.830 4.676 0.154 18518
9917 1 15 . 1 1 88 88 MET C C 88 176.419 176.419 176.232 0.187 18518
9918 1 15 . 1 1 88 88 MET CA C 88 54.899 54.899 55.151 -0.252 18518
9919 1 15 . 1 1 88 88 MET CB C 88 33.336 33.336 33.722 -0.386 18518
9920 1 15 . 1 1 88 88 MET H H 88 9.184 9.184 7.826 1.358 18518
9921 1 15 . 1 1 89 89 VAL N N 89 120.747 120.747 122.209 -1.462 18518
9922 1 15 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.091 0.141 18518
9923 1 15 . 1 1 89 89 VAL C C 89 175.958 175.958 175.049 0.909 18518
9924 1 15 . 1 1 89 89 VAL CA C 89 63.154 63.154 62.078 1.076 18518
9925 1 15 . 1 1 89 89 VAL CB C 89 31.878 31.878 32.626 -0.748 18518
9926 1 15 . 1 1 89 89 VAL H H 89 8.233 8.233 7.757 0.476 18518
9927 1 15 . 1 1 90 90 SER N N 90 117.362 117.362 121.490 -4.128 18518
9928 1 15 . 1 1 90 90 SER HA H 90 4.590 4.590 4.698 -0.108 18518
9929 1 15 . 1 1 90 90 SER C C 90 175.741 175.741 176.166 -0.425 18518
9930 1 15 . 1 1 90 90 SER CA C 90 57.717 57.717 57.392 0.326 18518
9931 1 15 . 1 1 90 90 SER CB C 90 63.223 63.223 64.241 -1.018 18518
9932 1 15 . 1 1 90 90 SER H H 90 8.482 8.482 8.368 0.114 18518
9933 1 15 . 1 1 91 91 VAL N N 91 120.466 120.466 122.159 -1.693 18518
9934 1 15 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.707 0.340 18518
9935 1 15 . 1 1 91 91 VAL C C 91 176.329 176.329 176.738 -0.409 18518
9936 1 15 . 1 1 91 91 VAL CA C 91 63.492 63.492 65.199 -1.707 18518
9937 1 15 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.677 0.891 18518
9938 1 15 . 1 1 91 91 VAL H H 91 8.188 8.188 8.700 -0.512 18518
9939 1 15 . 1 1 92 92 SER N N 92 116.398 116.398 114.547 1.851 18518
9940 1 15 . 1 1 92 92 SER HA H 92 4.636 4.636 4.386 0.250 18518
9941 1 15 . 1 1 92 92 SER C C 92 174.159 174.159 174.953 -0.794 18518
9942 1 15 . 1 1 92 92 SER CA C 92 57.805 57.805 59.432 -1.627 18518
9943 1 15 . 1 1 92 92 SER CB C 92 63.046 63.046 63.123 -0.077 18518
9944 1 15 . 1 1 92 92 SER H H 92 8.370 8.370 8.230 0.140 18518
9945 1 15 . 1 1 93 93 THR N N 93 119.211 119.211 121.118 -1.907 18518
9946 1 15 . 1 1 93 93 THR HA H 93 4.484 4.484 4.526 -0.042 18518
9947 1 15 . 1 1 93 93 THR CA C 93 60.884 60.884 61.545 -0.662 18518
9948 1 15 . 1 1 93 93 THR CB C 93 70.609 70.609 68.940 1.669 18518
9949 1 15 . 1 1 93 93 THR H H 93 7.416 7.416 7.487 -0.071 18518
9950 1 15 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.705 -0.266 18518
9951 1 15 . 1 1 94 94 PRO C C 94 178.775 178.775 177.392 1.383 18518
9952 1 15 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.475 0.468 18518
9953 1 15 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.416 0.233 18518
9954 1 15 . 1 1 95 95 ILE N N 95 124.174 124.174 125.017 -0.843 18518
9955 1 15 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.847 0.102 18518
9956 1 15 . 1 1 95 95 ILE C C 95 176.498 176.498 176.872 -0.374 18518
9957 1 15 . 1 1 95 95 ILE CA C 95 63.904 63.904 62.832 1.072 18518
9958 1 15 . 1 1 95 95 ILE CB C 95 38.182 38.182 37.957 0.225 18518
9959 1 15 . 1 1 95 95 ILE H H 95 9.305 9.305 8.078 1.227 18518
9960 1 15 . 1 1 96 96 SER N N 96 116.920 116.920 116.457 0.463 18518
9961 1 15 . 1 1 96 96 SER HA H 96 4.029 4.029 4.071 -0.042 18518
9962 1 15 . 1 1 96 96 SER C C 96 176.574 176.574 176.034 0.540 18518
9963 1 15 . 1 1 96 96 SER CA C 96 61.356 61.356 62.886 -1.530 18518
9964 1 15 . 1 1 96 96 SER CB C 96 61.723 61.723 62.877 -1.153 18518
9965 1 15 . 1 1 96 96 SER H H 96 8.335 8.335 8.603 -0.268 18518
9966 1 15 . 1 1 97 97 GLU N N 97 123.255 123.255 121.378 1.877 18518
9967 1 15 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.162 0.116 18518
9968 1 15 . 1 1 97 97 GLU C C 97 179.716 179.716 179.049 0.667 18518
9969 1 15 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.968 -0.176 18518
9970 1 15 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.164 0.398 18518
9971 1 15 . 1 1 97 97 GLU H H 97 7.376 7.376 7.902 -0.526 18518
9972 1 15 . 1 1 98 98 VAL N N 98 121.137 121.137 120.422 0.715 18518
9973 1 15 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.688 0.114 18518
9974 1 15 . 1 1 98 98 VAL C C 98 177.637 177.637 177.963 -0.326 18518
9975 1 15 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.479 -0.655 18518
9976 1 15 . 1 1 98 98 VAL CB C 98 32.154 32.154 31.004 1.150 18518
9977 1 15 . 1 1 98 98 VAL H H 98 7.387 7.387 7.901 -0.514 18518
9978 1 15 . 1 1 99 99 TYR N N 99 118.927 118.927 121.642 -2.715 18518
9979 1 15 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.006 -0.016 18518
9980 1 15 . 1 1 99 99 TYR C C 99 176.081 176.081 177.278 -1.197 18518
9981 1 15 . 1 1 99 99 TYR CA C 99 62.223 62.223 62.089 0.134 18518
9982 1 15 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.641 0.341 18518
9983 1 15 . 1 1 99 99 TYR H H 99 9.048 9.048 8.495 0.553 18518
9984 1 15 . 1 1 100 100 GLU N N 100 113.894 113.894 116.595 -2.701 18518
9985 1 15 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.899 -0.053 18518
9986 1 15 . 1 1 100 100 GLU C C 100 177.989 177.989 178.619 -0.630 18518
9987 1 15 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.541 0.546 18518
9988 1 15 . 1 1 100 100 GLU CB C 100 29.382 29.382 29.254 0.128 18518
9989 1 15 . 1 1 100 100 GLU H H 100 7.422 7.422 8.181 -0.759 18518
9990 1 15 . 1 1 101 101 SER N N 101 108.991 108.991 114.737 -5.746 18518
9991 1 15 . 1 1 101 101 SER HA H 101 4.524 4.524 4.350 0.174 18518
9992 1 15 . 1 1 101 101 SER C C 101 176.628 176.628 175.462 1.166 18518
9993 1 15 . 1 1 101 101 SER CA C 101 60.349 60.349 60.392 -0.043 18518
9994 1 15 . 1 1 101 101 SER CB C 101 64.741 64.741 63.900 0.841 18518
9995 1 15 . 1 1 101 101 SER H H 101 7.424 7.424 7.804 -0.380 18518
9996 1 15 . 1 1 102 102 GLU N N 102 116.533 116.533 119.426 -2.893 18518
9997 1 15 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.517 0.227 18518
9998 1 15 . 1 1 102 102 GLU C C 102 176.774 176.774 175.607 1.167 18518
9999 1 15 . 1 1 102 102 GLU CA C 102 55.581 55.581 55.593 -0.012 18518
10000 1 15 . 1 1 102 102 GLU CB C 102 30.697 30.697 30.944 -0.247 18518
10001 1 15 . 1 1 102 102 GLU H H 102 8.487 8.487 7.708 0.779 18518
10002 1 15 . 1 1 103 103 LYS N N 103 118.370 118.370 120.676 -2.306 18518
10003 1 15 . 1 1 103 103 LYS HA H 103 4.178 4.178 3.795 0.383 18518
10004 1 15 . 1 1 103 103 LYS C C 103 175.018 175.018 176.603 -1.585 18518
10005 1 15 . 1 1 103 103 LYS CA C 103 57.329 57.329 57.538 -0.209 18518
10006 1 15 . 1 1 103 103 LYS CB C 103 32.186 32.186 32.181 0.005 18518
10007 1 15 . 1 1 103 103 LYS H H 103 7.831 7.831 7.599 0.232 18518
10008 1 15 . 1 1 104 104 ASP N N 104 123.500 123.500 126.148 -2.648 18518
10009 1 15 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.728 0.027 18518
10010 1 15 . 1 1 104 104 ASP C C 104 177.383 177.383 177.482 -0.099 18518
10011 1 15 . 1 1 104 104 ASP CA C 104 53.846 53.846 53.594 0.251 18518
10012 1 15 . 1 1 104 104 ASP CB C 104 43.411 43.411 42.113 1.298 18518
10013 1 15 . 1 1 104 104 ASP H H 104 9.041 9.041 8.076 0.965 18518
10014 1 15 . 1 1 105 105 GLU N N 105 125.448 125.448 120.933 4.515 18518
10015 1 15 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.077 0.103 18518
10016 1 15 . 1 1 105 105 GLU C C 105 177.519 177.519 176.757 0.762 18518
10017 1 15 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.816 0.713 18518
10018 1 15 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.815 0.229 18518
10019 1 15 . 1 1 105 105 GLU H H 105 8.906 8.906 8.824 0.082 18518
10020 1 15 . 1 1 106 106 ASP N N 106 118.824 118.824 116.550 2.274 18518
10021 1 15 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.484 -0.305 18518
10022 1 15 . 1 1 106 106 ASP C C 106 176.223 176.223 177.052 -0.829 18518
10023 1 15 . 1 1 106 106 ASP CA C 106 54.756 54.756 54.662 0.094 18518
10024 1 15 . 1 1 106 106 ASP CB C 106 39.999 39.999 41.025 -1.026 18518
10025 1 15 . 1 1 106 106 ASP H H 106 10.036 10.036 8.362 1.674 18518
10026 1 15 . 1 1 107 107 GLY N N 107 105.866 105.866 105.986 -0.120 18518
10027 1 15 . 1 1 107 107 GLY C C 107 175.136 175.136 173.677 1.459 18518
10028 1 15 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.194 0.028 18518
10029 1 15 . 1 1 107 107 GLY H H 107 8.001 8.001 7.594 0.407 18518
10030 1 15 . 1 1 108 108 PHE N N 108 123.820 123.820 120.066 3.754 18518
10031 1 15 . 1 1 108 108 PHE HA H 108 4.662 4.662 5.050 -0.388 18518
10032 1 15 . 1 1 108 108 PHE C C 108 174.899 174.899 174.756 0.143 18518
10033 1 15 . 1 1 108 108 PHE CA C 108 60.238 60.238 57.742 2.496 18518
10034 1 15 . 1 1 108 108 PHE CB C 108 40.365 40.365 41.190 -0.825 18518
10035 1 15 . 1 1 108 108 PHE H H 108 9.912 9.912 7.819 2.094 18518
10036 1 15 . 1 1 109 109 LEU N N 109 120.130 120.130 123.124 -2.994 18518
10037 1 15 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.919 0.111 18518
10038 1 15 . 1 1 109 109 LEU C C 109 173.916 173.916 174.856 -0.940 18518
10039 1 15 . 1 1 109 109 LEU CA C 109 53.424 53.424 54.062 -0.638 18518
10040 1 15 . 1 1 109 109 LEU CB C 109 45.203 45.203 43.310 1.893 18518
10041 1 15 . 1 1 109 109 LEU H H 109 7.997 7.997 8.843 -0.846 18518
10042 1 15 . 1 1 110 110 TYR N N 110 126.579 126.579 128.868 -2.289 18518
10043 1 15 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.901 0.102 18518
10044 1 15 . 1 1 110 110 TYR C C 110 176.671 176.671 175.310 1.361 18518
10045 1 15 . 1 1 110 110 TYR CA C 110 59.058 59.058 58.338 0.720 18518
10046 1 15 . 1 1 110 110 TYR CB C 110 39.556 39.556 39.427 0.129 18518
10047 1 15 . 1 1 110 110 TYR H H 110 9.377 9.377 8.378 0.999 18518
10048 1 15 . 1 1 111 111 MET N N 111 119.240 119.240 120.863 -1.623 18518
10049 1 15 . 1 1 111 111 MET HA H 111 5.486 5.486 5.474 0.012 18518
10050 1 15 . 1 1 111 111 MET C C 111 175.695 175.695 174.254 1.441 18518
10051 1 15 . 1 1 111 111 MET CA C 111 54.124 54.124 54.215 -0.091 18518
10052 1 15 . 1 1 111 111 MET CB C 111 36.960 36.960 36.928 0.032 18518
10053 1 15 . 1 1 111 111 MET H H 111 9.658 9.658 9.151 0.507 18518
10054 1 15 . 1 1 112 112 VAL N N 112 119.865 119.865 115.905 3.960 18518
10055 1 15 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.465 0.498 18518
10056 1 15 . 1 1 112 112 VAL C C 112 175.058 175.058 174.220 0.838 18518
10057 1 15 . 1 1 112 112 VAL CA C 112 58.911 58.911 60.098 -1.187 18518
10058 1 15 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.416 0.635 18518
10059 1 15 . 1 1 112 112 VAL H H 112 8.794 8.794 8.992 -0.198 18518
10060 1 15 . 1 1 113 113 TYR N N 113 119.664 119.664 121.841 -2.177 18518
10061 1 15 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.662 0.456 18518
10062 1 15 . 1 1 113 113 TYR C C 113 173.375 173.375 173.784 -0.409 18518
10063 1 15 . 1 1 113 113 TYR CA C 113 54.153 54.153 54.336 -0.183 18518
10064 1 15 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.457 1.855 18518
10065 1 15 . 1 1 113 113 TYR H H 113 8.315 8.315 8.614 -0.299 18518
10066 1 15 . 1 1 114 114 ALA N N 114 119.763 119.763 122.164 -2.401 18518
10067 1 15 . 1 1 114 114 ALA HA H 114 4.800 4.800 4.756 0.044 18518
10068 1 15 . 1 1 114 114 ALA C C 114 176.216 176.216 174.865 1.351 18518
10069 1 15 . 1 1 114 114 ALA CA C 114 51.132 51.132 52.015 -0.883 18518
10070 1 15 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.332 2.264 18518
10071 1 15 . 1 1 114 114 ALA H H 114 8.465 8.465 8.675 -0.210 18518
10072 1 15 . 1 1 115 115 SER N N 115 114.763 114.763 116.074 -1.311 18518
10073 1 15 . 1 1 115 115 SER HA H 115 4.496 4.496 5.001 -0.505 18518
10074 1 15 . 1 1 115 115 SER C C 115 172.671 172.671 173.552 -0.881 18518
10075 1 15 . 1 1 115 115 SER CA C 115 58.651 58.651 57.400 1.251 18518
10076 1 15 . 1 1 115 115 SER CB C 115 63.526 63.526 61.814 1.712 18518
10077 1 15 . 1 1 115 115 SER H H 115 9.915 9.915 8.738 1.177 18518
10078 1 15 . 1 1 116 116 GLN N N 116 116.611 116.611 123.575 -6.964 18518
10079 1 15 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.507 -0.023 18518
10080 1 15 . 1 1 116 116 GLN C C 116 172.733 172.733 173.765 -1.032 18518
10081 1 15 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.702 -1.776 18518
10082 1 15 . 1 1 116 116 GLN CB C 116 32.358 32.358 30.204 2.154 18518
10083 1 15 . 1 1 116 116 GLN H H 116 7.219 7.219 8.016 -0.797 18518
10084 1 15 . 1 1 117 117 GLU N N 117 117.623 117.623 120.953 -3.330 18518
10085 1 15 . 1 1 117 117 GLU HA H 117 3.287 3.287 2.993 0.294 18518
10086 1 15 . 1 1 117 117 GLU C C 117 175.168 175.168 175.728 -0.560 18518
10087 1 15 . 1 1 117 117 GLU CA C 117 56.882 56.882 56.747 0.135 18518
10088 1 15 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.682 0.840 18518
10089 1 15 . 1 1 117 117 GLU H H 117 7.882 7.882 8.707 -0.825 18518
10090 1 15 . 1 1 118 118 THR N N 118 109.820 109.820 111.262 -1.442 18518
10091 1 15 . 1 1 118 118 THR HA H 118 4.066 4.066 4.389 -0.323 18518
10092 1 15 . 1 1 118 118 THR C C 118 172.355 172.355 174.161 -1.806 18518
10093 1 15 . 1 1 118 118 THR CA C 118 60.029 60.029 60.040 -0.011 18518
10094 1 15 . 1 1 118 118 THR CB C 118 70.480 70.480 69.480 1.000 18518
10095 1 15 . 1 1 118 118 THR H H 118 6.992 6.992 7.375 -0.383 18518
10096 1 16 . 1 1 2 2 ALA HA H 2 4.336 4.336 5.143 -0.807 18518
10097 1 16 . 1 1 2 2 ALA C C 2 177.974 177.974 176.488 1.486 18518
10098 1 16 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.560 1.225 18518
10099 1 16 . 1 1 2 2 ALA CB C 2 19.444 19.444 20.473 -1.029 18518
10100 1 16 . 1 1 3 3 MET N N 3 119.311 119.311 122.035 -2.724 18518
10101 1 16 . 1 1 3 3 MET HA H 3 4.451 4.451 4.766 -0.315 18518
10102 1 16 . 1 1 3 3 MET C C 3 176.913 176.913 176.421 0.492 18518
10103 1 16 . 1 1 3 3 MET CA C 3 55.679 55.679 54.742 0.937 18518
10104 1 16 . 1 1 3 3 MET CB C 3 32.590 32.590 35.620 -3.030 18518
10105 1 16 . 1 1 3 3 MET H H 3 8.638 8.638 8.669 -0.031 18518
10106 1 16 . 1 1 4 4 GLY N N 4 110.281 110.281 110.226 0.055 18518
10107 1 16 . 1 1 4 4 GLY C C 4 174.180 174.180 173.992 0.188 18518
10108 1 16 . 1 1 4 4 GLY CA C 4 45.495 45.495 45.219 0.276 18518
10109 1 16 . 1 1 4 4 GLY H H 4 8.552 8.552 8.552 0.000 18518
10110 1 16 . 1 1 5 5 LYS N N 5 120.818 120.818 126.193 -5.375 18518
10111 1 16 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.298 0.211 18518
10112 1 16 . 1 1 5 5 LYS C C 5 177.605 177.605 176.648 0.957 18518
10113 1 16 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.748 0.386 18518
10114 1 16 . 1 1 5 5 LYS CB C 5 34.813 34.813 32.693 2.120 18518
10115 1 16 . 1 1 5 5 LYS H H 5 8.133 8.133 8.181 -0.048 18518
10116 1 16 . 1 1 6 6 THR N N 6 114.781 114.781 117.093 -2.312 18518
10117 1 16 . 1 1 6 6 THR HA H 6 4.421 4.421 4.420 0.001 18518
10118 1 16 . 1 1 6 6 THR C C 6 175.524 175.524 175.631 -0.107 18518
10119 1 16 . 1 1 6 6 THR CA C 6 61.127 61.127 60.616 0.511 18518
10120 1 16 . 1 1 6 6 THR CB C 6 69.926 69.926 70.488 -0.562 18518
10121 1 16 . 1 1 6 6 THR H H 6 8.483 8.483 7.998 0.485 18518
10122 1 16 . 1 1 7 7 PHE N N 7 125.552 125.552 120.866 4.686 18518
10123 1 16 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.173 -0.168 18518
10124 1 16 . 1 1 7 7 PHE C C 7 177.397 177.397 176.776 0.621 18518
10125 1 16 . 1 1 7 7 PHE CA C 7 63.393 63.393 61.038 2.355 18518
10126 1 16 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.518 1.049 18518
10127 1 16 . 1 1 7 7 PHE H H 7 10.245 10.245 8.991 1.254 18518
10128 1 16 . 1 1 8 8 LYS N N 8 114.053 114.053 116.879 -2.826 18518
10129 1 16 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.656 0.179 18518
10130 1 16 . 1 1 8 8 LYS C C 8 175.520 175.520 178.504 -2.984 18518
10131 1 16 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.498 1.496 18518
10132 1 16 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.293 2.396 18518
10133 1 16 . 1 1 8 8 LYS H H 8 8.775 8.775 7.558 1.217 18518
10134 1 16 . 1 1 9 9 GLN N N 9 113.516 113.516 117.223 -3.707 18518
10135 1 16 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.150 -0.001 18518
10136 1 16 . 1 1 9 9 GLN C C 9 177.615 177.615 177.215 0.400 18518
10137 1 16 . 1 1 9 9 GLN CA C 9 56.819 56.819 57.900 -1.081 18518
10138 1 16 . 1 1 9 9 GLN CB C 9 30.019 30.019 28.849 1.170 18518
10139 1 16 . 1 1 9 9 GLN H H 9 7.355 7.355 7.495 -0.140 18518
10140 1 16 . 1 1 10 10 ARG N N 10 118.294 118.294 118.010 0.284 18518
10141 1 16 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.182 0.120 18518
10142 1 16 . 1 1 10 10 ARG C C 10 179.380 179.380 177.194 2.186 18518
10143 1 16 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.464 -0.196 18518
10144 1 16 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.958 0.684 18518
10145 1 16 . 1 1 10 10 ARG H H 10 7.936 7.936 7.797 0.139 18518
10146 1 16 . 1 1 11 11 ARG N N 11 121.137 121.137 119.517 1.620 18518
10147 1 16 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.781 -0.101 18518
10148 1 16 . 1 1 11 11 ARG CA C 11 53.453 53.453 53.929 -0.476 18518
10149 1 16 . 1 1 11 11 ARG CB C 11 32.938 32.938 32.181 0.757 18518
10150 1 16 . 1 1 11 11 ARG H H 11 7.390 7.390 7.857 -0.467 18518
10151 1 16 . 1 1 12 12 THR N N 12 116.819 116.819 119.978 -3.159 18518
10152 1 16 . 1 1 12 12 THR HA H 12 4.359 4.359 4.313 0.046 18518
10153 1 16 . 1 1 12 12 THR C C 12 174.989 174.989 175.891 -0.902 18518
10154 1 16 . 1 1 12 12 THR CA C 12 61.748 61.748 63.153 -1.405 18518
10155 1 16 . 1 1 12 12 THR CB C 12 71.068 71.068 70.280 0.788 18518
10156 1 16 . 1 1 12 12 THR H H 12 8.953 8.953 8.597 0.356 18518
10157 1 16 . 1 1 13 13 PHE N N 13 123.200 123.200 124.825 -1.625 18518
10158 1 16 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.185 -0.157 18518
10159 1 16 . 1 1 13 13 PHE C C 13 176.029 176.029 176.965 -0.936 18518
10160 1 16 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.723 0.141 18518
10161 1 16 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.383 0.177 18518
10162 1 16 . 1 1 13 13 PHE H H 13 9.284 9.284 9.058 0.226 18518
10163 1 16 . 1 1 14 14 GLU N N 14 115.414 115.414 117.438 -2.024 18518
10164 1 16 . 1 1 14 14 GLU HA H 14 3.794 3.794 3.891 -0.097 18518
10165 1 16 . 1 1 14 14 GLU C C 14 180.081 180.081 179.155 0.926 18518
10166 1 16 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.600 1.019 18518
10167 1 16 . 1 1 14 14 GLU CB C 14 28.852 28.852 29.134 -0.282 18518
10168 1 16 . 1 1 14 14 GLU H H 14 8.973 8.973 8.904 0.069 18518
10169 1 16 . 1 1 15 15 GLN N N 15 119.276 119.276 118.226 1.050 18518
10170 1 16 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.120 -0.120 18518
10171 1 16 . 1 1 15 15 GLN C C 15 177.978 177.978 178.661 -0.683 18518
10172 1 16 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.653 0.182 18518
10173 1 16 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.784 0.586 18518
10174 1 16 . 1 1 15 15 GLN H H 15 7.756 7.756 7.699 0.057 18518
10175 1 16 . 1 1 16 16 ARG N N 16 121.336 121.336 120.988 0.348 18518
10176 1 16 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.473 -0.203 18518
10177 1 16 . 1 1 16 16 ARG C C 16 177.416 177.416 179.046 -1.630 18518
10178 1 16 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.769 1.606 18518
10179 1 16 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.446 0.159 18518
10180 1 16 . 1 1 16 16 ARG H H 16 8.645 8.645 8.388 0.257 18518
10181 1 16 . 1 1 17 17 VAL N N 17 117.630 117.630 119.552 -1.922 18518
10182 1 16 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.526 0.331 18518
10183 1 16 . 1 1 17 17 VAL C C 17 179.748 179.748 177.845 1.903 18518
10184 1 16 . 1 1 17 17 VAL CA C 17 65.726 65.726 66.788 -1.062 18518
10185 1 16 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.668 0.526 18518
10186 1 16 . 1 1 17 17 VAL H H 17 8.373 8.373 8.315 0.058 18518
10187 1 16 . 1 1 18 18 GLU N N 18 120.864 120.864 119.625 1.239 18518
10188 1 16 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.904 0.398 18518
10189 1 16 . 1 1 18 18 GLU C C 18 177.728 177.728 178.703 -0.975 18518
10190 1 16 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.846 -1.360 18518
10191 1 16 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.398 -0.016 18518
10192 1 16 . 1 1 18 18 GLU H H 18 7.368 7.368 7.862 -0.494 18518
10193 1 16 . 1 1 19 19 ASP N N 19 121.425 121.425 119.741 1.684 18518
10194 1 16 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.431 0.003 18518
10195 1 16 . 1 1 19 19 ASP C C 19 179.978 179.978 178.859 1.119 18518
10196 1 16 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.464 -0.042 18518
10197 1 16 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.497 0.790 18518
10198 1 16 . 1 1 19 19 ASP H H 19 8.671 8.671 8.400 0.271 18518
10199 1 16 . 1 1 20 20 VAL N N 20 119.730 119.730 120.154 -0.424 18518
10200 1 16 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.340 -0.135 18518
10201 1 16 . 1 1 20 20 VAL C C 20 176.284 176.284 177.404 -1.120 18518
10202 1 16 . 1 1 20 20 VAL CA C 20 66.315 66.315 66.901 -0.586 18518
10203 1 16 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.236 -0.129 18518
10204 1 16 . 1 1 20 20 VAL H H 20 7.999 7.999 7.684 0.315 18518
10205 1 16 . 1 1 21 21 ARG N N 21 121.455 121.455 119.767 1.688 18518
10206 1 16 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.971 -0.157 18518
10207 1 16 . 1 1 21 21 ARG C C 21 180.120 180.120 178.927 1.193 18518
10208 1 16 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.745 1.085 18518
10209 1 16 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.096 0.850 18518
10210 1 16 . 1 1 21 21 ARG H H 21 8.098 8.098 7.787 0.311 18518
10211 1 16 . 1 1 22 22 LEU N N 22 117.826 117.826 121.109 -3.283 18518
10212 1 16 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.051 -0.002 18518
10213 1 16 . 1 1 22 22 LEU C C 22 180.115 180.115 178.655 1.460 18518
10214 1 16 . 1 1 22 22 LEU CA C 22 57.790 57.790 57.857 -0.067 18518
10215 1 16 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.462 0.680 18518
10216 1 16 . 1 1 22 22 LEU H H 22 8.207 8.207 8.341 -0.134 18518
10217 1 16 . 1 1 23 23 ILE N N 23 121.450 121.450 119.954 1.496 18518
10218 1 16 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.976 0.037 18518
10219 1 16 . 1 1 23 23 ILE C C 23 178.149 178.149 178.540 -0.391 18518
10220 1 16 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.305 -2.134 18518
10221 1 16 . 1 1 23 23 ILE CB C 23 38.106 38.106 37.710 0.396 18518
10222 1 16 . 1 1 23 23 ILE H H 23 8.105 8.105 8.002 0.103 18518
10223 1 16 . 1 1 24 24 ARG N N 24 121.139 121.139 118.722 2.417 18518
10224 1 16 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.022 -0.035 18518
10225 1 16 . 1 1 24 24 ARG C C 24 178.702 178.702 178.741 -0.039 18518
10226 1 16 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.772 -1.054 18518
10227 1 16 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.682 -0.913 18518
10228 1 16 . 1 1 24 24 ARG H H 24 8.601 8.601 8.265 0.336 18518
10229 1 16 . 1 1 25 25 GLU N N 25 118.054 118.054 118.615 -0.561 18518
10230 1 16 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.167 -0.141 18518
10231 1 16 . 1 1 25 25 GLU C C 25 178.492 178.492 178.163 0.329 18518
10232 1 16 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.278 0.502 18518
10233 1 16 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.539 0.462 18518
10234 1 16 . 1 1 25 25 GLU H H 25 7.423 7.423 7.731 -0.308 18518
10235 1 16 . 1 1 26 26 GLN N N 26 116.350 116.350 117.329 -0.979 18518
10236 1 16 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.013 -0.077 18518
10237 1 16 . 1 1 26 26 GLN C C 26 176.305 176.305 176.972 -0.667 18518
10238 1 16 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.344 0.159 18518
10239 1 16 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.305 0.902 18518
10240 1 16 . 1 1 26 26 GLN H H 26 7.524 7.524 7.850 -0.326 18518
10241 1 16 . 1 1 27 27 HIS N N 27 116.017 116.017 118.366 -2.349 18518
10242 1 16 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.139 -0.209 18518
10243 1 16 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.811 0.243 18518
10244 1 16 . 1 1 27 27 HIS CB C 27 30.747 30.747 29.941 0.806 18518
10245 1 16 . 1 1 27 27 HIS H H 27 8.284 8.284 8.147 0.137 18518
10246 1 16 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.576 0.005 18518
10247 1 16 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.418 0.500 18518
10248 1 16 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.162 0.293 18518
10249 1 16 . 1 1 29 29 THR N N 29 107.011 107.011 107.654 -0.643 18518
10250 1 16 . 1 1 29 29 THR HA H 29 4.599 4.599 4.299 0.300 18518
10251 1 16 . 1 1 29 29 THR C C 29 172.884 172.884 174.158 -1.274 18518
10252 1 16 . 1 1 29 29 THR CA C 29 60.810 60.810 62.096 -1.286 18518
10253 1 16 . 1 1 29 29 THR CB C 29 68.531 68.531 68.555 -0.024 18518
10254 1 16 . 1 1 29 29 THR H H 29 7.890 7.890 8.276 -0.386 18518
10255 1 16 . 1 1 30 30 LYS N N 30 117.679 117.679 120.591 -2.912 18518
10256 1 16 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.901 -0.043 18518
10257 1 16 . 1 1 30 30 LYS C C 30 174.310 174.310 174.369 -0.059 18518
10258 1 16 . 1 1 30 30 LYS CA C 30 53.751 53.751 54.060 -0.309 18518
10259 1 16 . 1 1 30 30 LYS CB C 30 35.804 35.804 36.287 -0.483 18518
10260 1 16 . 1 1 30 30 LYS H H 30 7.441 7.441 7.587 -0.146 18518
10261 1 16 . 1 1 31 31 ILE N N 31 122.849 122.849 122.058 0.791 18518
10262 1 16 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.476 -0.370 18518
10263 1 16 . 1 1 31 31 ILE CA C 31 54.801 54.801 56.288 -1.487 18518
10264 1 16 . 1 1 31 31 ILE CB C 31 38.265 38.265 38.796 -0.531 18518
10265 1 16 . 1 1 31 31 ILE H H 31 9.304 9.304 8.942 0.362 18518
10266 1 16 . 1 1 32 32 PRO HA H 32 5.159 5.159 5.066 0.093 18518
10267 1 16 . 1 1 32 32 PRO C C 32 174.164 174.164 175.982 -1.818 18518
10268 1 16 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.188 -0.685 18518
10269 1 16 . 1 1 32 32 PRO CB C 32 31.145 31.145 31.340 -0.195 18518
10270 1 16 . 1 1 33 33 VAL N N 33 125.606 125.606 125.839 -0.233 18518
10271 1 16 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.070 0.143 18518
10272 1 16 . 1 1 33 33 VAL C C 33 173.654 173.654 173.942 -0.288 18518
10273 1 16 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.745 0.299 18518
10274 1 16 . 1 1 33 33 VAL CB C 33 35.604 35.604 36.390 -0.786 18518
10275 1 16 . 1 1 33 33 VAL H H 33 9.424 9.424 8.641 0.783 18518
10276 1 16 . 1 1 34 34 ILE N N 34 128.241 128.241 127.225 1.016 18518
10277 1 16 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.771 0.062 18518
10278 1 16 . 1 1 34 34 ILE C C 34 175.605 175.605 174.453 1.152 18518
10279 1 16 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.458 -1.693 18518
10280 1 16 . 1 1 34 34 ILE CB C 34 36.799 36.799 38.689 -1.890 18518
10281 1 16 . 1 1 34 34 ILE H H 34 8.721 8.721 9.116 -0.395 18518
10282 1 16 . 1 1 35 35 ILE N N 35 125.650 125.650 128.201 -2.551 18518
10283 1 16 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.898 -0.062 18518
10284 1 16 . 1 1 35 35 ILE C C 35 174.887 174.887 174.761 0.126 18518
10285 1 16 . 1 1 35 35 ILE CA C 35 60.945 60.945 58.644 2.301 18518
10286 1 16 . 1 1 35 35 ILE CB C 35 39.210 39.210 38.875 0.335 18518
10287 1 16 . 1 1 35 35 ILE H H 35 9.034 9.034 8.834 0.200 18518
10288 1 16 . 1 1 36 36 GLU N N 36 122.657 122.657 125.228 -2.571 18518
10289 1 16 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.713 0.148 18518
10290 1 16 . 1 1 36 36 GLU C C 36 173.848 173.848 174.346 -0.498 18518
10291 1 16 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.739 -0.807 18518
10292 1 16 . 1 1 36 36 GLU CB C 36 35.282 35.282 33.959 1.323 18518
10293 1 16 . 1 1 36 36 GLU H H 36 8.303 8.303 8.469 -0.166 18518
10294 1 16 . 1 1 37 37 ARG N N 37 123.228 123.228 126.504 -3.276 18518
10295 1 16 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.226 -0.500 18518
10296 1 16 . 1 1 37 37 ARG C C 37 176.359 176.359 175.717 0.642 18518
10297 1 16 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.199 0.160 18518
10298 1 16 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.506 0.835 18518
10299 1 16 . 1 1 37 37 ARG H H 37 8.856 8.856 8.612 0.244 18518
10300 1 16 . 1 1 38 38 TYR N N 38 128.981 128.981 127.945 1.036 18518
10301 1 16 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.053 0.299 18518
10302 1 16 . 1 1 38 38 TYR C C 38 177.316 177.316 176.181 1.135 18518
10303 1 16 . 1 1 38 38 TYR CA C 38 57.712 57.712 58.211 -0.499 18518
10304 1 16 . 1 1 38 38 TYR CB C 38 39.472 39.472 39.509 -0.037 18518
10305 1 16 . 1 1 38 38 TYR H H 38 8.628 8.628 8.221 0.407 18518
10306 1 16 . 1 1 39 39 LYS N N 39 130.635 130.635 125.584 5.051 18518
10307 1 16 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.808 0.014 18518
10308 1 16 . 1 1 39 39 LYS CA C 39 58.887 58.887 57.905 0.982 18518
10309 1 16 . 1 1 39 39 LYS CB C 39 31.771 31.771 32.041 -0.270 18518
10310 1 16 . 1 1 39 39 LYS H H 39 8.594 8.594 8.240 0.354 18518
10311 1 16 . 1 1 40 40 GLY C C 40 173.447 173.447 173.762 -0.315 18518
10312 1 16 . 1 1 40 40 GLY CA C 40 44.663 44.663 43.996 0.667 18518
10313 1 16 . 1 1 40 40 GLY H H 40 5.188 5.188 6.193 -1.005 18518
10314 1 16 . 1 1 41 41 GLU N N 41 122.836 122.836 121.328 1.508 18518
10315 1 16 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.206 0.051 18518
10316 1 16 . 1 1 41 41 GLU C C 41 176.524 176.524 176.189 0.335 18518
10317 1 16 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.242 0.283 18518
10318 1 16 . 1 1 41 41 GLU CB C 41 30.985 30.985 28.990 1.995 18518
10319 1 16 . 1 1 41 41 GLU H H 41 7.380 7.380 7.256 0.124 18518
10320 1 16 . 1 1 42 42 LYS N N 42 124.040 124.040 127.351 -3.311 18518
10321 1 16 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.495 0.180 18518
10322 1 16 . 1 1 42 42 LYS C C 42 177.538 177.538 176.802 0.736 18518
10323 1 16 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.593 -0.753 18518
10324 1 16 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.287 1.692 18518
10325 1 16 . 1 1 42 42 LYS H H 42 9.034 9.034 8.649 0.385 18518
10326 1 16 . 1 1 43 43 GLN N N 43 119.259 119.259 118.799 0.460 18518
10327 1 16 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.458 0.084 18518
10328 1 16 . 1 1 43 43 GLN C C 43 177.336 177.336 176.001 1.335 18518
10329 1 16 . 1 1 43 43 GLN CA C 43 57.673 57.673 57.055 0.618 18518
10330 1 16 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.478 0.304 18518
10331 1 16 . 1 1 43 43 GLN H H 43 8.435 8.435 9.038 -0.603 18518
10332 1 16 . 1 1 44 44 LEU N N 44 120.760 120.760 122.840 -2.080 18518
10333 1 16 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.733 -0.038 18518
10334 1 16 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.485 0.760 18518
10335 1 16 . 1 1 44 44 LEU CB C 44 43.596 43.596 42.630 0.966 18518
10336 1 16 . 1 1 44 44 LEU H H 44 9.126 9.126 8.378 0.748 18518
10337 1 16 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.595 0.122 18518
10338 1 16 . 1 1 45 45 PRO C C 45 175.797 175.797 176.488 -0.691 18518
10339 1 16 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.110 0.001 18518
10340 1 16 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.273 0.319 18518
10341 1 16 . 1 1 46 46 VAL N N 46 119.052 119.052 120.736 -1.684 18518
10342 1 16 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.492 -0.625 18518
10343 1 16 . 1 1 46 46 VAL C C 46 175.640 175.640 177.276 -1.636 18518
10344 1 16 . 1 1 46 46 VAL CA C 46 62.944 62.944 62.494 0.450 18518
10345 1 16 . 1 1 46 46 VAL CB C 46 32.799 32.799 32.353 0.446 18518
10346 1 16 . 1 1 46 46 VAL H H 46 8.543 8.543 8.309 0.234 18518
10347 1 16 . 1 1 47 47 LEU N N 47 130.203 130.203 127.031 3.172 18518
10348 1 16 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.302 0.007 18518
10349 1 16 . 1 1 47 47 LEU C C 47 176.198 176.198 177.369 -1.171 18518
10350 1 16 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.466 -0.460 18518
10351 1 16 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.372 1.460 18518
10352 1 16 . 1 1 47 47 LEU H H 47 7.799 7.799 8.597 -0.798 18518
10353 1 16 . 1 1 48 48 ASP N N 48 122.403 122.403 119.389 3.014 18518
10354 1 16 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.596 -0.333 18518
10355 1 16 . 1 1 48 48 ASP C C 48 175.294 175.294 175.579 -0.285 18518
10356 1 16 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.499 0.333 18518
10357 1 16 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.374 -1.190 18518
10358 1 16 . 1 1 48 48 ASP H H 48 8.780 8.780 8.535 0.245 18518
10359 1 16 . 1 1 49 49 LYS N N 49 119.569 119.569 117.659 1.910 18518
10360 1 16 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.548 0.037 18518
10361 1 16 . 1 1 49 49 LYS C C 49 174.678 174.678 175.377 -0.699 18518
10362 1 16 . 1 1 49 49 LYS CA C 49 53.652 53.652 54.929 -1.277 18518
10363 1 16 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.588 1.357 18518
10364 1 16 . 1 1 49 49 LYS H H 49 7.280 7.280 7.513 -0.233 18518
10365 1 16 . 1 1 50 50 THR N N 50 110.862 110.862 114.171 -3.309 18518
10366 1 16 . 1 1 50 50 THR HA H 50 4.811 4.811 4.621 0.190 18518
10367 1 16 . 1 1 50 50 THR C C 50 172.425 172.425 173.645 -1.220 18518
10368 1 16 . 1 1 50 50 THR CA C 50 62.645 62.645 62.851 -0.206 18518
10369 1 16 . 1 1 50 50 THR CB C 50 71.648 71.648 70.817 0.831 18518
10370 1 16 . 1 1 50 50 THR H H 50 8.042 8.042 8.112 -0.070 18518
10371 1 16 . 1 1 51 51 LYS N N 51 120.008 120.008 121.862 -1.854 18518
10372 1 16 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.930 -0.305 18518
10373 1 16 . 1 1 51 51 LYS C C 51 175.082 175.082 175.975 -0.893 18518
10374 1 16 . 1 1 51 51 LYS CA C 51 54.704 54.704 55.766 -1.062 18518
10375 1 16 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.527 -1.151 18518
10376 1 16 . 1 1 51 51 LYS H H 51 7.119 7.119 7.516 -0.397 18518
10377 1 16 . 1 1 52 52 PHE N N 52 122.640 122.640 121.940 0.700 18518
10378 1 16 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.777 0.560 18518
10379 1 16 . 1 1 52 52 PHE C C 52 174.213 174.213 173.997 0.216 18518
10380 1 16 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.775 -0.164 18518
10381 1 16 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.291 -0.151 18518
10382 1 16 . 1 1 52 52 PHE H H 52 9.709 9.709 9.233 0.476 18518
10383 1 16 . 1 1 53 53 LEU N N 53 122.157 122.157 123.182 -1.025 18518
10384 1 16 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.882 0.065 18518
10385 1 16 . 1 1 53 53 LEU C C 53 175.769 175.769 175.653 0.116 18518
10386 1 16 . 1 1 53 53 LEU CA C 53 52.957 52.957 54.281 -1.324 18518
10387 1 16 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.336 1.079 18518
10388 1 16 . 1 1 53 53 LEU H H 53 8.959 8.959 8.586 0.373 18518
10389 1 16 . 1 1 54 54 VAL N N 54 124.919 124.919 125.100 -0.181 18518
10390 1 16 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.577 -0.018 18518
10391 1 16 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.800 0.330 18518
10392 1 16 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.826 1.142 18518
10393 1 16 . 1 1 54 54 VAL H H 54 8.922 8.922 8.554 0.368 18518
10394 1 16 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.769 -0.328 18518
10395 1 16 . 1 1 55 55 PRO C C 55 176.594 176.594 178.063 -1.469 18518
10396 1 16 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.403 1.912 18518
10397 1 16 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.078 0.587 18518
10398 1 16 . 1 1 56 56 ASP N N 56 120.522 120.522 123.593 -3.071 18518
10399 1 16 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.211 -0.349 18518
10400 1 16 . 1 1 56 56 ASP C C 56 175.809 175.809 176.793 -0.984 18518
10401 1 16 . 1 1 56 56 ASP CA C 56 56.749 56.749 57.194 -0.445 18518
10402 1 16 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.679 -0.170 18518
10403 1 16 . 1 1 56 56 ASP H H 56 8.347 8.347 8.377 -0.030 18518
10404 1 16 . 1 1 57 57 HIS N N 57 113.482 113.482 115.759 -2.277 18518
10405 1 16 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.551 0.169 18518
10406 1 16 . 1 1 57 57 HIS C C 57 176.507 176.507 175.416 1.091 18518
10407 1 16 . 1 1 57 57 HIS CA C 57 55.589 55.589 56.657 -1.068 18518
10408 1 16 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.779 0.864 18518
10409 1 16 . 1 1 57 57 HIS H H 57 7.557 7.557 8.129 -0.572 18518
10410 1 16 . 1 1 58 58 VAL N N 58 123.279 123.279 121.137 2.142 18518
10411 1 16 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.207 -0.371 18518
10412 1 16 . 1 1 58 58 VAL C C 58 175.019 175.019 174.564 0.455 18518
10413 1 16 . 1 1 58 58 VAL CA C 58 62.823 62.823 59.895 2.928 18518
10414 1 16 . 1 1 58 58 VAL CB C 58 32.310 32.310 34.357 -2.047 18518
10415 1 16 . 1 1 58 58 VAL H H 58 7.345 7.345 7.652 -0.307 18518
10416 1 16 . 1 1 59 59 ASN N N 59 123.781 123.781 120.117 3.664 18518
10417 1 16 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.146 -0.020 18518
10418 1 16 . 1 1 59 59 ASN C C 59 176.558 176.558 176.560 -0.002 18518
10419 1 16 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.756 -0.271 18518
10420 1 16 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.893 -0.786 18518
10421 1 16 . 1 1 59 59 ASN H H 59 8.735 8.735 8.224 0.511 18518
10422 1 16 . 1 1 60 60 MET N N 60 117.453 117.453 118.618 -1.165 18518
10423 1 16 . 1 1 60 60 MET HA H 60 4.395 4.395 4.140 0.255 18518
10424 1 16 . 1 1 60 60 MET C C 60 178.144 178.144 178.062 0.082 18518
10425 1 16 . 1 1 60 60 MET CA C 60 57.097 57.097 58.014 -0.916 18518
10426 1 16 . 1 1 60 60 MET CB C 60 30.140 30.140 31.380 -1.240 18518
10427 1 16 . 1 1 60 60 MET H H 60 8.227 8.227 8.402 -0.175 18518
10428 1 16 . 1 1 61 61 SER N N 61 114.216 114.216 115.549 -1.333 18518
10429 1 16 . 1 1 61 61 SER HA H 61 4.111 4.111 4.069 0.042 18518
10430 1 16 . 1 1 61 61 SER C C 61 177.335 177.335 176.768 0.567 18518
10431 1 16 . 1 1 61 61 SER CA C 61 61.590 61.590 61.913 -0.323 18518
10432 1 16 . 1 1 61 61 SER CB C 61 62.402 62.402 62.842 -0.440 18518
10433 1 16 . 1 1 61 61 SER H H 61 8.464 8.464 8.547 -0.083 18518
10434 1 16 . 1 1 62 62 GLU N N 62 123.004 123.004 121.408 1.596 18518
10435 1 16 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.092 -0.045 18518
10436 1 16 . 1 1 62 62 GLU C C 62 178.686 178.686 178.763 -0.077 18518
10437 1 16 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.917 -0.292 18518
10438 1 16 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.410 0.244 18518
10439 1 16 . 1 1 62 62 GLU H H 62 7.994 7.994 7.647 0.347 18518
10440 1 16 . 1 1 63 63 LEU N N 63 120.818 120.818 121.849 -1.031 18518
10441 1 16 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.985 -0.020 18518
10442 1 16 . 1 1 63 63 LEU C C 63 178.046 178.046 178.856 -0.810 18518
10443 1 16 . 1 1 63 63 LEU CA C 63 57.920 57.920 58.045 -0.125 18518
10444 1 16 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.450 0.174 18518
10445 1 16 . 1 1 63 63 LEU H H 63 8.130 8.130 7.791 0.339 18518
10446 1 16 . 1 1 64 64 ILE N N 64 118.528 118.528 119.046 -0.518 18518
10447 1 16 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.579 -0.210 18518
10448 1 16 . 1 1 64 64 ILE C C 64 177.127 177.127 177.689 -0.562 18518
10449 1 16 . 1 1 64 64 ILE CA C 64 66.678 66.678 65.806 0.872 18518
10450 1 16 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.659 0.785 18518
10451 1 16 . 1 1 64 64 ILE H H 64 8.488 8.488 8.715 -0.227 18518
10452 1 16 . 1 1 65 65 LYS N N 65 118.336 118.336 120.785 -2.449 18518
10453 1 16 . 1 1 65 65 LYS HA H 65 3.701 3.701 4.002 -0.301 18518
10454 1 16 . 1 1 65 65 LYS C C 65 179.291 179.291 179.052 0.239 18518
10455 1 16 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.580 0.860 18518
10456 1 16 . 1 1 65 65 LYS CB C 65 32.371 32.371 31.996 0.375 18518
10457 1 16 . 1 1 65 65 LYS H H 65 7.347 7.347 7.566 -0.219 18518
10458 1 16 . 1 1 66 66 ILE N N 66 120.171 120.171 120.521 -0.350 18518
10459 1 16 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.692 -0.114 18518
10460 1 16 . 1 1 66 66 ILE C C 66 178.873 178.873 178.263 0.610 18518
10461 1 16 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.389 -0.229 18518
10462 1 16 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.772 0.861 18518
10463 1 16 . 1 1 66 66 ILE H H 66 7.901 7.901 7.979 -0.078 18518
10464 1 16 . 1 1 67 67 ILE N N 67 121.185 121.185 120.280 0.905 18518
10465 1 16 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.564 -0.118 18518
10466 1 16 . 1 1 67 67 ILE C C 67 177.150 177.150 177.923 -0.773 18518
10467 1 16 . 1 1 67 67 ILE CA C 67 62.806 62.806 65.034 -2.228 18518
10468 1 16 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.407 -2.412 18518
10469 1 16 . 1 1 67 67 ILE H H 67 8.290 8.290 7.900 0.390 18518
10470 1 16 . 1 1 68 68 ARG N N 68 119.173 119.173 118.749 0.424 18518
10471 1 16 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.754 -0.823 18518
10472 1 16 . 1 1 68 68 ARG C C 68 178.496 178.496 178.615 -0.119 18518
10473 1 16 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.447 1.189 18518
10474 1 16 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.761 0.680 18518
10475 1 16 . 1 1 68 68 ARG H H 68 8.438 8.438 8.331 0.107 18518
10476 1 16 . 1 1 69 69 ARG N N 69 116.511 116.511 120.575 -4.064 18518
10477 1 16 . 1 1 69 69 ARG HA H 69 4.134 4.134 4.005 0.129 18518
10478 1 16 . 1 1 69 69 ARG C C 69 180.262 180.262 178.175 2.087 18518
10479 1 16 . 1 1 69 69 ARG CA C 69 58.707 58.707 58.996 -0.289 18518
10480 1 16 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.060 -0.107 18518
10481 1 16 . 1 1 69 69 ARG H H 69 7.497 7.497 8.355 -0.858 18518
10482 1 16 . 1 1 70 70 ARG N N 70 123.297 123.297 117.304 5.993 18518
10483 1 16 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.175 -0.159 18518
10484 1 16 . 1 1 70 70 ARG C C 70 178.700 178.700 178.345 0.355 18518
10485 1 16 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.263 1.197 18518
10486 1 16 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.761 0.551 18518
10487 1 16 . 1 1 70 70 ARG H H 70 8.075 8.075 7.847 0.228 18518
10488 1 16 . 1 1 71 71 LEU N N 71 116.829 116.829 119.193 -2.364 18518
10489 1 16 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.073 -0.008 18518
10490 1 16 . 1 1 71 71 LEU C C 71 174.956 174.956 176.735 -1.779 18518
10491 1 16 . 1 1 71 71 LEU CA C 71 55.126 55.126 56.360 -1.234 18518
10492 1 16 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.306 0.940 18518
10493 1 16 . 1 1 71 71 LEU H H 71 7.719 7.719 7.705 0.014 18518
10494 1 16 . 1 1 72 72 GLN N N 72 114.991 114.991 114.137 0.854 18518
10495 1 16 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.860 -0.024 18518
10496 1 16 . 1 1 72 72 GLN C C 72 175.683 175.683 175.417 0.266 18518
10497 1 16 . 1 1 72 72 GLN CA C 72 56.325 56.325 55.972 0.353 18518
10498 1 16 . 1 1 72 72 GLN CB C 72 26.004 26.004 26.091 -0.087 18518
10499 1 16 . 1 1 72 72 GLN H H 72 7.744 7.744 8.017 -0.273 18518
10500 1 16 . 1 1 73 73 LEU N N 73 115.045 115.045 117.974 -2.929 18518
10501 1 16 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.179 0.057 18518
10502 1 16 . 1 1 73 73 LEU C C 73 178.762 178.762 177.743 1.019 18518
10503 1 16 . 1 1 73 73 LEU CA C 73 54.386 54.386 54.264 0.122 18518
10504 1 16 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.824 0.267 18518
10505 1 16 . 1 1 73 73 LEU H H 73 7.500 7.500 7.768 -0.268 18518
10506 1 16 . 1 1 74 74 ASN N N 74 121.700 121.700 118.505 3.195 18518
10507 1 16 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.539 0.151 18518
10508 1 16 . 1 1 74 74 ASN C C 74 176.617 176.617 175.863 0.754 18518
10509 1 16 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.625 -0.940 18518
10510 1 16 . 1 1 74 74 ASN CB C 74 39.598 39.598 40.023 -0.425 18518
10511 1 16 . 1 1 74 74 ASN H H 74 9.045 9.045 8.288 0.757 18518
10512 1 16 . 1 1 75 75 ALA N N 75 123.952 123.952 121.898 2.054 18518
10513 1 16 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.238 -0.274 18518
10514 1 16 . 1 1 75 75 ALA C C 75 178.131 178.131 177.792 0.339 18518
10515 1 16 . 1 1 75 75 ALA CA C 75 54.868 54.868 54.448 0.420 18518
10516 1 16 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.251 -0.533 18518
10517 1 16 . 1 1 75 75 ALA H H 75 8.784 8.784 8.506 0.278 18518
10518 1 16 . 1 1 76 76 ASN N N 76 112.295 112.295 114.624 -2.329 18518
10519 1 16 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.658 -0.078 18518
10520 1 16 . 1 1 76 76 ASN C C 76 175.448 175.448 175.089 0.359 18518
10521 1 16 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.388 -0.174 18518
10522 1 16 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.966 -0.646 18518
10523 1 16 . 1 1 76 76 ASN H H 76 8.391 8.391 8.329 0.062 18518
10524 1 16 . 1 1 77 77 GLN N N 77 120.577 120.577 118.910 1.667 18518
10525 1 16 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.534 -0.261 18518
10526 1 16 . 1 1 77 77 GLN C C 77 175.045 175.045 174.391 0.654 18518
10527 1 16 . 1 1 77 77 GLN CA C 77 55.805 55.805 55.372 0.433 18518
10528 1 16 . 1 1 77 77 GLN CB C 77 30.157 30.157 29.590 0.567 18518
10529 1 16 . 1 1 77 77 GLN H H 77 7.552 7.552 7.602 -0.050 18518
10530 1 16 . 1 1 78 78 ALA N N 78 130.670 130.670 127.519 3.151 18518
10531 1 16 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.554 -0.383 18518
10532 1 16 . 1 1 78 78 ALA C C 78 176.512 176.512 175.770 0.742 18518
10533 1 16 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.463 1.379 18518
10534 1 16 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.319 -1.258 18518
10535 1 16 . 1 1 78 78 ALA H H 78 8.799 8.799 8.664 0.135 18518
10536 1 16 . 1 1 79 79 PHE N N 79 119.325 119.325 115.865 3.460 18518
10537 1 16 . 1 1 79 79 PHE HA H 79 4.434 4.434 5.061 -0.627 18518
10538 1 16 . 1 1 79 79 PHE C C 79 171.726 171.726 172.986 -1.260 18518
10539 1 16 . 1 1 79 79 PHE CA C 79 59.145 59.145 55.689 3.456 18518
10540 1 16 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.296 0.875 18518
10541 1 16 . 1 1 79 79 PHE H H 79 7.664 7.664 8.238 -0.574 18518
10542 1 16 . 1 1 80 80 PHE N N 80 126.314 126.314 117.115 9.199 18518
10543 1 16 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.354 0.038 18518
10544 1 16 . 1 1 80 80 PHE C C 80 177.169 177.169 173.213 3.956 18518
10545 1 16 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.561 0.092 18518
10546 1 16 . 1 1 80 80 PHE CB C 80 41.933 41.933 42.962 -1.029 18518
10547 1 16 . 1 1 80 80 PHE H H 80 8.508 8.508 8.866 -0.358 18518
10548 1 16 . 1 1 81 81 LEU N N 81 121.426 121.426 123.923 -2.497 18518
10549 1 16 . 1 1 81 81 LEU HA H 81 4.851 4.851 4.973 -0.122 18518
10550 1 16 . 1 1 81 81 LEU C C 81 174.488 174.488 174.760 -0.272 18518
10551 1 16 . 1 1 81 81 LEU CA C 81 53.197 53.197 54.412 -1.215 18518
10552 1 16 . 1 1 81 81 LEU CB C 81 45.100 45.100 43.403 1.697 18518
10553 1 16 . 1 1 81 81 LEU H H 81 8.229 8.229 8.349 -0.120 18518
10554 1 16 . 1 1 82 82 LEU N N 82 125.155 125.155 126.822 -1.667 18518
10555 1 16 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.689 0.144 18518
10556 1 16 . 1 1 82 82 LEU C C 82 177.166 177.166 176.311 0.855 18518
10557 1 16 . 1 1 82 82 LEU CA C 82 54.197 54.197 53.260 0.937 18518
10558 1 16 . 1 1 82 82 LEU CB C 82 43.442 43.442 43.894 -0.452 18518
10559 1 16 . 1 1 82 82 LEU H H 82 9.400 9.400 9.104 0.296 18518
10560 1 16 . 1 1 83 83 VAL N N 83 123.886 123.886 120.793 3.093 18518
10561 1 16 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.296 0.083 18518
10562 1 16 . 1 1 83 83 VAL C C 83 175.810 175.810 176.420 -0.610 18518
10563 1 16 . 1 1 83 83 VAL CA C 83 61.677 61.677 62.494 -0.817 18518
10564 1 16 . 1 1 83 83 VAL CB C 83 33.758 33.758 32.191 1.567 18518
10565 1 16 . 1 1 83 83 VAL H H 83 8.721 8.721 7.853 0.868 18518
10566 1 16 . 1 1 84 84 ASN N N 84 126.474 126.474 127.026 -0.552 18518
10567 1 16 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.489 -0.093 18518
10568 1 16 . 1 1 84 84 ASN C C 84 175.164 175.164 174.915 0.249 18518
10569 1 16 . 1 1 84 84 ASN CA C 84 54.738 54.738 55.001 -0.263 18518
10570 1 16 . 1 1 84 84 ASN CB C 84 37.950 37.950 37.533 0.417 18518
10571 1 16 . 1 1 84 84 ASN H H 84 9.707 9.707 9.420 0.287 18518
10572 1 16 . 1 1 85 85 GLY N N 85 101.296 101.296 105.047 -3.751 18518
10573 1 16 . 1 1 85 85 GLY C C 85 173.680 173.680 172.219 1.461 18518
10574 1 16 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.724 0.879 18518
10575 1 16 . 1 1 85 85 GLY H H 85 8.644 8.644 8.187 0.457 18518
10576 1 16 . 1 1 86 86 HIS N N 86 117.238 117.238 117.398 -0.160 18518
10577 1 16 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.753 0.264 18518
10578 1 16 . 1 1 86 86 HIS C C 86 173.841 173.841 173.865 -0.024 18518
10579 1 16 . 1 1 86 86 HIS CA C 86 53.796 53.796 53.602 0.194 18518
10580 1 16 . 1 1 86 86 HIS CB C 86 31.280 31.280 32.229 -0.949 18518
10581 1 16 . 1 1 86 86 HIS H H 86 7.918 7.918 8.149 -0.231 18518
10582 1 16 . 1 1 87 87 SER N N 87 118.179 118.179 120.482 -2.303 18518
10583 1 16 . 1 1 87 87 SER HA H 87 4.699 4.699 4.457 0.242 18518
10584 1 16 . 1 1 87 87 SER C C 87 175.904 175.904 174.320 1.584 18518
10585 1 16 . 1 1 87 87 SER CA C 87 58.271 58.271 59.466 -1.195 18518
10586 1 16 . 1 1 87 87 SER CB C 87 63.735 63.735 62.288 1.447 18518
10587 1 16 . 1 1 87 87 SER H H 87 8.977 8.977 8.837 0.140 18518
10588 1 16 . 1 1 88 88 MET N N 88 125.472 125.472 123.569 1.903 18518
10589 1 16 . 1 1 88 88 MET HA H 88 4.830 4.830 4.490 0.340 18518
10590 1 16 . 1 1 88 88 MET C C 88 176.419 176.419 175.217 1.202 18518
10591 1 16 . 1 1 88 88 MET CA C 88 54.899 54.899 55.575 -0.676 18518
10592 1 16 . 1 1 88 88 MET CB C 88 33.336 33.336 33.220 0.116 18518
10593 1 16 . 1 1 88 88 MET H H 88 9.184 9.184 8.177 1.007 18518
10594 1 16 . 1 1 89 89 VAL N N 89 120.747 120.747 119.250 1.497 18518
10595 1 16 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.303 -0.071 18518
10596 1 16 . 1 1 89 89 VAL C C 89 175.958 175.958 173.898 2.060 18518
10597 1 16 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.155 1.999 18518
10598 1 16 . 1 1 89 89 VAL CB C 89 31.878 31.878 35.681 -3.803 18518
10599 1 16 . 1 1 89 89 VAL H H 89 8.233 8.233 7.302 0.931 18518
10600 1 16 . 1 1 90 90 SER N N 90 117.362 117.362 117.424 -0.062 18518
10601 1 16 . 1 1 90 90 SER HA H 90 4.590 4.590 4.869 -0.279 18518
10602 1 16 . 1 1 90 90 SER C C 90 175.741 175.741 176.057 -0.316 18518
10603 1 16 . 1 1 90 90 SER CA C 90 57.717 57.717 56.250 1.467 18518
10604 1 16 . 1 1 90 90 SER CB C 90 63.223 63.223 64.502 -1.279 18518
10605 1 16 . 1 1 90 90 SER H H 90 8.482 8.482 8.434 0.048 18518
10606 1 16 . 1 1 91 91 VAL N N 91 120.466 120.466 121.528 -1.062 18518
10607 1 16 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.942 0.105 18518
10608 1 16 . 1 1 91 91 VAL C C 91 176.329 176.329 176.349 -0.020 18518
10609 1 16 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.710 -1.218 18518
10610 1 16 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.418 1.150 18518
10611 1 16 . 1 1 91 91 VAL H H 91 8.188 8.188 8.670 -0.482 18518
10612 1 16 . 1 1 92 92 SER N N 92 116.398 116.398 115.596 0.802 18518
10613 1 16 . 1 1 92 92 SER HA H 92 4.636 4.636 4.424 0.212 18518
10614 1 16 . 1 1 92 92 SER C C 92 174.159 174.159 174.575 -0.416 18518
10615 1 16 . 1 1 92 92 SER CA C 92 57.805 57.805 59.543 -1.738 18518
10616 1 16 . 1 1 92 92 SER CB C 92 63.046 63.046 63.391 -0.345 18518
10617 1 16 . 1 1 92 92 SER H H 92 8.370 8.370 8.200 0.170 18518
10618 1 16 . 1 1 93 93 THR N N 93 119.211 119.211 120.412 -1.201 18518
10619 1 16 . 1 1 93 93 THR HA H 93 4.484 4.484 4.552 -0.068 18518
10620 1 16 . 1 1 93 93 THR CA C 93 60.884 60.884 61.388 -0.504 18518
10621 1 16 . 1 1 93 93 THR CB C 93 70.609 70.609 68.982 1.627 18518
10622 1 16 . 1 1 93 93 THR H H 93 7.416 7.416 7.429 -0.013 18518
10623 1 16 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.605 -0.165 18518
10624 1 16 . 1 1 94 94 PRO C C 94 178.775 178.775 177.494 1.281 18518
10625 1 16 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.670 0.273 18518
10626 1 16 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.502 0.147 18518
10627 1 16 . 1 1 95 95 ILE N N 95 124.174 124.174 123.566 0.608 18518
10628 1 16 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.795 0.154 18518
10629 1 16 . 1 1 95 95 ILE C C 95 176.498 176.498 177.151 -0.653 18518
10630 1 16 . 1 1 95 95 ILE CA C 95 63.904 63.904 63.628 0.276 18518
10631 1 16 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.222 -0.040 18518
10632 1 16 . 1 1 95 95 ILE H H 95 9.305 9.305 8.586 0.719 18518
10633 1 16 . 1 1 96 96 SER N N 96 116.920 116.920 116.415 0.505 18518
10634 1 16 . 1 1 96 96 SER HA H 96 4.029 4.029 4.017 0.012 18518
10635 1 16 . 1 1 96 96 SER C C 96 176.574 176.574 176.155 0.419 18518
10636 1 16 . 1 1 96 96 SER CA C 96 61.356 61.356 62.388 -1.032 18518
10637 1 16 . 1 1 96 96 SER CB C 96 61.723 61.723 62.749 -1.026 18518
10638 1 16 . 1 1 96 96 SER H H 96 8.335 8.335 8.218 0.117 18518
10639 1 16 . 1 1 97 97 GLU N N 97 123.255 123.255 121.157 2.098 18518
10640 1 16 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.201 0.077 18518
10641 1 16 . 1 1 97 97 GLU C C 97 179.716 179.716 179.182 0.534 18518
10642 1 16 . 1 1 97 97 GLU CA C 97 58.792 58.792 59.074 -0.282 18518
10643 1 16 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.232 0.330 18518
10644 1 16 . 1 1 97 97 GLU H H 97 7.376 7.376 7.875 -0.499 18518
10645 1 16 . 1 1 98 98 VAL N N 98 121.137 121.137 120.833 0.304 18518
10646 1 16 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.677 0.125 18518
10647 1 16 . 1 1 98 98 VAL C C 98 177.637 177.637 177.952 -0.315 18518
10648 1 16 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.394 -0.570 18518
10649 1 16 . 1 1 98 98 VAL CB C 98 32.154 32.154 30.804 1.350 18518
10650 1 16 . 1 1 98 98 VAL H H 98 7.387 7.387 7.980 -0.593 18518
10651 1 16 . 1 1 99 99 TYR N N 99 118.927 118.927 121.665 -2.738 18518
10652 1 16 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.061 -0.071 18518
10653 1 16 . 1 1 99 99 TYR C C 99 176.081 176.081 176.893 -0.812 18518
10654 1 16 . 1 1 99 99 TYR CA C 99 62.223 62.223 62.252 -0.029 18518
10655 1 16 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.678 0.304 18518
10656 1 16 . 1 1 99 99 TYR H H 99 9.048 9.048 8.479 0.570 18518
10657 1 16 . 1 1 100 100 GLU N N 100 113.894 113.894 116.495 -2.601 18518
10658 1 16 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.898 -0.052 18518
10659 1 16 . 1 1 100 100 GLU C C 100 177.989 177.989 177.881 0.108 18518
10660 1 16 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.422 0.665 18518
10661 1 16 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.994 0.388 18518
10662 1 16 . 1 1 100 100 GLU H H 100 7.422 7.422 8.263 -0.841 18518
10663 1 16 . 1 1 101 101 SER N N 101 108.991 108.991 114.352 -5.361 18518
10664 1 16 . 1 1 101 101 SER HA H 101 4.524 4.524 4.452 0.072 18518
10665 1 16 . 1 1 101 101 SER C C 101 176.628 176.628 175.380 1.248 18518
10666 1 16 . 1 1 101 101 SER CA C 101 60.349 60.349 60.288 0.061 18518
10667 1 16 . 1 1 101 101 SER CB C 101 64.741 64.741 64.040 0.702 18518
10668 1 16 . 1 1 101 101 SER H H 101 7.424 7.424 7.911 -0.487 18518
10669 1 16 . 1 1 102 102 GLU N N 102 116.533 116.533 118.184 -1.651 18518
10670 1 16 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.531 0.213 18518
10671 1 16 . 1 1 102 102 GLU C C 102 176.774 176.774 176.003 0.771 18518
10672 1 16 . 1 1 102 102 GLU CA C 102 55.581 55.581 54.877 0.704 18518
10673 1 16 . 1 1 102 102 GLU CB C 102 30.697 30.697 30.408 0.289 18518
10674 1 16 . 1 1 102 102 GLU H H 102 8.487 8.487 7.960 0.527 18518
10675 1 16 . 1 1 103 103 LYS N N 103 118.370 118.370 120.263 -1.893 18518
10676 1 16 . 1 1 103 103 LYS HA H 103 4.178 4.178 3.832 0.346 18518
10677 1 16 . 1 1 103 103 LYS C C 103 175.018 175.018 176.753 -1.735 18518
10678 1 16 . 1 1 103 103 LYS CA C 103 57.329 57.329 56.809 0.520 18518
10679 1 16 . 1 1 103 103 LYS CB C 103 32.186 32.186 31.502 0.684 18518
10680 1 16 . 1 1 103 103 LYS H H 103 7.831 7.831 7.536 0.295 18518
10681 1 16 . 1 1 104 104 ASP N N 104 123.500 123.500 124.419 -0.919 18518
10682 1 16 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.550 0.205 18518
10683 1 16 . 1 1 104 104 ASP C C 104 177.383 177.383 178.071 -0.688 18518
10684 1 16 . 1 1 104 104 ASP CA C 104 53.846 53.846 53.740 0.105 18518
10685 1 16 . 1 1 104 104 ASP CB C 104 43.411 43.411 42.616 0.795 18518
10686 1 16 . 1 1 104 104 ASP H H 104 9.041 9.041 7.947 1.094 18518
10687 1 16 . 1 1 105 105 GLU N N 105 125.448 125.448 120.649 4.799 18518
10688 1 16 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.090 0.090 18518
10689 1 16 . 1 1 105 105 GLU C C 105 177.519 177.519 176.399 1.120 18518
10690 1 16 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.864 0.666 18518
10691 1 16 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.457 0.587 18518
10692 1 16 . 1 1 105 105 GLU H H 105 8.906 8.906 8.834 0.072 18518
10693 1 16 . 1 1 106 106 ASP N N 106 118.824 118.824 117.976 0.848 18518
10694 1 16 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.646 -0.467 18518
10695 1 16 . 1 1 106 106 ASP C C 106 176.223 176.223 177.056 -0.833 18518
10696 1 16 . 1 1 106 106 ASP CA C 106 54.756 54.756 54.311 0.445 18518
10697 1 16 . 1 1 106 106 ASP CB C 106 39.999 39.999 41.026 -1.026 18518
10698 1 16 . 1 1 106 106 ASP H H 106 10.036 10.036 8.191 1.845 18518
10699 1 16 . 1 1 107 107 GLY N N 107 105.866 105.866 106.915 -1.049 18518
10700 1 16 . 1 1 107 107 GLY C C 107 175.136 175.136 173.984 1.152 18518
10701 1 16 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.515 -0.293 18518
10702 1 16 . 1 1 107 107 GLY H H 107 8.001 8.001 7.832 0.169 18518
10703 1 16 . 1 1 108 108 PHE N N 108 123.820 123.820 119.421 4.399 18518
10704 1 16 . 1 1 108 108 PHE HA H 108 4.662 4.662 5.176 -0.514 18518
10705 1 16 . 1 1 108 108 PHE C C 108 174.899 174.899 174.658 0.241 18518
10706 1 16 . 1 1 108 108 PHE CA C 108 60.238 60.238 57.590 2.648 18518
10707 1 16 . 1 1 108 108 PHE CB C 108 40.365 40.365 41.377 -1.012 18518
10708 1 16 . 1 1 108 108 PHE H H 108 9.912 9.912 7.864 2.048 18518
10709 1 16 . 1 1 109 109 LEU N N 109 120.130 120.130 121.418 -1.288 18518
10710 1 16 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.844 0.186 18518
10711 1 16 . 1 1 109 109 LEU C C 109 173.916 173.916 174.735 -0.819 18518
10712 1 16 . 1 1 109 109 LEU CA C 109 53.424 53.424 54.163 -0.739 18518
10713 1 16 . 1 1 109 109 LEU CB C 109 45.203 45.203 44.871 0.332 18518
10714 1 16 . 1 1 109 109 LEU H H 109 7.997 7.997 8.789 -0.792 18518
10715 1 16 . 1 1 110 110 TYR N N 110 126.579 126.579 127.198 -0.619 18518
10716 1 16 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.878 0.125 18518
10717 1 16 . 1 1 110 110 TYR C C 110 176.671 176.671 175.339 1.332 18518
10718 1 16 . 1 1 110 110 TYR CA C 110 59.058 59.058 57.153 1.905 18518
10719 1 16 . 1 1 110 110 TYR CB C 110 39.556 39.556 39.249 0.307 18518
10720 1 16 . 1 1 110 110 TYR H H 110 9.377 9.377 8.976 0.401 18518
10721 1 16 . 1 1 111 111 MET N N 111 119.240 119.240 122.028 -2.788 18518
10722 1 16 . 1 1 111 111 MET HA H 111 5.486 5.486 5.164 0.322 18518
10723 1 16 . 1 1 111 111 MET C C 111 175.695 175.695 174.490 1.205 18518
10724 1 16 . 1 1 111 111 MET CA C 111 54.124 54.124 54.807 -0.683 18518
10725 1 16 . 1 1 111 111 MET CB C 111 36.960 36.960 37.637 -0.677 18518
10726 1 16 . 1 1 111 111 MET H H 111 9.658 9.658 9.228 0.430 18518
10727 1 16 . 1 1 112 112 VAL N N 112 119.865 119.865 119.172 0.693 18518
10728 1 16 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.423 0.540 18518
10729 1 16 . 1 1 112 112 VAL C C 112 175.058 175.058 174.684 0.374 18518
10730 1 16 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.879 -0.968 18518
10731 1 16 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.225 0.826 18518
10732 1 16 . 1 1 112 112 VAL H H 112 8.794 8.794 9.151 -0.357 18518
10733 1 16 . 1 1 113 113 TYR N N 113 119.664 119.664 121.076 -1.412 18518
10734 1 16 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.615 0.503 18518
10735 1 16 . 1 1 113 113 TYR C C 113 173.375 173.375 173.352 0.023 18518
10736 1 16 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.292 -1.139 18518
10737 1 16 . 1 1 113 113 TYR CB C 113 43.312 43.312 42.017 1.295 18518
10738 1 16 . 1 1 113 113 TYR H H 113 8.315 8.315 8.572 -0.257 18518
10739 1 16 . 1 1 114 114 ALA N N 114 119.763 119.763 122.884 -3.121 18518
10740 1 16 . 1 1 114 114 ALA HA H 114 4.800 4.800 5.056 -0.256 18518
10741 1 16 . 1 1 114 114 ALA C C 114 176.216 176.216 175.382 0.834 18518
10742 1 16 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.780 -0.648 18518
10743 1 16 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.287 2.309 18518
10744 1 16 . 1 1 114 114 ALA H H 114 8.465 8.465 8.980 -0.515 18518
10745 1 16 . 1 1 115 115 SER N N 115 114.763 114.763 116.406 -1.643 18518
10746 1 16 . 1 1 115 115 SER HA H 115 4.496 4.496 4.877 -0.381 18518
10747 1 16 . 1 1 115 115 SER C C 115 172.671 172.671 173.788 -1.117 18518
10748 1 16 . 1 1 115 115 SER CA C 115 58.651 58.651 58.064 0.587 18518
10749 1 16 . 1 1 115 115 SER CB C 115 63.526 63.526 61.714 1.812 18518
10750 1 16 . 1 1 115 115 SER H H 115 9.915 9.915 9.116 0.799 18518
10751 1 16 . 1 1 116 116 GLN N N 116 116.611 116.611 125.161 -8.550 18518
10752 1 16 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.312 0.172 18518
10753 1 16 . 1 1 116 116 GLN C C 116 172.733 172.733 173.869 -1.136 18518
10754 1 16 . 1 1 116 116 GLN CA C 116 53.926 53.926 56.218 -2.292 18518
10755 1 16 . 1 1 116 116 GLN CB C 116 32.358 32.358 30.981 1.377 18518
10756 1 16 . 1 1 116 116 GLN H H 116 7.219 7.219 7.989 -0.770 18518
10757 1 16 . 1 1 117 117 GLU N N 117 117.623 117.623 122.543 -4.920 18518
10758 1 16 . 1 1 117 117 GLU HA H 117 3.287 3.287 2.372 0.915 18518
10759 1 16 . 1 1 117 117 GLU C C 117 175.168 175.168 175.366 -0.198 18518
10760 1 16 . 1 1 117 117 GLU CA C 117 56.882 56.882 57.750 -0.868 18518
10761 1 16 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.365 1.157 18518
10762 1 16 . 1 1 117 117 GLU H H 117 7.882 7.882 8.356 -0.474 18518
10763 1 16 . 1 1 118 118 THR N N 118 109.820 109.820 110.725 -0.905 18518
10764 1 16 . 1 1 118 118 THR HA H 118 4.066 4.066 4.021 0.045 18518
10765 1 16 . 1 1 118 118 THR C C 118 172.355 172.355 173.183 -0.828 18518
10766 1 16 . 1 1 118 118 THR CA C 118 60.029 60.029 60.614 -0.585 18518
10767 1 16 . 1 1 118 118 THR CB C 118 70.480 70.480 68.571 1.909 18518
10768 1 16 . 1 1 118 118 THR H H 118 6.992 6.992 7.217 -0.225 18518
10769 1 17 . 1 1 2 2 ALA HA H 2 4.336 4.336 5.281 -0.945 18518
10770 1 17 . 1 1 2 2 ALA C C 2 177.974 177.974 176.734 1.240 18518
10771 1 17 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.234 1.551 18518
10772 1 17 . 1 1 2 2 ALA CB C 2 19.444 19.444 20.248 -0.804 18518
10773 1 17 . 1 1 3 3 MET N N 3 119.311 119.311 119.237 0.074 18518
10774 1 17 . 1 1 3 3 MET HA H 3 4.451 4.451 4.936 -0.485 18518
10775 1 17 . 1 1 3 3 MET C C 3 176.913 176.913 176.094 0.819 18518
10776 1 17 . 1 1 3 3 MET CA C 3 55.679 55.679 54.931 0.748 18518
10777 1 17 . 1 1 3 3 MET CB C 3 32.590 32.590 34.825 -2.235 18518
10778 1 17 . 1 1 3 3 MET H H 3 8.638 8.638 9.015 -0.377 18518
10779 1 17 . 1 1 4 4 GLY N N 4 110.281 110.281 109.298 0.983 18518
10780 1 17 . 1 1 4 4 GLY C C 4 174.180 174.180 173.346 0.834 18518
10781 1 17 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.566 0.929 18518
10782 1 17 . 1 1 4 4 GLY H H 4 8.552 8.552 8.405 0.147 18518
10783 1 17 . 1 1 5 5 LYS N N 5 120.818 120.818 120.601 0.217 18518
10784 1 17 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.188 0.321 18518
10785 1 17 . 1 1 5 5 LYS C C 5 177.605 177.605 176.218 1.387 18518
10786 1 17 . 1 1 5 5 LYS CA C 5 56.134 56.134 56.089 0.045 18518
10787 1 17 . 1 1 5 5 LYS CB C 5 34.813 34.813 31.975 2.838 18518
10788 1 17 . 1 1 5 5 LYS H H 5 8.133 8.133 8.261 -0.128 18518
10789 1 17 . 1 1 6 6 THR N N 6 114.781 114.781 114.693 0.088 18518
10790 1 17 . 1 1 6 6 THR HA H 6 4.421 4.421 4.343 0.078 18518
10791 1 17 . 1 1 6 6 THR C C 6 175.524 175.524 175.789 -0.265 18518
10792 1 17 . 1 1 6 6 THR CA C 6 61.127 61.127 61.143 -0.016 18518
10793 1 17 . 1 1 6 6 THR CB C 6 69.926 69.926 70.241 -0.315 18518
10794 1 17 . 1 1 6 6 THR H H 6 8.483 8.483 7.880 0.603 18518
10795 1 17 . 1 1 7 7 PHE N N 7 125.552 125.552 119.892 5.660 18518
10796 1 17 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.110 -0.105 18518
10797 1 17 . 1 1 7 7 PHE C C 7 177.397 177.397 176.737 0.660 18518
10798 1 17 . 1 1 7 7 PHE CA C 7 63.393 63.393 60.773 2.619 18518
10799 1 17 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.139 1.428 18518
10800 1 17 . 1 1 7 7 PHE H H 7 10.245 10.245 9.022 1.223 18518
10801 1 17 . 1 1 8 8 LYS N N 8 114.053 114.053 118.698 -4.645 18518
10802 1 17 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.762 0.073 18518
10803 1 17 . 1 1 8 8 LYS C C 8 175.520 175.520 179.234 -3.714 18518
10804 1 17 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.872 1.121 18518
10805 1 17 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.690 1.999 18518
10806 1 17 . 1 1 8 8 LYS H H 8 8.775 8.775 6.557 2.218 18518
10807 1 17 . 1 1 9 9 GLN N N 9 113.516 113.516 117.387 -3.871 18518
10808 1 17 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.025 0.124 18518
10809 1 17 . 1 1 9 9 GLN C C 9 177.615 177.615 177.539 0.076 18518
10810 1 17 . 1 1 9 9 GLN CA C 9 56.819 56.819 58.479 -1.660 18518
10811 1 17 . 1 1 9 9 GLN CB C 9 30.019 30.019 28.882 1.137 18518
10812 1 17 . 1 1 9 9 GLN H H 9 7.355 7.355 7.301 0.054 18518
10813 1 17 . 1 1 10 10 ARG N N 10 118.294 118.294 115.759 2.535 18518
10814 1 17 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.235 0.067 18518
10815 1 17 . 1 1 10 10 ARG C C 10 179.380 179.380 176.593 2.787 18518
10816 1 17 . 1 1 10 10 ARG CA C 10 57.268 57.268 56.554 0.714 18518
10817 1 17 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.394 1.248 18518
10818 1 17 . 1 1 10 10 ARG H H 10 7.936 7.936 7.714 0.222 18518
10819 1 17 . 1 1 11 11 ARG N N 11 121.137 121.137 120.753 0.384 18518
10820 1 17 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.728 -0.048 18518
10821 1 17 . 1 1 11 11 ARG CA C 11 53.453 53.453 53.766 -0.313 18518
10822 1 17 . 1 1 11 11 ARG CB C 11 32.938 32.938 32.452 0.486 18518
10823 1 17 . 1 1 11 11 ARG H H 11 7.390 7.390 7.462 -0.072 18518
10824 1 17 . 1 1 12 12 THR N N 12 116.819 116.819 120.854 -4.035 18518
10825 1 17 . 1 1 12 12 THR HA H 12 4.359 4.359 4.273 0.086 18518
10826 1 17 . 1 1 12 12 THR C C 12 174.989 174.989 175.657 -0.668 18518
10827 1 17 . 1 1 12 12 THR CA C 12 61.748 61.748 63.556 -1.808 18518
10828 1 17 . 1 1 12 12 THR CB C 12 71.068 71.068 69.637 1.431 18518
10829 1 17 . 1 1 12 12 THR H H 12 8.953 8.953 8.803 0.150 18518
10830 1 17 . 1 1 13 13 PHE N N 13 123.200 123.200 123.739 -0.539 18518
10831 1 17 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.180 -0.152 18518
10832 1 17 . 1 1 13 13 PHE C C 13 176.029 176.029 176.912 -0.883 18518
10833 1 17 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.785 0.079 18518
10834 1 17 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.249 0.311 18518
10835 1 17 . 1 1 13 13 PHE H H 13 9.284 9.284 8.850 0.434 18518
10836 1 17 . 1 1 14 14 GLU N N 14 115.414 115.414 118.364 -2.950 18518
10837 1 17 . 1 1 14 14 GLU HA H 14 3.794 3.794 4.059 -0.265 18518
10838 1 17 . 1 1 14 14 GLU C C 14 180.081 180.081 179.114 0.967 18518
10839 1 17 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.977 0.642 18518
10840 1 17 . 1 1 14 14 GLU CB C 14 28.852 28.852 28.411 0.441 18518
10841 1 17 . 1 1 14 14 GLU H H 14 8.973 8.973 8.858 0.115 18518
10842 1 17 . 1 1 15 15 GLN N N 15 119.276 119.276 118.778 0.498 18518
10843 1 17 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.069 -0.069 18518
10844 1 17 . 1 1 15 15 GLN C C 15 177.978 177.978 178.760 -0.782 18518
10845 1 17 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.940 -0.105 18518
10846 1 17 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.102 1.268 18518
10847 1 17 . 1 1 15 15 GLN H H 15 7.756 7.756 8.705 -0.949 18518
10848 1 17 . 1 1 16 16 ARG N N 16 121.336 121.336 119.481 1.855 18518
10849 1 17 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.221 0.049 18518
10850 1 17 . 1 1 16 16 ARG C C 16 177.416 177.416 178.804 -1.388 18518
10851 1 17 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.651 1.724 18518
10852 1 17 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.398 0.207 18518
10853 1 17 . 1 1 16 16 ARG H H 16 8.645 8.645 7.751 0.894 18518
10854 1 17 . 1 1 17 17 VAL N N 17 117.630 117.630 120.195 -2.565 18518
10855 1 17 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.582 0.275 18518
10856 1 17 . 1 1 17 17 VAL C C 17 179.748 179.748 178.123 1.625 18518
10857 1 17 . 1 1 17 17 VAL CA C 17 65.726 65.726 66.433 -0.708 18518
10858 1 17 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.643 0.551 18518
10859 1 17 . 1 1 17 17 VAL H H 17 8.373 8.373 8.076 0.297 18518
10860 1 17 . 1 1 18 18 GLU N N 18 120.864 120.864 119.901 0.963 18518
10861 1 17 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.939 0.363 18518
10862 1 17 . 1 1 18 18 GLU C C 18 177.728 177.728 178.837 -1.109 18518
10863 1 17 . 1 1 18 18 GLU CA C 18 58.486 58.486 60.136 -1.650 18518
10864 1 17 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.450 -0.068 18518
10865 1 17 . 1 1 18 18 GLU H H 18 7.368 7.368 8.664 -1.296 18518
10866 1 17 . 1 1 19 19 ASP N N 19 121.425 121.425 120.066 1.359 18518
10867 1 17 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.480 -0.046 18518
10868 1 17 . 1 1 19 19 ASP C C 19 179.978 179.978 178.816 1.162 18518
10869 1 17 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.405 0.017 18518
10870 1 17 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.859 0.428 18518
10871 1 17 . 1 1 19 19 ASP H H 19 8.671 8.671 7.871 0.800 18518
10872 1 17 . 1 1 20 20 VAL N N 20 119.730 119.730 120.461 -0.731 18518
10873 1 17 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.527 -0.322 18518
10874 1 17 . 1 1 20 20 VAL C C 20 176.284 176.284 177.055 -0.771 18518
10875 1 17 . 1 1 20 20 VAL CA C 20 66.315 66.315 65.635 0.681 18518
10876 1 17 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.203 -0.096 18518
10877 1 17 . 1 1 20 20 VAL H H 20 7.999 7.999 7.703 0.296 18518
10878 1 17 . 1 1 21 21 ARG N N 21 121.455 121.455 119.825 1.630 18518
10879 1 17 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.920 -0.106 18518
10880 1 17 . 1 1 21 21 ARG C C 21 180.120 180.120 178.609 1.511 18518
10881 1 17 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.940 0.890 18518
10882 1 17 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.187 0.759 18518
10883 1 17 . 1 1 21 21 ARG H H 21 8.098 8.098 8.214 -0.116 18518
10884 1 17 . 1 1 22 22 LEU N N 22 117.826 117.826 121.262 -3.436 18518
10885 1 17 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.035 0.014 18518
10886 1 17 . 1 1 22 22 LEU C C 22 180.115 180.115 178.492 1.623 18518
10887 1 17 . 1 1 22 22 LEU CA C 22 57.790 57.790 57.880 -0.090 18518
10888 1 17 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.754 0.388 18518
10889 1 17 . 1 1 22 22 LEU H H 22 8.207 8.207 7.840 0.367 18518
10890 1 17 . 1 1 23 23 ILE N N 23 121.450 121.450 119.067 2.383 18518
10891 1 17 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.678 0.335 18518
10892 1 17 . 1 1 23 23 ILE C C 23 178.149 178.149 178.396 -0.247 18518
10893 1 17 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.167 -1.996 18518
10894 1 17 . 1 1 23 23 ILE CB C 23 38.106 38.106 36.679 1.427 18518
10895 1 17 . 1 1 23 23 ILE H H 23 8.105 8.105 7.988 0.117 18518
10896 1 17 . 1 1 24 24 ARG N N 24 121.139 121.139 118.604 2.535 18518
10897 1 17 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.099 -0.112 18518
10898 1 17 . 1 1 24 24 ARG C C 24 178.702 178.702 179.027 -0.325 18518
10899 1 17 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.943 -1.225 18518
10900 1 17 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.675 -0.906 18518
10901 1 17 . 1 1 24 24 ARG H H 24 8.601 8.601 8.462 0.139 18518
10902 1 17 . 1 1 25 25 GLU N N 25 118.054 118.054 119.452 -1.398 18518
10903 1 17 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.156 -0.130 18518
10904 1 17 . 1 1 25 25 GLU C C 25 178.492 178.492 178.256 0.236 18518
10905 1 17 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.443 0.337 18518
10906 1 17 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.541 0.460 18518
10907 1 17 . 1 1 25 25 GLU H H 25 7.423 7.423 7.771 -0.348 18518
10908 1 17 . 1 1 26 26 GLN N N 26 116.350 116.350 116.647 -0.297 18518
10909 1 17 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.034 -0.098 18518
10910 1 17 . 1 1 26 26 GLN C C 26 176.305 176.305 176.813 -0.508 18518
10911 1 17 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.303 0.200 18518
10912 1 17 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.261 0.946 18518
10913 1 17 . 1 1 26 26 GLN H H 26 7.524 7.524 7.819 -0.295 18518
10914 1 17 . 1 1 27 27 HIS N N 27 116.017 116.017 118.053 -2.036 18518
10915 1 17 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.159 -0.229 18518
10916 1 17 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.461 0.593 18518
10917 1 17 . 1 1 27 27 HIS CB C 27 30.747 30.747 30.447 0.300 18518
10918 1 17 . 1 1 27 27 HIS H H 27 8.284 8.284 8.135 0.149 18518
10919 1 17 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.684 -0.103 18518
10920 1 17 . 1 1 28 28 PRO CA C 28 64.919 64.919 63.940 0.979 18518
10921 1 17 . 1 1 28 28 PRO CB C 28 32.455 32.455 31.970 0.485 18518
10922 1 17 . 1 1 29 29 THR N N 29 107.011 107.011 106.141 0.870 18518
10923 1 17 . 1 1 29 29 THR HA H 29 4.599 4.599 4.556 0.043 18518
10924 1 17 . 1 1 29 29 THR C C 29 172.884 172.884 173.869 -0.985 18518
10925 1 17 . 1 1 29 29 THR CA C 29 60.810 60.810 61.561 -0.751 18518
10926 1 17 . 1 1 29 29 THR CB C 29 68.531 68.531 68.967 -0.436 18518
10927 1 17 . 1 1 29 29 THR H H 29 7.890 7.890 8.112 -0.222 18518
10928 1 17 . 1 1 30 30 LYS N N 30 117.679 117.679 121.236 -3.557 18518
10929 1 17 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.979 -0.121 18518
10930 1 17 . 1 1 30 30 LYS C C 30 174.310 174.310 174.898 -0.588 18518
10931 1 17 . 1 1 30 30 LYS CA C 30 53.751 53.751 54.144 -0.393 18518
10932 1 17 . 1 1 30 30 LYS CB C 30 35.804 35.804 36.435 -0.631 18518
10933 1 17 . 1 1 30 30 LYS H H 30 7.441 7.441 7.734 -0.293 18518
10934 1 17 . 1 1 31 31 ILE N N 31 122.849 122.849 122.261 0.588 18518
10935 1 17 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.497 -0.392 18518
10936 1 17 . 1 1 31 31 ILE CA C 31 54.801 54.801 58.276 -3.475 18518
10937 1 17 . 1 1 31 31 ILE CB C 31 38.265 38.265 39.459 -1.194 18518
10938 1 17 . 1 1 31 31 ILE H H 31 9.304 9.304 9.018 0.286 18518
10939 1 17 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.742 0.417 18518
10940 1 17 . 1 1 32 32 PRO C C 32 174.164 174.164 175.566 -1.402 18518
10941 1 17 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.331 -0.828 18518
10942 1 17 . 1 1 32 32 PRO CB C 32 31.145 31.145 31.163 -0.018 18518
10943 1 17 . 1 1 33 33 VAL N N 33 125.606 125.606 125.845 -0.239 18518
10944 1 17 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.141 0.072 18518
10945 1 17 . 1 1 33 33 VAL C C 33 173.654 173.654 173.831 -0.177 18518
10946 1 17 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.389 0.655 18518
10947 1 17 . 1 1 33 33 VAL CB C 33 35.604 35.604 36.292 -0.688 18518
10948 1 17 . 1 1 33 33 VAL H H 33 9.424 9.424 8.550 0.874 18518
10949 1 17 . 1 1 34 34 ILE N N 34 128.241 128.241 127.185 1.056 18518
10950 1 17 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.476 0.357 18518
10951 1 17 . 1 1 34 34 ILE C C 34 175.605 175.605 174.349 1.256 18518
10952 1 17 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.351 -1.586 18518
10953 1 17 . 1 1 34 34 ILE CB C 34 36.799 36.799 38.014 -1.215 18518
10954 1 17 . 1 1 34 34 ILE H H 34 8.721 8.721 9.078 -0.357 18518
10955 1 17 . 1 1 35 35 ILE N N 35 125.650 125.650 127.773 -2.123 18518
10956 1 17 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.763 0.073 18518
10957 1 17 . 1 1 35 35 ILE C C 35 174.887 174.887 174.340 0.547 18518
10958 1 17 . 1 1 35 35 ILE CA C 35 60.945 60.945 59.823 1.122 18518
10959 1 17 . 1 1 35 35 ILE CB C 35 39.210 39.210 40.943 -1.733 18518
10960 1 17 . 1 1 35 35 ILE H H 35 9.034 9.034 8.992 0.042 18518
10961 1 17 . 1 1 36 36 GLU N N 36 122.657 122.657 125.344 -2.687 18518
10962 1 17 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.799 0.062 18518
10963 1 17 . 1 1 36 36 GLU C C 36 173.848 173.848 174.357 -0.509 18518
10964 1 17 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.102 -0.170 18518
10965 1 17 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.092 1.190 18518
10966 1 17 . 1 1 36 36 GLU H H 36 8.303 8.303 8.675 -0.372 18518
10967 1 17 . 1 1 37 37 ARG N N 37 123.228 123.228 123.816 -0.588 18518
10968 1 17 . 1 1 37 37 ARG HA H 37 2.726 2.726 2.982 -0.256 18518
10969 1 17 . 1 1 37 37 ARG C C 37 176.359 176.359 175.572 0.787 18518
10970 1 17 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.195 0.164 18518
10971 1 17 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.768 0.573 18518
10972 1 17 . 1 1 37 37 ARG H H 37 8.856 8.856 8.436 0.420 18518
10973 1 17 . 1 1 38 38 TYR N N 38 128.981 128.981 127.982 0.999 18518
10974 1 17 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.196 0.156 18518
10975 1 17 . 1 1 38 38 TYR C C 38 177.316 177.316 176.267 1.049 18518
10976 1 17 . 1 1 38 38 TYR CA C 38 57.712 57.712 57.874 -0.162 18518
10977 1 17 . 1 1 38 38 TYR CB C 38 39.472 39.472 39.808 -0.336 18518
10978 1 17 . 1 1 38 38 TYR H H 38 8.628 8.628 8.258 0.370 18518
10979 1 17 . 1 1 39 39 LYS N N 39 130.635 130.635 127.132 3.503 18518
10980 1 17 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.801 0.021 18518
10981 1 17 . 1 1 39 39 LYS CA C 39 58.887 58.887 58.282 0.605 18518
10982 1 17 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.972 -0.201 18518
10983 1 17 . 1 1 39 39 LYS H H 39 8.594 8.594 8.440 0.154 18518
10984 1 17 . 1 1 40 40 GLY C C 40 173.447 173.447 174.128 -0.681 18518
10985 1 17 . 1 1 40 40 GLY CA C 40 44.663 44.663 43.985 0.678 18518
10986 1 17 . 1 1 40 40 GLY H H 40 5.188 5.188 6.382 -1.194 18518
10987 1 17 . 1 1 41 41 GLU N N 41 122.836 122.836 120.746 2.090 18518
10988 1 17 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.264 -0.007 18518
10989 1 17 . 1 1 41 41 GLU C C 41 176.524 176.524 176.262 0.262 18518
10990 1 17 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.591 -0.066 18518
10991 1 17 . 1 1 41 41 GLU CB C 41 30.985 30.985 29.555 1.431 18518
10992 1 17 . 1 1 41 41 GLU H H 41 7.380 7.380 7.668 -0.288 18518
10993 1 17 . 1 1 42 42 LYS N N 42 124.040 124.040 125.970 -1.930 18518
10994 1 17 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.467 0.208 18518
10995 1 17 . 1 1 42 42 LYS C C 42 177.538 177.538 176.867 0.671 18518
10996 1 17 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.644 -0.804 18518
10997 1 17 . 1 1 42 42 LYS CB C 42 34.979 34.979 32.921 2.058 18518
10998 1 17 . 1 1 42 42 LYS H H 42 9.034 9.034 8.462 0.572 18518
10999 1 17 . 1 1 43 43 GLN N N 43 119.259 119.259 117.671 1.588 18518
11000 1 17 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.433 0.109 18518
11001 1 17 . 1 1 43 43 GLN C C 43 177.336 177.336 176.227 1.109 18518
11002 1 17 . 1 1 43 43 GLN CA C 43 57.673 57.673 56.375 1.298 18518
11003 1 17 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.422 0.360 18518
11004 1 17 . 1 1 43 43 GLN H H 43 8.435 8.435 9.073 -0.638 18518
11005 1 17 . 1 1 44 44 LEU N N 44 120.760 120.760 124.121 -3.361 18518
11006 1 17 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.834 -0.139 18518
11007 1 17 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.641 0.604 18518
11008 1 17 . 1 1 44 44 LEU CB C 44 43.596 43.596 41.628 1.968 18518
11009 1 17 . 1 1 44 44 LEU H H 44 9.126 9.126 8.309 0.817 18518
11010 1 17 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.523 0.194 18518
11011 1 17 . 1 1 45 45 PRO C C 45 175.797 175.797 175.868 -0.071 18518
11012 1 17 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.334 -0.223 18518
11013 1 17 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.356 0.236 18518
11014 1 17 . 1 1 46 46 VAL N N 46 119.052 119.052 119.877 -0.825 18518
11015 1 17 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.410 -0.543 18518
11016 1 17 . 1 1 46 46 VAL C C 46 175.640 175.640 176.528 -0.888 18518
11017 1 17 . 1 1 46 46 VAL CA C 46 62.944 62.944 61.223 1.721 18518
11018 1 17 . 1 1 46 46 VAL CB C 46 32.799 32.799 33.406 -0.607 18518
11019 1 17 . 1 1 46 46 VAL H H 46 8.543 8.543 8.081 0.462 18518
11020 1 17 . 1 1 47 47 LEU N N 47 130.203 130.203 126.740 3.463 18518
11021 1 17 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.539 -0.230 18518
11022 1 17 . 1 1 47 47 LEU C C 47 176.198 176.198 177.421 -1.223 18518
11023 1 17 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.004 0.002 18518
11024 1 17 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.676 1.156 18518
11025 1 17 . 1 1 47 47 LEU H H 47 7.799 7.799 8.586 -0.787 18518
11026 1 17 . 1 1 48 48 ASP N N 48 122.403 122.403 119.774 2.629 18518
11027 1 17 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.563 -0.300 18518
11028 1 17 . 1 1 48 48 ASP C C 48 175.294 175.294 175.559 -0.265 18518
11029 1 17 . 1 1 48 48 ASP CA C 48 55.832 55.832 56.060 -0.228 18518
11030 1 17 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.369 -1.185 18518
11031 1 17 . 1 1 48 48 ASP H H 48 8.780 8.780 8.509 0.271 18518
11032 1 17 . 1 1 49 49 LYS N N 49 119.569 119.569 116.706 2.863 18518
11033 1 17 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.463 0.122 18518
11034 1 17 . 1 1 49 49 LYS C C 49 174.678 174.678 175.798 -1.120 18518
11035 1 17 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.085 -1.433 18518
11036 1 17 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.363 1.582 18518
11037 1 17 . 1 1 49 49 LYS H H 49 7.280 7.280 7.498 -0.218 18518
11038 1 17 . 1 1 50 50 THR N N 50 110.862 110.862 109.951 0.911 18518
11039 1 17 . 1 1 50 50 THR HA H 50 4.811 4.811 4.662 0.149 18518
11040 1 17 . 1 1 50 50 THR C C 50 172.425 172.425 174.254 -1.829 18518
11041 1 17 . 1 1 50 50 THR CA C 50 62.645 62.645 62.578 0.067 18518
11042 1 17 . 1 1 50 50 THR CB C 50 71.648 71.648 70.204 1.444 18518
11043 1 17 . 1 1 50 50 THR H H 50 8.042 8.042 8.171 -0.129 18518
11044 1 17 . 1 1 51 51 LYS N N 51 120.008 120.008 122.383 -2.375 18518
11045 1 17 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.537 0.088 18518
11046 1 17 . 1 1 51 51 LYS C C 51 175.082 175.082 175.852 -0.770 18518
11047 1 17 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.810 -2.106 18518
11048 1 17 . 1 1 51 51 LYS CB C 51 32.376 32.376 32.900 -0.524 18518
11049 1 17 . 1 1 51 51 LYS H H 51 7.119 7.119 7.616 -0.497 18518
11050 1 17 . 1 1 52 52 PHE N N 52 122.640 122.640 123.973 -1.333 18518
11051 1 17 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.719 0.618 18518
11052 1 17 . 1 1 52 52 PHE C C 52 174.213 174.213 173.900 0.313 18518
11053 1 17 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.566 0.045 18518
11054 1 17 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.057 0.083 18518
11055 1 17 . 1 1 52 52 PHE H H 52 9.709 9.709 9.160 0.549 18518
11056 1 17 . 1 1 53 53 LEU N N 53 122.157 122.157 122.217 -0.060 18518
11057 1 17 . 1 1 53 53 LEU HA H 53 4.947 4.947 5.188 -0.241 18518
11058 1 17 . 1 1 53 53 LEU C C 53 175.769 175.769 175.626 0.143 18518
11059 1 17 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.703 -0.746 18518
11060 1 17 . 1 1 53 53 LEU CB C 53 44.415 44.415 44.165 0.250 18518
11061 1 17 . 1 1 53 53 LEU H H 53 8.959 8.959 8.336 0.623 18518
11062 1 17 . 1 1 54 54 VAL N N 54 124.919 124.919 124.751 0.168 18518
11063 1 17 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.592 -0.033 18518
11064 1 17 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.244 0.886 18518
11065 1 17 . 1 1 54 54 VAL CB C 54 34.968 34.968 34.647 0.321 18518
11066 1 17 . 1 1 54 54 VAL H H 54 8.922 8.922 8.671 0.251 18518
11067 1 17 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.866 -0.425 18518
11068 1 17 . 1 1 55 55 PRO C C 55 176.594 176.594 177.815 -1.221 18518
11069 1 17 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.106 2.208 18518
11070 1 17 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.119 0.546 18518
11071 1 17 . 1 1 56 56 ASP N N 56 120.522 120.522 123.297 -2.775 18518
11072 1 17 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.284 -0.422 18518
11073 1 17 . 1 1 56 56 ASP C C 56 175.809 175.809 176.628 -0.819 18518
11074 1 17 . 1 1 56 56 ASP CA C 56 56.749 56.749 56.880 -0.131 18518
11075 1 17 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.342 0.168 18518
11076 1 17 . 1 1 56 56 ASP H H 56 8.347 8.347 8.429 -0.082 18518
11077 1 17 . 1 1 57 57 HIS N N 57 113.482 113.482 114.987 -1.505 18518
11078 1 17 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.703 0.017 18518
11079 1 17 . 1 1 57 57 HIS C C 57 176.507 176.507 174.976 1.531 18518
11080 1 17 . 1 1 57 57 HIS CA C 57 55.589 55.589 56.075 -0.486 18518
11081 1 17 . 1 1 57 57 HIS CB C 57 30.643 30.643 30.057 0.586 18518
11082 1 17 . 1 1 57 57 HIS H H 57 7.557 7.557 8.195 -0.638 18518
11083 1 17 . 1 1 58 58 VAL N N 58 123.279 123.279 122.182 1.097 18518
11084 1 17 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.217 -0.381 18518
11085 1 17 . 1 1 58 58 VAL C C 58 175.019 175.019 174.662 0.357 18518
11086 1 17 . 1 1 58 58 VAL CA C 58 62.823 62.823 60.519 2.304 18518
11087 1 17 . 1 1 58 58 VAL CB C 58 32.310 32.310 33.953 -1.643 18518
11088 1 17 . 1 1 58 58 VAL H H 58 7.345 7.345 7.456 -0.111 18518
11089 1 17 . 1 1 59 59 ASN N N 59 123.781 123.781 119.575 4.206 18518
11090 1 17 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.001 0.125 18518
11091 1 17 . 1 1 59 59 ASN C C 59 176.558 176.558 176.387 0.171 18518
11092 1 17 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.346 0.139 18518
11093 1 17 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.486 -0.379 18518
11094 1 17 . 1 1 59 59 ASN H H 59 8.735 8.735 8.099 0.636 18518
11095 1 17 . 1 1 60 60 MET N N 60 117.453 117.453 118.437 -0.984 18518
11096 1 17 . 1 1 60 60 MET HA H 60 4.395 4.395 4.120 0.275 18518
11097 1 17 . 1 1 60 60 MET C C 60 178.144 178.144 178.296 -0.152 18518
11098 1 17 . 1 1 60 60 MET CA C 60 57.097 57.097 57.636 -0.539 18518
11099 1 17 . 1 1 60 60 MET CB C 60 30.140 30.140 30.962 -0.822 18518
11100 1 17 . 1 1 60 60 MET H H 60 8.227 8.227 8.312 -0.085 18518
11101 1 17 . 1 1 61 61 SER N N 61 114.216 114.216 115.460 -1.244 18518
11102 1 17 . 1 1 61 61 SER HA H 61 4.111 4.111 4.111 -0.000 18518
11103 1 17 . 1 1 61 61 SER C C 61 177.335 177.335 177.044 0.291 18518
11104 1 17 . 1 1 61 61 SER CA C 61 61.590 61.590 62.455 -0.865 18518
11105 1 17 . 1 1 61 61 SER CB C 61 62.402 62.402 62.853 -0.451 18518
11106 1 17 . 1 1 61 61 SER H H 61 8.464 8.464 8.575 -0.111 18518
11107 1 17 . 1 1 62 62 GLU N N 62 123.004 123.004 120.926 2.078 18518
11108 1 17 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.107 -0.060 18518
11109 1 17 . 1 1 62 62 GLU C C 62 178.686 178.686 178.932 -0.246 18518
11110 1 17 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.800 -0.175 18518
11111 1 17 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.355 0.298 18518
11112 1 17 . 1 1 62 62 GLU H H 62 7.994 7.994 7.602 0.392 18518
11113 1 17 . 1 1 63 63 LEU N N 63 120.818 120.818 121.897 -1.079 18518
11114 1 17 . 1 1 63 63 LEU HA H 63 3.965 3.965 4.035 -0.070 18518
11115 1 17 . 1 1 63 63 LEU C C 63 178.046 178.046 178.814 -0.768 18518
11116 1 17 . 1 1 63 63 LEU CA C 63 57.920 57.920 58.065 -0.145 18518
11117 1 17 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.378 0.246 18518
11118 1 17 . 1 1 63 63 LEU H H 63 8.130 8.130 7.778 0.352 18518
11119 1 17 . 1 1 64 64 ILE N N 64 118.528 118.528 119.486 -0.958 18518
11120 1 17 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.616 -0.247 18518
11121 1 17 . 1 1 64 64 ILE C C 64 177.127 177.127 177.892 -0.765 18518
11122 1 17 . 1 1 64 64 ILE CA C 64 66.678 66.678 64.357 2.321 18518
11123 1 17 . 1 1 64 64 ILE CB C 64 38.444 38.444 36.333 2.111 18518
11124 1 17 . 1 1 64 64 ILE H H 64 8.488 8.488 8.692 -0.204 18518
11125 1 17 . 1 1 65 65 LYS N N 65 118.336 118.336 121.150 -2.814 18518
11126 1 17 . 1 1 65 65 LYS HA H 65 3.701 3.701 3.944 -0.243 18518
11127 1 17 . 1 1 65 65 LYS C C 65 179.291 179.291 179.100 0.191 18518
11128 1 17 . 1 1 65 65 LYS CA C 65 60.440 60.440 60.016 0.424 18518
11129 1 17 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.234 0.137 18518
11130 1 17 . 1 1 65 65 LYS H H 65 7.347 7.347 7.587 -0.240 18518
11131 1 17 . 1 1 66 66 ILE N N 66 120.171 120.171 120.887 -0.716 18518
11132 1 17 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.703 -0.125 18518
11133 1 17 . 1 1 66 66 ILE C C 66 178.873 178.873 178.203 0.670 18518
11134 1 17 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.323 -0.163 18518
11135 1 17 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.826 0.807 18518
11136 1 17 . 1 1 66 66 ILE H H 66 7.901 7.901 7.944 -0.043 18518
11137 1 17 . 1 1 67 67 ILE N N 67 121.185 121.185 120.268 0.917 18518
11138 1 17 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.596 -0.150 18518
11139 1 17 . 1 1 67 67 ILE C C 67 177.150 177.150 177.981 -0.831 18518
11140 1 17 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.545 -1.739 18518
11141 1 17 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.240 -2.245 18518
11142 1 17 . 1 1 67 67 ILE H H 67 8.290 8.290 8.077 0.213 18518
11143 1 17 . 1 1 68 68 ARG N N 68 119.173 119.173 118.998 0.175 18518
11144 1 17 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.808 -0.877 18518
11145 1 17 . 1 1 68 68 ARG C C 68 178.496 178.496 178.660 -0.164 18518
11146 1 17 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.515 1.121 18518
11147 1 17 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.859 0.581 18518
11148 1 17 . 1 1 68 68 ARG H H 68 8.438 8.438 8.141 0.297 18518
11149 1 17 . 1 1 69 69 ARG N N 69 116.511 116.511 120.072 -3.561 18518
11150 1 17 . 1 1 69 69 ARG HA H 69 4.134 4.134 3.958 0.176 18518
11151 1 17 . 1 1 69 69 ARG C C 69 180.262 180.262 178.613 1.649 18518
11152 1 17 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.059 -0.352 18518
11153 1 17 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.108 -0.155 18518
11154 1 17 . 1 1 69 69 ARG H H 69 7.497 7.497 8.353 -0.856 18518
11155 1 17 . 1 1 70 70 ARG N N 70 123.297 123.297 117.889 5.408 18518
11156 1 17 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.134 -0.118 18518
11157 1 17 . 1 1 70 70 ARG C C 70 178.700 178.700 178.350 0.350 18518
11158 1 17 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.446 1.014 18518
11159 1 17 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.680 0.632 18518
11160 1 17 . 1 1 70 70 ARG H H 70 8.075 8.075 7.845 0.230 18518
11161 1 17 . 1 1 71 71 LEU N N 71 116.829 116.829 119.707 -2.878 18518
11162 1 17 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.215 -0.150 18518
11163 1 17 . 1 1 71 71 LEU C C 71 174.956 174.956 176.077 -1.121 18518
11164 1 17 . 1 1 71 71 LEU CA C 71 55.126 55.126 55.448 -0.322 18518
11165 1 17 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.578 0.667 18518
11166 1 17 . 1 1 71 71 LEU H H 71 7.719 7.719 7.809 -0.090 18518
11167 1 17 . 1 1 72 72 GLN N N 72 114.991 114.991 114.723 0.268 18518
11168 1 17 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.847 -0.011 18518
11169 1 17 . 1 1 72 72 GLN C C 72 175.683 175.683 175.041 0.642 18518
11170 1 17 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.198 0.127 18518
11171 1 17 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.803 0.201 18518
11172 1 17 . 1 1 72 72 GLN H H 72 7.744 7.744 7.548 0.196 18518
11173 1 17 . 1 1 73 73 LEU N N 73 115.045 115.045 118.992 -3.947 18518
11174 1 17 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.110 0.126 18518
11175 1 17 . 1 1 73 73 LEU C C 73 178.762 178.762 176.948 1.814 18518
11176 1 17 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.343 -0.957 18518
11177 1 17 . 1 1 73 73 LEU CB C 73 42.091 42.091 42.235 -0.144 18518
11178 1 17 . 1 1 73 73 LEU H H 73 7.500 7.500 7.362 0.138 18518
11179 1 17 . 1 1 74 74 ASN N N 74 121.700 121.700 122.671 -0.971 18518
11180 1 17 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.569 0.121 18518
11181 1 17 . 1 1 74 74 ASN C C 74 176.617 176.617 175.466 1.151 18518
11182 1 17 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.755 -1.070 18518
11183 1 17 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.047 0.551 18518
11184 1 17 . 1 1 74 74 ASN H H 74 9.045 9.045 8.476 0.569 18518
11185 1 17 . 1 1 75 75 ALA N N 75 123.952 123.952 121.416 2.536 18518
11186 1 17 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.319 -0.355 18518
11187 1 17 . 1 1 75 75 ALA C C 75 178.131 178.131 177.234 0.897 18518
11188 1 17 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.356 1.512 18518
11189 1 17 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.808 -1.090 18518
11190 1 17 . 1 1 75 75 ALA H H 75 8.784 8.784 8.425 0.359 18518
11191 1 17 . 1 1 76 76 ASN N N 76 112.295 112.295 116.022 -3.727 18518
11192 1 17 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.659 -0.079 18518
11193 1 17 . 1 1 76 76 ASN C C 76 175.448 175.448 174.603 0.845 18518
11194 1 17 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.443 -0.229 18518
11195 1 17 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.549 -0.229 18518
11196 1 17 . 1 1 76 76 ASN H H 76 8.391 8.391 8.327 0.064 18518
11197 1 17 . 1 1 77 77 GLN N N 77 120.577 120.577 118.940 1.637 18518
11198 1 17 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.502 -0.229 18518
11199 1 17 . 1 1 77 77 GLN C C 77 175.045 175.045 173.578 1.467 18518
11200 1 17 . 1 1 77 77 GLN CA C 77 55.805 55.805 55.090 0.715 18518
11201 1 17 . 1 1 77 77 GLN CB C 77 30.157 30.157 31.176 -1.019 18518
11202 1 17 . 1 1 77 77 GLN H H 77 7.552 7.552 7.404 0.148 18518
11203 1 17 . 1 1 78 78 ALA N N 78 130.670 130.670 124.729 5.941 18518
11204 1 17 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.564 -0.393 18518
11205 1 17 . 1 1 78 78 ALA C C 78 176.512 176.512 175.619 0.893 18518
11206 1 17 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.636 1.206 18518
11207 1 17 . 1 1 78 78 ALA CB C 78 20.060 20.060 20.979 -0.919 18518
11208 1 17 . 1 1 78 78 ALA H H 78 8.799 8.799 8.463 0.336 18518
11209 1 17 . 1 1 79 79 PHE N N 79 119.325 119.325 116.772 2.553 18518
11210 1 17 . 1 1 79 79 PHE HA H 79 4.434 4.434 4.803 -0.369 18518
11211 1 17 . 1 1 79 79 PHE C C 79 171.726 171.726 172.646 -0.920 18518
11212 1 17 . 1 1 79 79 PHE CA C 79 59.145 59.145 56.286 2.859 18518
11213 1 17 . 1 1 79 79 PHE CB C 79 42.171 42.171 40.632 1.539 18518
11214 1 17 . 1 1 79 79 PHE H H 79 7.664 7.664 8.122 -0.458 18518
11215 1 17 . 1 1 80 80 PHE N N 80 126.314 126.314 116.750 9.564 18518
11216 1 17 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.391 0.001 18518
11217 1 17 . 1 1 80 80 PHE C C 80 177.169 177.169 172.846 4.323 18518
11218 1 17 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.731 -0.078 18518
11219 1 17 . 1 1 80 80 PHE CB C 80 41.933 41.933 43.196 -1.263 18518
11220 1 17 . 1 1 80 80 PHE H H 80 8.508 8.508 8.270 0.238 18518
11221 1 17 . 1 1 81 81 LEU N N 81 121.426 121.426 121.929 -0.503 18518
11222 1 17 . 1 1 81 81 LEU HA H 81 4.851 4.851 4.918 -0.067 18518
11223 1 17 . 1 1 81 81 LEU C C 81 174.488 174.488 175.023 -0.535 18518
11224 1 17 . 1 1 81 81 LEU CA C 81 53.197 53.197 54.232 -1.035 18518
11225 1 17 . 1 1 81 81 LEU CB C 81 45.100 45.100 44.600 0.500 18518
11226 1 17 . 1 1 81 81 LEU H H 81 8.229 8.229 8.365 -0.136 18518
11227 1 17 . 1 1 82 82 LEU N N 82 125.155 125.155 127.109 -1.954 18518
11228 1 17 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.570 0.263 18518
11229 1 17 . 1 1 82 82 LEU C C 82 177.166 177.166 175.746 1.420 18518
11230 1 17 . 1 1 82 82 LEU CA C 82 54.197 54.197 54.050 0.147 18518
11231 1 17 . 1 1 82 82 LEU CB C 82 43.442 43.442 43.968 -0.526 18518
11232 1 17 . 1 1 82 82 LEU H H 82 9.400 9.400 9.148 0.252 18518
11233 1 17 . 1 1 83 83 VAL N N 83 123.886 123.886 121.230 2.656 18518
11234 1 17 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.560 -0.181 18518
11235 1 17 . 1 1 83 83 VAL C C 83 175.810 175.810 176.578 -0.768 18518
11236 1 17 . 1 1 83 83 VAL CA C 83 61.677 61.677 61.602 0.075 18518
11237 1 17 . 1 1 83 83 VAL CB C 83 33.758 33.758 31.930 1.828 18518
11238 1 17 . 1 1 83 83 VAL H H 83 8.721 8.721 8.705 0.016 18518
11239 1 17 . 1 1 84 84 ASN N N 84 126.474 126.474 126.108 0.366 18518
11240 1 17 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.564 -0.168 18518
11241 1 17 . 1 1 84 84 ASN C C 84 175.164 175.164 175.257 -0.093 18518
11242 1 17 . 1 1 84 84 ASN CA C 84 54.738 54.738 55.267 -0.529 18518
11243 1 17 . 1 1 84 84 ASN CB C 84 37.950 37.950 37.968 -0.018 18518
11244 1 17 . 1 1 84 84 ASN H H 84 9.707 9.707 9.452 0.255 18518
11245 1 17 . 1 1 85 85 GLY N N 85 101.296 101.296 104.452 -3.156 18518
11246 1 17 . 1 1 85 85 GLY C C 85 173.680 173.680 173.391 0.289 18518
11247 1 17 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.853 0.750 18518
11248 1 17 . 1 1 85 85 GLY H H 85 8.644 8.644 8.301 0.343 18518
11249 1 17 . 1 1 86 86 HIS N N 86 117.238 117.238 119.192 -1.954 18518
11250 1 17 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.781 0.236 18518
11251 1 17 . 1 1 86 86 HIS C C 86 173.841 173.841 174.067 -0.226 18518
11252 1 17 . 1 1 86 86 HIS CA C 86 53.796 53.796 54.665 -0.869 18518
11253 1 17 . 1 1 86 86 HIS CB C 86 31.280 31.280 31.970 -0.690 18518
11254 1 17 . 1 1 86 86 HIS H H 86 7.918 7.918 8.403 -0.485 18518
11255 1 17 . 1 1 87 87 SER N N 87 118.179 118.179 121.540 -3.361 18518
11256 1 17 . 1 1 87 87 SER HA H 87 4.699 4.699 4.540 0.159 18518
11257 1 17 . 1 1 87 87 SER C C 87 175.904 175.904 174.594 1.310 18518
11258 1 17 . 1 1 87 87 SER CA C 87 58.271 58.271 58.141 0.130 18518
11259 1 17 . 1 1 87 87 SER CB C 87 63.735 63.735 61.708 2.027 18518
11260 1 17 . 1 1 87 87 SER H H 87 8.977 8.977 8.898 0.079 18518
11261 1 17 . 1 1 88 88 MET N N 88 125.472 125.472 123.202 2.270 18518
11262 1 17 . 1 1 88 88 MET HA H 88 4.830 4.830 4.792 0.038 18518
11263 1 17 . 1 1 88 88 MET C C 88 176.419 176.419 174.274 2.145 18518
11264 1 17 . 1 1 88 88 MET CA C 88 54.899 54.899 54.604 0.295 18518
11265 1 17 . 1 1 88 88 MET CB C 88 33.336 33.336 33.367 -0.031 18518
11266 1 17 . 1 1 88 88 MET H H 88 9.184 9.184 7.937 1.247 18518
11267 1 17 . 1 1 89 89 VAL N N 89 120.747 120.747 120.864 -0.117 18518
11268 1 17 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.338 -0.106 18518
11269 1 17 . 1 1 89 89 VAL C C 89 175.958 175.958 175.591 0.367 18518
11270 1 17 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.490 1.663 18518
11271 1 17 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.708 -1.830 18518
11272 1 17 . 1 1 89 89 VAL H H 89 8.233 8.233 7.735 0.498 18518
11273 1 17 . 1 1 90 90 SER N N 90 117.362 117.362 121.474 -4.112 18518
11274 1 17 . 1 1 90 90 SER HA H 90 4.590 4.590 4.571 0.019 18518
11275 1 17 . 1 1 90 90 SER C C 90 175.741 175.741 176.076 -0.335 18518
11276 1 17 . 1 1 90 90 SER CA C 90 57.717 57.717 57.622 0.095 18518
11277 1 17 . 1 1 90 90 SER CB C 90 63.223 63.223 64.237 -1.014 18518
11278 1 17 . 1 1 90 90 SER H H 90 8.482 8.482 8.607 -0.125 18518
11279 1 17 . 1 1 91 91 VAL N N 91 120.466 120.466 123.578 -3.112 18518
11280 1 17 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.871 0.176 18518
11281 1 17 . 1 1 91 91 VAL C C 91 176.329 176.329 176.049 0.280 18518
11282 1 17 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.323 -0.831 18518
11283 1 17 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.530 1.038 18518
11284 1 17 . 1 1 91 91 VAL H H 91 8.188 8.188 8.749 -0.561 18518
11285 1 17 . 1 1 92 92 SER N N 92 116.398 116.398 113.554 2.844 18518
11286 1 17 . 1 1 92 92 SER HA H 92 4.636 4.636 4.637 -0.001 18518
11287 1 17 . 1 1 92 92 SER C C 92 174.159 174.159 174.244 -0.085 18518
11288 1 17 . 1 1 92 92 SER CA C 92 57.805 57.805 57.965 -0.160 18518
11289 1 17 . 1 1 92 92 SER CB C 92 63.046 63.046 63.563 -0.517 18518
11290 1 17 . 1 1 92 92 SER H H 92 8.370 8.370 8.169 0.201 18518
11291 1 17 . 1 1 93 93 THR N N 93 119.211 119.211 120.261 -1.050 18518
11292 1 17 . 1 1 93 93 THR HA H 93 4.484 4.484 4.677 -0.193 18518
11293 1 17 . 1 1 93 93 THR CA C 93 60.884 60.884 61.002 -0.118 18518
11294 1 17 . 1 1 93 93 THR CB C 93 70.609 70.609 69.251 1.358 18518
11295 1 17 . 1 1 93 93 THR H H 93 7.416 7.416 7.620 -0.204 18518
11296 1 17 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.513 -0.073 18518
11297 1 17 . 1 1 94 94 PRO C C 94 178.775 178.775 177.454 1.321 18518
11298 1 17 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.444 0.499 18518
11299 1 17 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.327 0.322 18518
11300 1 17 . 1 1 95 95 ILE N N 95 124.174 124.174 124.631 -0.457 18518
11301 1 17 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.715 0.234 18518
11302 1 17 . 1 1 95 95 ILE C C 95 176.498 176.498 177.065 -0.567 18518
11303 1 17 . 1 1 95 95 ILE CA C 95 63.904 63.904 63.914 -0.010 18518
11304 1 17 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.177 0.005 18518
11305 1 17 . 1 1 95 95 ILE H H 95 9.305 9.305 8.108 1.197 18518
11306 1 17 . 1 1 96 96 SER N N 96 116.920 116.920 115.046 1.874 18518
11307 1 17 . 1 1 96 96 SER HA H 96 4.029 4.029 4.193 -0.164 18518
11308 1 17 . 1 1 96 96 SER C C 96 176.574 176.574 176.300 0.274 18518
11309 1 17 . 1 1 96 96 SER CA C 96 61.356 61.356 62.370 -1.014 18518
11310 1 17 . 1 1 96 96 SER CB C 96 61.723 61.723 63.001 -1.278 18518
11311 1 17 . 1 1 96 96 SER H H 96 8.335 8.335 8.644 -0.309 18518
11312 1 17 . 1 1 97 97 GLU N N 97 123.255 123.255 121.205 2.050 18518
11313 1 17 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.183 0.095 18518
11314 1 17 . 1 1 97 97 GLU C C 97 179.716 179.716 178.860 0.856 18518
11315 1 17 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.997 -0.205 18518
11316 1 17 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.269 0.293 18518
11317 1 17 . 1 1 97 97 GLU H H 97 7.376 7.376 7.741 -0.365 18518
11318 1 17 . 1 1 98 98 VAL N N 98 121.137 121.137 120.555 0.582 18518
11319 1 17 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.745 0.057 18518
11320 1 17 . 1 1 98 98 VAL C C 98 177.637 177.637 178.056 -0.419 18518
11321 1 17 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.555 -0.731 18518
11322 1 17 . 1 1 98 98 VAL CB C 98 32.154 32.154 30.933 1.221 18518
11323 1 17 . 1 1 98 98 VAL H H 98 7.387 7.387 7.898 -0.511 18518
11324 1 17 . 1 1 99 99 TYR N N 99 118.927 118.927 121.787 -2.860 18518
11325 1 17 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.143 -0.153 18518
11326 1 17 . 1 1 99 99 TYR C C 99 176.081 176.081 176.932 -0.851 18518
11327 1 17 . 1 1 99 99 TYR CA C 99 62.223 62.223 60.142 2.080 18518
11328 1 17 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.190 0.792 18518
11329 1 17 . 1 1 99 99 TYR H H 99 9.048 9.048 8.479 0.569 18518
11330 1 17 . 1 1 100 100 GLU N N 100 113.894 113.894 116.804 -2.910 18518
11331 1 17 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.871 -0.025 18518
11332 1 17 . 1 1 100 100 GLU C C 100 177.989 177.989 178.519 -0.530 18518
11333 1 17 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.542 0.545 18518
11334 1 17 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.880 0.502 18518
11335 1 17 . 1 1 100 100 GLU H H 100 7.422 7.422 8.007 -0.585 18518
11336 1 17 . 1 1 101 101 SER N N 101 108.991 108.991 114.979 -5.988 18518
11337 1 17 . 1 1 101 101 SER HA H 101 4.524 4.524 4.421 0.103 18518
11338 1 17 . 1 1 101 101 SER C C 101 176.628 176.628 175.710 0.918 18518
11339 1 17 . 1 1 101 101 SER CA C 101 60.349 60.349 60.777 -0.428 18518
11340 1 17 . 1 1 101 101 SER CB C 101 64.741 64.741 63.955 0.786 18518
11341 1 17 . 1 1 101 101 SER H H 101 7.424 7.424 7.893 -0.469 18518
11342 1 17 . 1 1 102 102 GLU N N 102 116.533 116.533 118.868 -2.335 18518
11343 1 17 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.592 0.152 18518
11344 1 17 . 1 1 102 102 GLU C C 102 176.774 176.774 176.157 0.617 18518
11345 1 17 . 1 1 102 102 GLU CA C 102 55.581 55.581 54.402 1.179 18518
11346 1 17 . 1 1 102 102 GLU CB C 102 30.697 30.697 29.856 0.841 18518
11347 1 17 . 1 1 102 102 GLU H H 102 8.487 8.487 8.204 0.283 18518
11348 1 17 . 1 1 103 103 LYS N N 103 118.370 118.370 119.920 -1.550 18518
11349 1 17 . 1 1 103 103 LYS HA H 103 4.178 4.178 4.154 0.024 18518
11350 1 17 . 1 1 103 103 LYS C C 103 175.018 175.018 176.724 -1.706 18518
11351 1 17 . 1 1 103 103 LYS CA C 103 57.329 57.329 57.102 0.227 18518
11352 1 17 . 1 1 103 103 LYS CB C 103 32.186 32.186 31.578 0.608 18518
11353 1 17 . 1 1 103 103 LYS H H 103 7.831 7.831 7.724 0.107 18518
11354 1 17 . 1 1 104 104 ASP N N 104 123.500 123.500 124.946 -1.446 18518
11355 1 17 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.544 0.211 18518
11356 1 17 . 1 1 104 104 ASP C C 104 177.383 177.383 178.027 -0.644 18518
11357 1 17 . 1 1 104 104 ASP CA C 104 53.846 53.846 53.899 -0.053 18518
11358 1 17 . 1 1 104 104 ASP CB C 104 43.411 43.411 42.795 0.616 18518
11359 1 17 . 1 1 104 104 ASP H H 104 9.041 9.041 8.243 0.798 18518
11360 1 17 . 1 1 105 105 GLU N N 105 125.448 125.448 121.451 3.997 18518
11361 1 17 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.137 0.043 18518
11362 1 17 . 1 1 105 105 GLU C C 105 177.519 177.519 176.660 0.859 18518
11363 1 17 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.965 0.564 18518
11364 1 17 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.538 0.506 18518
11365 1 17 . 1 1 105 105 GLU H H 105 8.906 8.906 8.859 0.047 18518
11366 1 17 . 1 1 106 106 ASP N N 106 118.824 118.824 118.768 0.056 18518
11367 1 17 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.494 -0.315 18518
11368 1 17 . 1 1 106 106 ASP C C 106 176.223 176.223 176.631 -0.408 18518
11369 1 17 . 1 1 106 106 ASP CA C 106 54.756 54.756 55.797 -1.040 18518
11370 1 17 . 1 1 106 106 ASP CB C 106 39.999 39.999 41.285 -1.286 18518
11371 1 17 . 1 1 106 106 ASP H H 106 10.036 10.036 8.287 1.749 18518
11372 1 17 . 1 1 107 107 GLY N N 107 105.866 105.866 104.761 1.105 18518
11373 1 17 . 1 1 107 107 GLY C C 107 175.136 175.136 173.506 1.630 18518
11374 1 17 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.055 0.167 18518
11375 1 17 . 1 1 107 107 GLY H H 107 8.001 8.001 8.034 -0.033 18518
11376 1 17 . 1 1 108 108 PHE N N 108 123.820 123.820 119.477 4.343 18518
11377 1 17 . 1 1 108 108 PHE HA H 108 4.662 4.662 5.232 -0.570 18518
11378 1 17 . 1 1 108 108 PHE C C 108 174.899 174.899 174.658 0.241 18518
11379 1 17 . 1 1 108 108 PHE CA C 108 60.238 60.238 57.790 2.448 18518
11380 1 17 . 1 1 108 108 PHE CB C 108 40.365 40.365 41.438 -1.073 18518
11381 1 17 . 1 1 108 108 PHE H H 108 9.912 9.912 7.613 2.299 18518
11382 1 17 . 1 1 109 109 LEU N N 109 120.130 120.130 120.279 -0.149 18518
11383 1 17 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.886 0.144 18518
11384 1 17 . 1 1 109 109 LEU C C 109 173.916 173.916 174.765 -0.849 18518
11385 1 17 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.958 -0.534 18518
11386 1 17 . 1 1 109 109 LEU CB C 109 45.203 45.203 44.860 0.343 18518
11387 1 17 . 1 1 109 109 LEU H H 109 7.997 7.997 8.589 -0.592 18518
11388 1 17 . 1 1 110 110 TYR N N 110 126.579 126.579 125.606 0.973 18518
11389 1 17 . 1 1 110 110 TYR HA H 110 5.003 5.003 5.521 -0.518 18518
11390 1 17 . 1 1 110 110 TYR C C 110 176.671 176.671 176.036 0.635 18518
11391 1 17 . 1 1 110 110 TYR CA C 110 59.058 59.058 55.594 3.464 18518
11392 1 17 . 1 1 110 110 TYR CB C 110 39.556 39.556 40.753 -1.197 18518
11393 1 17 . 1 1 110 110 TYR H H 110 9.377 9.377 8.225 1.152 18518
11394 1 17 . 1 1 111 111 MET N N 111 119.240 119.240 119.112 0.128 18518
11395 1 17 . 1 1 111 111 MET HA H 111 5.486 5.486 5.209 0.277 18518
11396 1 17 . 1 1 111 111 MET C C 111 175.695 175.695 174.447 1.248 18518
11397 1 17 . 1 1 111 111 MET CA C 111 54.124 54.124 54.893 -0.769 18518
11398 1 17 . 1 1 111 111 MET CB C 111 36.960 36.960 37.763 -0.803 18518
11399 1 17 . 1 1 111 111 MET H H 111 9.658 9.658 9.200 0.458 18518
11400 1 17 . 1 1 112 112 VAL N N 112 119.865 119.865 116.289 3.576 18518
11401 1 17 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.455 0.508 18518
11402 1 17 . 1 1 112 112 VAL C C 112 175.058 175.058 174.237 0.821 18518
11403 1 17 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.505 -0.594 18518
11404 1 17 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.248 0.803 18518
11405 1 17 . 1 1 112 112 VAL H H 112 8.794 8.794 8.738 0.056 18518
11406 1 17 . 1 1 113 113 TYR N N 113 119.664 119.664 118.821 0.843 18518
11407 1 17 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.395 0.723 18518
11408 1 17 . 1 1 113 113 TYR C C 113 173.375 173.375 173.287 0.088 18518
11409 1 17 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.216 -1.063 18518
11410 1 17 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.630 1.682 18518
11411 1 17 . 1 1 113 113 TYR H H 113 8.315 8.315 8.323 -0.008 18518
11412 1 17 . 1 1 114 114 ALA N N 114 119.763 119.763 122.585 -2.822 18518
11413 1 17 . 1 1 114 114 ALA HA H 114 4.800 4.800 5.042 -0.242 18518
11414 1 17 . 1 1 114 114 ALA C C 114 176.216 176.216 175.209 1.007 18518
11415 1 17 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.888 -0.756 18518
11416 1 17 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.288 2.308 18518
11417 1 17 . 1 1 114 114 ALA H H 114 8.465 8.465 8.735 -0.270 18518
11418 1 17 . 1 1 115 115 SER N N 115 114.763 114.763 116.116 -1.353 18518
11419 1 17 . 1 1 115 115 SER HA H 115 4.496 4.496 4.778 -0.282 18518
11420 1 17 . 1 1 115 115 SER C C 115 172.671 172.671 173.850 -1.179 18518
11421 1 17 . 1 1 115 115 SER CA C 115 58.651 58.651 57.961 0.690 18518
11422 1 17 . 1 1 115 115 SER CB C 115 63.526 63.526 62.126 1.400 18518
11423 1 17 . 1 1 115 115 SER H H 115 9.915 9.915 9.356 0.559 18518
11424 1 17 . 1 1 116 116 GLN N N 116 116.611 116.611 124.093 -7.482 18518
11425 1 17 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.430 0.054 18518
11426 1 17 . 1 1 116 116 GLN C C 116 172.733 172.733 173.605 -0.872 18518
11427 1 17 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.943 -2.017 18518
11428 1 17 . 1 1 116 116 GLN CB C 116 32.358 32.358 31.175 1.183 18518
11429 1 17 . 1 1 116 116 GLN H H 116 7.219 7.219 7.834 -0.615 18518
11430 1 17 . 1 1 117 117 GLU N N 117 117.623 117.623 120.220 -2.597 18518
11431 1 17 . 1 1 117 117 GLU HA H 117 3.287 3.287 3.084 0.203 18518
11432 1 17 . 1 1 117 117 GLU C C 117 175.168 175.168 175.543 -0.375 18518
11433 1 17 . 1 1 117 117 GLU CA C 117 56.882 56.882 56.964 -0.082 18518
11434 1 17 . 1 1 117 117 GLU CB C 117 30.522 30.522 30.066 0.456 18518
11435 1 17 . 1 1 117 117 GLU H H 117 7.882 7.882 8.510 -0.628 18518
11436 1 17 . 1 1 118 118 THR N N 118 109.820 109.820 111.801 -1.981 18518
11437 1 17 . 1 1 118 118 THR HA H 118 4.066 4.066 4.232 -0.166 18518
11438 1 17 . 1 1 118 118 THR C C 118 172.355 172.355 173.384 -1.029 18518
11439 1 17 . 1 1 118 118 THR CA C 118 60.029 60.029 61.192 -1.163 18518
11440 1 17 . 1 1 118 118 THR CB C 118 70.480 70.480 69.318 1.162 18518
11441 1 17 . 1 1 118 118 THR H H 118 6.992 6.992 7.272 -0.280 18518
11442 1 18 . 1 1 2 2 ALA HA H 2 4.336 4.336 5.380 -1.044 18518
11443 1 18 . 1 1 2 2 ALA C C 2 177.974 177.974 177.390 0.584 18518
11444 1 18 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.680 1.105 18518
11445 1 18 . 1 1 2 2 ALA CB C 2 19.444 19.444 20.845 -1.401 18518
11446 1 18 . 1 1 3 3 MET N N 3 119.311 119.311 118.262 1.049 18518
11447 1 18 . 1 1 3 3 MET HA H 3 4.451 4.451 5.177 -0.726 18518
11448 1 18 . 1 1 3 3 MET C C 3 176.913 176.913 175.911 1.002 18518
11449 1 18 . 1 1 3 3 MET CA C 3 55.679 55.679 54.861 0.819 18518
11450 1 18 . 1 1 3 3 MET CB C 3 32.590 32.590 34.540 -1.950 18518
11451 1 18 . 1 1 3 3 MET H H 3 8.638 8.638 9.043 -0.405 18518
11452 1 18 . 1 1 4 4 GLY N N 4 110.281 110.281 108.844 1.437 18518
11453 1 18 . 1 1 4 4 GLY C C 4 174.180 174.180 172.771 1.409 18518
11454 1 18 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.847 0.648 18518
11455 1 18 . 1 1 4 4 GLY H H 4 8.552 8.552 8.305 0.247 18518
11456 1 18 . 1 1 5 5 LYS N N 5 120.818 120.818 122.277 -1.459 18518
11457 1 18 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.508 0.001 18518
11458 1 18 . 1 1 5 5 LYS C C 5 177.605 177.605 176.619 0.986 18518
11459 1 18 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.727 0.407 18518
11460 1 18 . 1 1 5 5 LYS CB C 5 34.813 34.813 33.661 1.152 18518
11461 1 18 . 1 1 5 5 LYS H H 5 8.133 8.133 8.393 -0.260 18518
11462 1 18 . 1 1 6 6 THR N N 6 114.781 114.781 121.598 -6.817 18518
11463 1 18 . 1 1 6 6 THR HA H 6 4.421 4.421 4.306 0.115 18518
11464 1 18 . 1 1 6 6 THR C C 6 175.524 175.524 175.821 -0.297 18518
11465 1 18 . 1 1 6 6 THR CA C 6 61.127 61.127 62.791 -1.664 18518
11466 1 18 . 1 1 6 6 THR CB C 6 69.926 69.926 69.174 0.752 18518
11467 1 18 . 1 1 6 6 THR H H 6 8.483 8.483 8.695 -0.212 18518
11468 1 18 . 1 1 7 7 PHE N N 7 125.552 125.552 122.927 2.625 18518
11469 1 18 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.085 -0.080 18518
11470 1 18 . 1 1 7 7 PHE C C 7 177.397 177.397 177.034 0.363 18518
11471 1 18 . 1 1 7 7 PHE CA C 7 63.393 63.393 61.663 1.730 18518
11472 1 18 . 1 1 7 7 PHE CB C 7 39.567 39.567 37.790 1.777 18518
11473 1 18 . 1 1 7 7 PHE H H 7 10.245 10.245 9.039 1.206 18518
11474 1 18 . 1 1 8 8 LYS N N 8 114.053 114.053 117.165 -3.112 18518
11475 1 18 . 1 1 8 8 LYS HA H 8 3.835 3.835 4.062 -0.227 18518
11476 1 18 . 1 1 8 8 LYS C C 8 175.520 175.520 178.241 -2.721 18518
11477 1 18 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.348 1.645 18518
11478 1 18 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.181 2.508 18518
11479 1 18 . 1 1 8 8 LYS H H 8 8.775 8.775 6.895 1.880 18518
11480 1 18 . 1 1 9 9 GLN N N 9 113.516 113.516 118.542 -5.026 18518
11481 1 18 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.137 0.012 18518
11482 1 18 . 1 1 9 9 GLN C C 9 177.615 177.615 177.899 -0.284 18518
11483 1 18 . 1 1 9 9 GLN CA C 9 56.819 56.819 57.951 -1.132 18518
11484 1 18 . 1 1 9 9 GLN CB C 9 30.019 30.019 28.979 1.040 18518
11485 1 18 . 1 1 9 9 GLN H H 9 7.355 7.355 7.608 -0.253 18518
11486 1 18 . 1 1 10 10 ARG N N 10 118.294 118.294 116.922 1.372 18518
11487 1 18 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.215 0.087 18518
11488 1 18 . 1 1 10 10 ARG C C 10 179.380 179.380 177.492 1.888 18518
11489 1 18 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.427 -0.159 18518
11490 1 18 . 1 1 10 10 ARG CB C 10 31.642 31.642 31.088 0.554 18518
11491 1 18 . 1 1 10 10 ARG H H 10 7.936 7.936 7.958 -0.022 18518
11492 1 18 . 1 1 11 11 ARG N N 11 121.137 121.137 120.211 0.926 18518
11493 1 18 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.656 0.024 18518
11494 1 18 . 1 1 11 11 ARG CA C 11 53.453 53.453 54.367 -0.914 18518
11495 1 18 . 1 1 11 11 ARG CB C 11 32.938 32.938 31.547 1.391 18518
11496 1 18 . 1 1 11 11 ARG H H 11 7.390 7.390 8.197 -0.807 18518
11497 1 18 . 1 1 12 12 THR N N 12 116.819 116.819 119.209 -2.390 18518
11498 1 18 . 1 1 12 12 THR HA H 12 4.359 4.359 4.512 -0.153 18518
11499 1 18 . 1 1 12 12 THR C C 12 174.989 174.989 176.000 -1.011 18518
11500 1 18 . 1 1 12 12 THR CA C 12 61.748 61.748 61.462 0.287 18518
11501 1 18 . 1 1 12 12 THR CB C 12 71.068 71.068 70.185 0.883 18518
11502 1 18 . 1 1 12 12 THR H H 12 8.953 8.953 8.432 0.521 18518
11503 1 18 . 1 1 13 13 PHE N N 13 123.200 123.200 122.615 0.585 18518
11504 1 18 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.114 -0.086 18518
11505 1 18 . 1 1 13 13 PHE C C 13 176.029 176.029 177.192 -1.163 18518
11506 1 18 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.880 -0.016 18518
11507 1 18 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.271 0.289 18518
11508 1 18 . 1 1 13 13 PHE H H 13 9.284 9.284 9.160 0.124 18518
11509 1 18 . 1 1 14 14 GLU N N 14 115.414 115.414 117.862 -2.448 18518
11510 1 18 . 1 1 14 14 GLU HA H 14 3.794 3.794 4.028 -0.234 18518
11511 1 18 . 1 1 14 14 GLU C C 14 180.081 180.081 178.819 1.262 18518
11512 1 18 . 1 1 14 14 GLU CA C 14 60.619 60.619 60.292 0.327 18518
11513 1 18 . 1 1 14 14 GLU CB C 14 28.852 28.852 28.750 0.102 18518
11514 1 18 . 1 1 14 14 GLU H H 14 8.973 8.973 8.923 0.050 18518
11515 1 18 . 1 1 15 15 GLN N N 15 119.276 119.276 117.703 1.573 18518
11516 1 18 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.127 -0.127 18518
11517 1 18 . 1 1 15 15 GLN C C 15 177.978 177.978 178.875 -0.897 18518
11518 1 18 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.906 -0.071 18518
11519 1 18 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.148 1.222 18518
11520 1 18 . 1 1 15 15 GLN H H 15 7.756 7.756 8.520 -0.764 18518
11521 1 18 . 1 1 16 16 ARG N N 16 121.336 121.336 120.383 0.953 18518
11522 1 18 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.334 -0.064 18518
11523 1 18 . 1 1 16 16 ARG C C 16 177.416 177.416 178.819 -1.403 18518
11524 1 18 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.454 1.921 18518
11525 1 18 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.442 0.163 18518
11526 1 18 . 1 1 16 16 ARG H H 16 8.645 8.645 8.223 0.422 18518
11527 1 18 . 1 1 17 17 VAL N N 17 117.630 117.630 121.181 -3.551 18518
11528 1 18 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.686 0.171 18518
11529 1 18 . 1 1 17 17 VAL C C 17 179.748 179.748 177.439 2.309 18518
11530 1 18 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.900 -0.174 18518
11531 1 18 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.463 0.731 18518
11532 1 18 . 1 1 17 17 VAL H H 17 8.373 8.373 8.404 -0.031 18518
11533 1 18 . 1 1 18 18 GLU N N 18 120.864 120.864 119.636 1.228 18518
11534 1 18 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.984 0.318 18518
11535 1 18 . 1 1 18 18 GLU C C 18 177.728 177.728 178.572 -0.844 18518
11536 1 18 . 1 1 18 18 GLU CA C 18 58.486 58.486 60.023 -1.537 18518
11537 1 18 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.442 -0.060 18518
11538 1 18 . 1 1 18 18 GLU H H 18 7.368 7.368 8.211 -0.843 18518
11539 1 18 . 1 1 19 19 ASP N N 19 121.425 121.425 120.169 1.256 18518
11540 1 18 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.435 -0.001 18518
11541 1 18 . 1 1 19 19 ASP C C 19 179.978 179.978 178.817 1.161 18518
11542 1 18 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.585 -0.163 18518
11543 1 18 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.766 0.521 18518
11544 1 18 . 1 1 19 19 ASP H H 19 8.671 8.671 7.982 0.689 18518
11545 1 18 . 1 1 20 20 VAL N N 20 119.730 119.730 120.402 -0.672 18518
11546 1 18 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.409 -0.204 18518
11547 1 18 . 1 1 20 20 VAL C C 20 176.284 176.284 177.546 -1.262 18518
11548 1 18 . 1 1 20 20 VAL CA C 20 66.315 66.315 67.287 -0.972 18518
11549 1 18 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.735 -0.628 18518
11550 1 18 . 1 1 20 20 VAL H H 20 7.999 7.999 8.238 -0.239 18518
11551 1 18 . 1 1 21 21 ARG N N 21 121.455 121.455 119.442 2.013 18518
11552 1 18 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.953 -0.139 18518
11553 1 18 . 1 1 21 21 ARG C C 21 180.120 180.120 178.680 1.440 18518
11554 1 18 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.913 0.918 18518
11555 1 18 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.307 0.639 18518
11556 1 18 . 1 1 21 21 ARG H H 21 8.098 8.098 7.959 0.139 18518
11557 1 18 . 1 1 22 22 LEU N N 22 117.826 117.826 121.002 -3.176 18518
11558 1 18 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.068 -0.019 18518
11559 1 18 . 1 1 22 22 LEU C C 22 180.115 180.115 178.481 1.634 18518
11560 1 18 . 1 1 22 22 LEU CA C 22 57.790 57.790 58.007 -0.217 18518
11561 1 18 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.912 0.230 18518
11562 1 18 . 1 1 22 22 LEU H H 22 8.207 8.207 8.291 -0.084 18518
11563 1 18 . 1 1 23 23 ILE N N 23 121.450 121.450 119.380 2.070 18518
11564 1 18 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.924 0.089 18518
11565 1 18 . 1 1 23 23 ILE C C 23 178.149 178.149 178.692 -0.543 18518
11566 1 18 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.278 -2.106 18518
11567 1 18 . 1 1 23 23 ILE CB C 23 38.106 38.106 36.801 1.305 18518
11568 1 18 . 1 1 23 23 ILE H H 23 8.105 8.105 8.026 0.079 18518
11569 1 18 . 1 1 24 24 ARG N N 24 121.139 121.139 118.668 2.471 18518
11570 1 18 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.028 -0.041 18518
11571 1 18 . 1 1 24 24 ARG C C 24 178.702 178.702 178.931 -0.229 18518
11572 1 18 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.747 -1.029 18518
11573 1 18 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.608 -0.840 18518
11574 1 18 . 1 1 24 24 ARG H H 24 8.601 8.601 8.482 0.119 18518
11575 1 18 . 1 1 25 25 GLU N N 25 118.054 118.054 119.088 -1.034 18518
11576 1 18 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.104 -0.078 18518
11577 1 18 . 1 1 25 25 GLU C C 25 178.492 178.492 178.071 0.421 18518
11578 1 18 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.373 0.407 18518
11579 1 18 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.708 0.293 18518
11580 1 18 . 1 1 25 25 GLU H H 25 7.423 7.423 7.791 -0.368 18518
11581 1 18 . 1 1 26 26 GLN N N 26 116.350 116.350 117.302 -0.952 18518
11582 1 18 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.027 -0.091 18518
11583 1 18 . 1 1 26 26 GLN C C 26 176.305 176.305 176.788 -0.483 18518
11584 1 18 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.400 0.103 18518
11585 1 18 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.433 0.774 18518
11586 1 18 . 1 1 26 26 GLN H H 26 7.524 7.524 8.044 -0.520 18518
11587 1 18 . 1 1 27 27 HIS N N 27 116.017 116.017 117.840 -1.823 18518
11588 1 18 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.141 -0.211 18518
11589 1 18 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.687 0.367 18518
11590 1 18 . 1 1 27 27 HIS CB C 27 30.747 30.747 30.419 0.328 18518
11591 1 18 . 1 1 27 27 HIS H H 27 8.284 8.284 8.247 0.037 18518
11592 1 18 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.470 0.111 18518
11593 1 18 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.587 0.332 18518
11594 1 18 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.046 0.409 18518
11595 1 18 . 1 1 29 29 THR N N 29 107.011 107.011 106.740 0.271 18518
11596 1 18 . 1 1 29 29 THR HA H 29 4.599 4.599 4.272 0.327 18518
11597 1 18 . 1 1 29 29 THR C C 29 172.884 172.884 173.669 -0.785 18518
11598 1 18 . 1 1 29 29 THR CA C 29 60.810 60.810 61.968 -1.158 18518
11599 1 18 . 1 1 29 29 THR CB C 29 68.531 68.531 68.386 0.145 18518
11600 1 18 . 1 1 29 29 THR H H 29 7.890 7.890 8.364 -0.474 18518
11601 1 18 . 1 1 30 30 LYS N N 30 117.679 117.679 120.889 -3.210 18518
11602 1 18 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.998 -0.140 18518
11603 1 18 . 1 1 30 30 LYS C C 30 174.310 174.310 174.622 -0.312 18518
11604 1 18 . 1 1 30 30 LYS CA C 30 53.751 53.751 53.895 -0.144 18518
11605 1 18 . 1 1 30 30 LYS CB C 30 35.804 35.804 36.230 -0.426 18518
11606 1 18 . 1 1 30 30 LYS H H 30 7.441 7.441 7.652 -0.211 18518
11607 1 18 . 1 1 31 31 ILE N N 31 122.849 122.849 122.088 0.761 18518
11608 1 18 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.286 -0.181 18518
11609 1 18 . 1 1 31 31 ILE CA C 31 54.801 54.801 57.894 -3.092 18518
11610 1 18 . 1 1 31 31 ILE CB C 31 38.265 38.265 39.585 -1.320 18518
11611 1 18 . 1 1 31 31 ILE H H 31 9.304 9.304 8.789 0.515 18518
11612 1 18 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.861 0.298 18518
11613 1 18 . 1 1 32 32 PRO C C 32 174.164 174.164 175.689 -1.525 18518
11614 1 18 . 1 1 32 32 PRO CA C 32 61.503 61.503 61.959 -0.457 18518
11615 1 18 . 1 1 32 32 PRO CB C 32 31.145 31.145 30.708 0.437 18518
11616 1 18 . 1 1 33 33 VAL N N 33 125.606 125.606 125.138 0.468 18518
11617 1 18 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.212 0.001 18518
11618 1 18 . 1 1 33 33 VAL C C 33 173.654 173.654 173.849 -0.195 18518
11619 1 18 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.139 0.905 18518
11620 1 18 . 1 1 33 33 VAL CB C 33 35.604 35.604 35.854 -0.250 18518
11621 1 18 . 1 1 33 33 VAL H H 33 9.424 9.424 8.595 0.829 18518
11622 1 18 . 1 1 34 34 ILE N N 34 128.241 128.241 128.023 0.218 18518
11623 1 18 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.631 0.202 18518
11624 1 18 . 1 1 34 34 ILE C C 34 175.605 175.605 174.792 0.813 18518
11625 1 18 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.343 -1.577 18518
11626 1 18 . 1 1 34 34 ILE CB C 34 36.799 36.799 37.025 -0.226 18518
11627 1 18 . 1 1 34 34 ILE H H 34 8.721 8.721 9.036 -0.315 18518
11628 1 18 . 1 1 35 35 ILE N N 35 125.650 125.650 128.975 -3.325 18518
11629 1 18 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.656 0.180 18518
11630 1 18 . 1 1 35 35 ILE C C 35 174.887 174.887 174.648 0.239 18518
11631 1 18 . 1 1 35 35 ILE CA C 35 60.945 60.945 58.834 2.111 18518
11632 1 18 . 1 1 35 35 ILE CB C 35 39.210 39.210 37.276 1.934 18518
11633 1 18 . 1 1 35 35 ILE H H 35 9.034 9.034 9.021 0.013 18518
11634 1 18 . 1 1 36 36 GLU N N 36 122.657 122.657 127.041 -4.384 18518
11635 1 18 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.781 0.080 18518
11636 1 18 . 1 1 36 36 GLU C C 36 173.848 173.848 174.592 -0.744 18518
11637 1 18 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.602 -0.670 18518
11638 1 18 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.062 1.220 18518
11639 1 18 . 1 1 36 36 GLU H H 36 8.303 8.303 8.340 -0.037 18518
11640 1 18 . 1 1 37 37 ARG N N 37 123.228 123.228 125.532 -2.304 18518
11641 1 18 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.576 -0.850 18518
11642 1 18 . 1 1 37 37 ARG C C 37 176.359 176.359 175.801 0.558 18518
11643 1 18 . 1 1 37 37 ARG CA C 37 56.359 56.359 55.950 0.409 18518
11644 1 18 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.990 0.351 18518
11645 1 18 . 1 1 37 37 ARG H H 37 8.856 8.856 8.562 0.294 18518
11646 1 18 . 1 1 38 38 TYR N N 38 128.981 128.981 127.009 1.972 18518
11647 1 18 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.261 0.091 18518
11648 1 18 . 1 1 38 38 TYR C C 38 177.316 177.316 176.504 0.812 18518
11649 1 18 . 1 1 38 38 TYR CA C 38 57.712 57.712 58.478 -0.766 18518
11650 1 18 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.096 -0.624 18518
11651 1 18 . 1 1 38 38 TYR H H 38 8.628 8.628 8.281 0.346 18518
11652 1 18 . 1 1 39 39 LYS N N 39 130.635 130.635 125.015 5.620 18518
11653 1 18 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.864 -0.042 18518
11654 1 18 . 1 1 39 39 LYS CA C 39 58.887 58.887 57.974 0.913 18518
11655 1 18 . 1 1 39 39 LYS CB C 39 31.771 31.771 32.089 -0.318 18518
11656 1 18 . 1 1 39 39 LYS H H 39 8.594 8.594 7.911 0.683 18518
11657 1 18 . 1 1 40 40 GLY C C 40 173.447 173.447 173.992 -0.545 18518
11658 1 18 . 1 1 40 40 GLY CA C 40 44.663 44.663 44.088 0.575 18518
11659 1 18 . 1 1 40 40 GLY H H 40 5.188 5.188 6.714 -1.526 18518
11660 1 18 . 1 1 41 41 GLU N N 41 122.836 122.836 120.612 2.224 18518
11661 1 18 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.352 -0.095 18518
11662 1 18 . 1 1 41 41 GLU C C 41 176.524 176.524 175.924 0.600 18518
11663 1 18 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.040 0.485 18518
11664 1 18 . 1 1 41 41 GLU CB C 41 30.985 30.985 30.001 0.984 18518
11665 1 18 . 1 1 41 41 GLU H H 41 7.380 7.380 7.443 -0.063 18518
11666 1 18 . 1 1 42 42 LYS N N 42 124.040 124.040 123.679 0.361 18518
11667 1 18 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.527 0.147 18518
11668 1 18 . 1 1 42 42 LYS C C 42 177.538 177.538 177.262 0.276 18518
11669 1 18 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.598 -0.758 18518
11670 1 18 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.698 1.281 18518
11671 1 18 . 1 1 42 42 LYS H H 42 9.034 9.034 8.521 0.513 18518
11672 1 18 . 1 1 43 43 GLN N N 43 119.259 119.259 118.440 0.819 18518
11673 1 18 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.384 0.158 18518
11674 1 18 . 1 1 43 43 GLN C C 43 177.336 177.336 176.739 0.597 18518
11675 1 18 . 1 1 43 43 GLN CA C 43 57.673 57.673 56.947 0.726 18518
11676 1 18 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.230 0.552 18518
11677 1 18 . 1 1 43 43 GLN H H 43 8.435 8.435 8.711 -0.276 18518
11678 1 18 . 1 1 44 44 LEU N N 44 120.760 120.760 122.959 -2.199 18518
11679 1 18 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.580 0.115 18518
11680 1 18 . 1 1 44 44 LEU CA C 44 53.245 53.245 53.167 0.078 18518
11681 1 18 . 1 1 44 44 LEU CB C 44 43.596 43.596 41.850 1.746 18518
11682 1 18 . 1 1 44 44 LEU H H 44 9.126 9.126 8.449 0.677 18518
11683 1 18 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.548 0.169 18518
11684 1 18 . 1 1 45 45 PRO C C 45 175.797 175.797 176.230 -0.433 18518
11685 1 18 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.207 -0.096 18518
11686 1 18 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.371 0.221 18518
11687 1 18 . 1 1 46 46 VAL N N 46 119.052 119.052 121.538 -2.486 18518
11688 1 18 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.204 -0.337 18518
11689 1 18 . 1 1 46 46 VAL C C 46 175.640 175.640 176.634 -0.994 18518
11690 1 18 . 1 1 46 46 VAL CA C 46 62.944 62.944 62.565 0.379 18518
11691 1 18 . 1 1 46 46 VAL CB C 46 32.799 32.799 32.284 0.515 18518
11692 1 18 . 1 1 46 46 VAL H H 46 8.543 8.543 8.379 0.164 18518
11693 1 18 . 1 1 47 47 LEU N N 47 130.203 130.203 128.021 2.182 18518
11694 1 18 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.351 -0.042 18518
11695 1 18 . 1 1 47 47 LEU C C 47 176.198 176.198 177.878 -1.680 18518
11696 1 18 . 1 1 47 47 LEU CA C 47 55.006 55.006 54.975 0.031 18518
11697 1 18 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.778 1.054 18518
11698 1 18 . 1 1 47 47 LEU H H 47 7.799 7.799 8.273 -0.474 18518
11699 1 18 . 1 1 48 48 ASP N N 48 122.403 122.403 125.596 -3.193 18518
11700 1 18 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.468 -0.205 18518
11701 1 18 . 1 1 48 48 ASP C C 48 175.294 175.294 176.091 -0.797 18518
11702 1 18 . 1 1 48 48 ASP CA C 48 55.832 55.832 56.078 -0.246 18518
11703 1 18 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.420 -1.236 18518
11704 1 18 . 1 1 48 48 ASP H H 48 8.780 8.780 8.587 0.193 18518
11705 1 18 . 1 1 49 49 LYS N N 49 119.569 119.569 116.352 3.217 18518
11706 1 18 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.525 0.060 18518
11707 1 18 . 1 1 49 49 LYS C C 49 174.678 174.678 175.350 -0.672 18518
11708 1 18 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.641 -1.988 18518
11709 1 18 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.959 0.986 18518
11710 1 18 . 1 1 49 49 LYS H H 49 7.280 7.280 7.566 -0.286 18518
11711 1 18 . 1 1 50 50 THR N N 50 110.862 110.862 114.263 -3.401 18518
11712 1 18 . 1 1 50 50 THR HA H 50 4.811 4.811 4.793 0.018 18518
11713 1 18 . 1 1 50 50 THR C C 50 172.425 172.425 173.930 -1.505 18518
11714 1 18 . 1 1 50 50 THR CA C 50 62.645 62.645 62.846 -0.201 18518
11715 1 18 . 1 1 50 50 THR CB C 50 71.648 71.648 70.060 1.588 18518
11716 1 18 . 1 1 50 50 THR H H 50 8.042 8.042 8.329 -0.287 18518
11717 1 18 . 1 1 51 51 LYS N N 51 120.008 120.008 122.133 -2.125 18518
11718 1 18 . 1 1 51 51 LYS HA H 51 4.625 4.625 5.080 -0.455 18518
11719 1 18 . 1 1 51 51 LYS C C 51 175.082 175.082 175.987 -0.905 18518
11720 1 18 . 1 1 51 51 LYS CA C 51 54.704 54.704 55.465 -0.761 18518
11721 1 18 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.418 -1.042 18518
11722 1 18 . 1 1 51 51 LYS H H 51 7.119 7.119 7.523 -0.404 18518
11723 1 18 . 1 1 52 52 PHE N N 52 122.640 122.640 123.270 -0.630 18518
11724 1 18 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.766 0.571 18518
11725 1 18 . 1 1 52 52 PHE C C 52 174.213 174.213 174.399 -0.186 18518
11726 1 18 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.659 -0.048 18518
11727 1 18 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.339 -0.199 18518
11728 1 18 . 1 1 52 52 PHE H H 52 9.709 9.709 9.247 0.462 18518
11729 1 18 . 1 1 53 53 LEU N N 53 122.157 122.157 123.309 -1.152 18518
11730 1 18 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.889 0.058 18518
11731 1 18 . 1 1 53 53 LEU C C 53 175.769 175.769 175.763 0.006 18518
11732 1 18 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.749 -0.792 18518
11733 1 18 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.416 0.999 18518
11734 1 18 . 1 1 53 53 LEU H H 53 8.959 8.959 8.462 0.497 18518
11735 1 18 . 1 1 54 54 VAL N N 54 124.919 124.919 121.773 3.146 18518
11736 1 18 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.759 -0.200 18518
11737 1 18 . 1 1 54 54 VAL CA C 54 59.130 59.130 57.851 1.279 18518
11738 1 18 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.507 1.461 18518
11739 1 18 . 1 1 54 54 VAL H H 54 8.922 8.922 8.534 0.388 18518
11740 1 18 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.749 -0.308 18518
11741 1 18 . 1 1 55 55 PRO C C 55 176.594 176.594 178.083 -1.489 18518
11742 1 18 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.275 2.040 18518
11743 1 18 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.475 0.190 18518
11744 1 18 . 1 1 56 56 ASP N N 56 120.522 120.522 123.802 -3.280 18518
11745 1 18 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.185 -0.323 18518
11746 1 18 . 1 1 56 56 ASP C C 56 175.809 175.809 176.766 -0.957 18518
11747 1 18 . 1 1 56 56 ASP CA C 56 56.749 56.749 57.254 -0.505 18518
11748 1 18 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.947 -0.437 18518
11749 1 18 . 1 1 56 56 ASP H H 56 8.347 8.347 8.166 0.181 18518
11750 1 18 . 1 1 57 57 HIS N N 57 113.482 113.482 115.725 -2.243 18518
11751 1 18 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.643 0.077 18518
11752 1 18 . 1 1 57 57 HIS C C 57 176.507 176.507 175.980 0.527 18518
11753 1 18 . 1 1 57 57 HIS CA C 57 55.589 55.589 56.152 -0.563 18518
11754 1 18 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.521 1.122 18518
11755 1 18 . 1 1 57 57 HIS H H 57 7.557 7.557 8.117 -0.560 18518
11756 1 18 . 1 1 58 58 VAL N N 58 123.279 123.279 121.760 1.519 18518
11757 1 18 . 1 1 58 58 VAL HA H 58 3.836 3.836 3.959 -0.123 18518
11758 1 18 . 1 1 58 58 VAL C C 58 175.019 175.019 174.946 0.073 18518
11759 1 18 . 1 1 58 58 VAL CA C 58 62.823 62.823 62.580 0.243 18518
11760 1 18 . 1 1 58 58 VAL CB C 58 32.310 32.310 32.740 -0.430 18518
11761 1 18 . 1 1 58 58 VAL H H 58 7.345 7.345 7.205 0.140 18518
11762 1 18 . 1 1 59 59 ASN N N 59 123.781 123.781 122.542 1.239 18518
11763 1 18 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.366 -0.240 18518
11764 1 18 . 1 1 59 59 ASN C C 59 176.558 176.558 176.801 -0.243 18518
11765 1 18 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.455 0.030 18518
11766 1 18 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.949 -0.842 18518
11767 1 18 . 1 1 59 59 ASN H H 59 8.735 8.735 8.315 0.420 18518
11768 1 18 . 1 1 60 60 MET N N 60 117.453 117.453 119.747 -2.294 18518
11769 1 18 . 1 1 60 60 MET HA H 60 4.395 4.395 4.005 0.390 18518
11770 1 18 . 1 1 60 60 MET C C 60 178.144 178.144 178.080 0.064 18518
11771 1 18 . 1 1 60 60 MET CA C 60 57.097 57.097 58.037 -0.940 18518
11772 1 18 . 1 1 60 60 MET CB C 60 30.140 30.140 30.722 -0.582 18518
11773 1 18 . 1 1 60 60 MET H H 60 8.227 8.227 8.598 -0.371 18518
11774 1 18 . 1 1 61 61 SER N N 61 114.216 114.216 115.491 -1.275 18518
11775 1 18 . 1 1 61 61 SER HA H 61 4.111 4.111 4.066 0.045 18518
11776 1 18 . 1 1 61 61 SER C C 61 177.335 177.335 176.677 0.658 18518
11777 1 18 . 1 1 61 61 SER CA C 61 61.590 61.590 62.365 -0.775 18518
11778 1 18 . 1 1 61 61 SER CB C 61 62.402 62.402 62.825 -0.423 18518
11779 1 18 . 1 1 61 61 SER H H 61 8.464 8.464 8.391 0.073 18518
11780 1 18 . 1 1 62 62 GLU N N 62 123.004 123.004 121.493 1.511 18518
11781 1 18 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.114 -0.067 18518
11782 1 18 . 1 1 62 62 GLU C C 62 178.686 178.686 178.763 -0.077 18518
11783 1 18 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.757 -0.132 18518
11784 1 18 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.200 0.454 18518
11785 1 18 . 1 1 62 62 GLU H H 62 7.994 7.994 7.775 0.219 18518
11786 1 18 . 1 1 63 63 LEU N N 63 120.818 120.818 122.611 -1.793 18518
11787 1 18 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.980 -0.015 18518
11788 1 18 . 1 1 63 63 LEU C C 63 178.046 178.046 179.040 -0.994 18518
11789 1 18 . 1 1 63 63 LEU CA C 63 57.920 57.920 57.639 0.281 18518
11790 1 18 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.138 0.486 18518
11791 1 18 . 1 1 63 63 LEU H H 63 8.130 8.130 7.871 0.259 18518
11792 1 18 . 1 1 64 64 ILE N N 64 118.528 118.528 119.160 -0.632 18518
11793 1 18 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.655 -0.286 18518
11794 1 18 . 1 1 64 64 ILE C C 64 177.127 177.127 177.604 -0.477 18518
11795 1 18 . 1 1 64 64 ILE CA C 64 66.678 66.678 64.941 1.737 18518
11796 1 18 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.477 0.967 18518
11797 1 18 . 1 1 64 64 ILE H H 64 8.488 8.488 8.641 -0.153 18518
11798 1 18 . 1 1 65 65 LYS N N 65 118.336 118.336 120.744 -2.408 18518
11799 1 18 . 1 1 65 65 LYS HA H 65 3.701 3.701 4.008 -0.307 18518
11800 1 18 . 1 1 65 65 LYS C C 65 179.291 179.291 179.413 -0.122 18518
11801 1 18 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.676 0.764 18518
11802 1 18 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.113 0.258 18518
11803 1 18 . 1 1 65 65 LYS H H 65 7.347 7.347 7.602 -0.255 18518
11804 1 18 . 1 1 66 66 ILE N N 66 120.171 120.171 120.032 0.139 18518
11805 1 18 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.694 -0.116 18518
11806 1 18 . 1 1 66 66 ILE C C 66 178.873 178.873 178.132 0.741 18518
11807 1 18 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.263 -0.103 18518
11808 1 18 . 1 1 66 66 ILE CB C 66 38.633 38.633 38.001 0.632 18518
11809 1 18 . 1 1 66 66 ILE H H 66 7.901 7.901 8.245 -0.344 18518
11810 1 18 . 1 1 67 67 ILE N N 67 121.185 121.185 120.614 0.571 18518
11811 1 18 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.603 -0.157 18518
11812 1 18 . 1 1 67 67 ILE C C 67 177.150 177.150 177.739 -0.589 18518
11813 1 18 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.642 -1.836 18518
11814 1 18 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.337 -2.342 18518
11815 1 18 . 1 1 67 67 ILE H H 67 8.290 8.290 7.828 0.462 18518
11816 1 18 . 1 1 68 68 ARG N N 68 119.173 119.173 118.829 0.344 18518
11817 1 18 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.725 -0.794 18518
11818 1 18 . 1 1 68 68 ARG C C 68 178.496 178.496 178.645 -0.149 18518
11819 1 18 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.496 1.140 18518
11820 1 18 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.730 0.710 18518
11821 1 18 . 1 1 68 68 ARG H H 68 8.438 8.438 8.421 0.017 18518
11822 1 18 . 1 1 69 69 ARG N N 69 116.511 116.511 120.160 -3.649 18518
11823 1 18 . 1 1 69 69 ARG HA H 69 4.134 4.134 4.040 0.094 18518
11824 1 18 . 1 1 69 69 ARG C C 69 180.262 180.262 178.903 1.359 18518
11825 1 18 . 1 1 69 69 ARG CA C 69 58.707 58.707 58.984 -0.277 18518
11826 1 18 . 1 1 69 69 ARG CB C 69 29.953 29.953 29.995 -0.043 18518
11827 1 18 . 1 1 69 69 ARG H H 69 7.497 7.497 8.155 -0.658 18518
11828 1 18 . 1 1 70 70 ARG N N 70 123.297 123.297 118.653 4.644 18518
11829 1 18 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.131 -0.115 18518
11830 1 18 . 1 1 70 70 ARG C C 70 178.700 178.700 178.278 0.422 18518
11831 1 18 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.599 0.861 18518
11832 1 18 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.685 0.627 18518
11833 1 18 . 1 1 70 70 ARG H H 70 8.075 8.075 7.899 0.176 18518
11834 1 18 . 1 1 71 71 LEU N N 71 116.829 116.829 118.577 -1.748 18518
11835 1 18 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.187 -0.122 18518
11836 1 18 . 1 1 71 71 LEU C C 71 174.956 174.956 176.563 -1.607 18518
11837 1 18 . 1 1 71 71 LEU CA C 71 55.126 55.126 55.508 -0.382 18518
11838 1 18 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.184 1.062 18518
11839 1 18 . 1 1 71 71 LEU H H 71 7.719 7.719 7.682 0.037 18518
11840 1 18 . 1 1 72 72 GLN N N 72 114.991 114.991 115.806 -0.815 18518
11841 1 18 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.854 -0.018 18518
11842 1 18 . 1 1 72 72 GLN C C 72 175.683 175.683 175.409 0.274 18518
11843 1 18 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.170 0.155 18518
11844 1 18 . 1 1 72 72 GLN CB C 72 26.004 26.004 26.450 -0.446 18518
11845 1 18 . 1 1 72 72 GLN H H 72 7.744 7.744 7.682 0.062 18518
11846 1 18 . 1 1 73 73 LEU N N 73 115.045 115.045 118.565 -3.520 18518
11847 1 18 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.211 0.025 18518
11848 1 18 . 1 1 73 73 LEU C C 73 178.762 178.762 177.847 0.915 18518
11849 1 18 . 1 1 73 73 LEU CA C 73 54.386 54.386 54.248 0.138 18518
11850 1 18 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.835 0.256 18518
11851 1 18 . 1 1 73 73 LEU H H 73 7.500 7.500 7.844 -0.344 18518
11852 1 18 . 1 1 74 74 ASN N N 74 121.700 121.700 118.360 3.340 18518
11853 1 18 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.509 0.181 18518
11854 1 18 . 1 1 74 74 ASN C C 74 176.617 176.617 175.679 0.938 18518
11855 1 18 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.803 -1.118 18518
11856 1 18 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.655 -0.057 18518
11857 1 18 . 1 1 74 74 ASN H H 74 9.045 9.045 8.571 0.474 18518
11858 1 18 . 1 1 75 75 ALA N N 75 123.952 123.952 123.075 0.877 18518
11859 1 18 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.340 -0.376 18518
11860 1 18 . 1 1 75 75 ALA C C 75 178.131 178.131 177.396 0.735 18518
11861 1 18 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.746 1.122 18518
11862 1 18 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.167 -0.449 18518
11863 1 18 . 1 1 75 75 ALA H H 75 8.784 8.784 8.578 0.206 18518
11864 1 18 . 1 1 76 76 ASN N N 76 112.295 112.295 115.664 -3.369 18518
11865 1 18 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.635 -0.055 18518
11866 1 18 . 1 1 76 76 ASN C C 76 175.448 175.448 175.049 0.399 18518
11867 1 18 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.032 0.181 18518
11868 1 18 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.953 -0.633 18518
11869 1 18 . 1 1 76 76 ASN H H 76 8.391 8.391 8.594 -0.203 18518
11870 1 18 . 1 1 77 77 GLN N N 77 120.577 120.577 118.309 2.268 18518
11871 1 18 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.679 -0.406 18518
11872 1 18 . 1 1 77 77 GLN C C 77 175.045 175.045 174.400 0.645 18518
11873 1 18 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.795 1.010 18518
11874 1 18 . 1 1 77 77 GLN CB C 77 30.157 30.157 30.561 -0.404 18518
11875 1 18 . 1 1 77 77 GLN H H 77 7.552 7.552 7.507 0.045 18518
11876 1 18 . 1 1 78 78 ALA N N 78 130.670 130.670 124.606 6.064 18518
11877 1 18 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.625 -0.454 18518
11878 1 18 . 1 1 78 78 ALA C C 78 176.512 176.512 175.245 1.267 18518
11879 1 18 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.346 1.496 18518
11880 1 18 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.481 -1.421 18518
11881 1 18 . 1 1 78 78 ALA H H 78 8.799 8.799 8.703 0.096 18518
11882 1 18 . 1 1 79 79 PHE N N 79 119.325 119.325 115.880 3.445 18518
11883 1 18 . 1 1 79 79 PHE HA H 79 4.434 4.434 4.740 -0.306 18518
11884 1 18 . 1 1 79 79 PHE C C 79 171.726 171.726 172.706 -0.980 18518
11885 1 18 . 1 1 79 79 PHE CA C 79 59.145 59.145 55.061 4.084 18518
11886 1 18 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.410 0.761 18518
11887 1 18 . 1 1 79 79 PHE H H 79 7.664 7.664 8.160 -0.496 18518
11888 1 18 . 1 1 80 80 PHE N N 80 126.314 126.314 117.176 9.138 18518
11889 1 18 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.412 -0.020 18518
11890 1 18 . 1 1 80 80 PHE C C 80 177.169 177.169 173.064 4.105 18518
11891 1 18 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.283 0.370 18518
11892 1 18 . 1 1 80 80 PHE CB C 80 41.933 41.933 42.471 -0.538 18518
11893 1 18 . 1 1 80 80 PHE H H 80 8.508 8.508 8.900 -0.392 18518
11894 1 18 . 1 1 81 81 LEU N N 81 121.426 121.426 121.214 0.212 18518
11895 1 18 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.264 -0.413 18518
11896 1 18 . 1 1 81 81 LEU C C 81 174.488 174.488 174.601 -0.113 18518
11897 1 18 . 1 1 81 81 LEU CA C 81 53.197 53.197 53.856 -0.659 18518
11898 1 18 . 1 1 81 81 LEU CB C 81 45.100 45.100 45.329 -0.229 18518
11899 1 18 . 1 1 81 81 LEU H H 81 8.229 8.229 8.460 -0.231 18518
11900 1 18 . 1 1 82 82 LEU N N 82 125.155 125.155 125.614 -0.459 18518
11901 1 18 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.614 0.219 18518
11902 1 18 . 1 1 82 82 LEU C C 82 177.166 177.166 174.990 2.176 18518
11903 1 18 . 1 1 82 82 LEU CA C 82 54.197 54.197 53.944 0.253 18518
11904 1 18 . 1 1 82 82 LEU CB C 82 43.442 43.442 45.120 -1.678 18518
11905 1 18 . 1 1 82 82 LEU H H 82 9.400 9.400 9.205 0.195 18518
11906 1 18 . 1 1 83 83 VAL N N 83 123.886 123.886 122.342 1.544 18518
11907 1 18 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.486 -0.107 18518
11908 1 18 . 1 1 83 83 VAL C C 83 175.810 175.810 176.952 -1.142 18518
11909 1 18 . 1 1 83 83 VAL CA C 83 61.677 61.677 61.807 -0.130 18518
11910 1 18 . 1 1 83 83 VAL CB C 83 33.758 33.758 31.468 2.290 18518
11911 1 18 . 1 1 83 83 VAL H H 83 8.721 8.721 8.646 0.075 18518
11912 1 18 . 1 1 84 84 ASN N N 84 126.474 126.474 127.844 -1.370 18518
11913 1 18 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.472 -0.076 18518
11914 1 18 . 1 1 84 84 ASN C C 84 175.164 175.164 175.325 -0.161 18518
11915 1 18 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.526 0.212 18518
11916 1 18 . 1 1 84 84 ASN CB C 84 37.950 37.950 36.926 1.024 18518
11917 1 18 . 1 1 84 84 ASN H H 84 9.707 9.707 9.478 0.229 18518
11918 1 18 . 1 1 85 85 GLY N N 85 101.296 101.296 104.734 -3.438 18518
11919 1 18 . 1 1 85 85 GLY C C 85 173.680 173.680 173.337 0.343 18518
11920 1 18 . 1 1 85 85 GLY CA C 85 45.603 45.603 45.095 0.508 18518
11921 1 18 . 1 1 85 85 GLY H H 85 8.644 8.644 8.082 0.562 18518
11922 1 18 . 1 1 86 86 HIS N N 86 117.238 117.238 118.891 -1.653 18518
11923 1 18 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.684 0.333 18518
11924 1 18 . 1 1 86 86 HIS C C 86 173.841 173.841 173.718 0.123 18518
11925 1 18 . 1 1 86 86 HIS CA C 86 53.796 53.796 54.564 -0.768 18518
11926 1 18 . 1 1 86 86 HIS CB C 86 31.280 31.280 32.587 -1.308 18518
11927 1 18 . 1 1 86 86 HIS H H 86 7.918 7.918 8.172 -0.254 18518
11928 1 18 . 1 1 87 87 SER N N 87 118.179 118.179 118.837 -0.658 18518
11929 1 18 . 1 1 87 87 SER HA H 87 4.699 4.699 4.594 0.105 18518
11930 1 18 . 1 1 87 87 SER C C 87 175.904 175.904 174.446 1.458 18518
11931 1 18 . 1 1 87 87 SER CA C 87 58.271 58.271 58.054 0.217 18518
11932 1 18 . 1 1 87 87 SER CB C 87 63.735 63.735 62.682 1.053 18518
11933 1 18 . 1 1 87 87 SER H H 87 8.977 8.977 8.723 0.254 18518
11934 1 18 . 1 1 88 88 MET N N 88 125.472 125.472 125.432 0.040 18518
11935 1 18 . 1 1 88 88 MET HA H 88 4.830 4.830 4.595 0.235 18518
11936 1 18 . 1 1 88 88 MET C C 88 176.419 176.419 175.561 0.858 18518
11937 1 18 . 1 1 88 88 MET CA C 88 54.899 54.899 54.956 -0.057 18518
11938 1 18 . 1 1 88 88 MET CB C 88 33.336 33.336 33.451 -0.115 18518
11939 1 18 . 1 1 88 88 MET H H 88 9.184 9.184 8.570 0.614 18518
11940 1 18 . 1 1 89 89 VAL N N 89 120.747 120.747 121.616 -0.869 18518
11941 1 18 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.196 0.036 18518
11942 1 18 . 1 1 89 89 VAL C C 89 175.958 175.958 174.966 0.992 18518
11943 1 18 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.700 1.454 18518
11944 1 18 . 1 1 89 89 VAL CB C 89 31.878 31.878 32.996 -1.118 18518
11945 1 18 . 1 1 89 89 VAL H H 89 8.233 8.233 7.773 0.460 18518
11946 1 18 . 1 1 90 90 SER N N 90 117.362 117.362 123.582 -6.220 18518
11947 1 18 . 1 1 90 90 SER HA H 90 4.590 4.590 4.616 -0.026 18518
11948 1 18 . 1 1 90 90 SER C C 90 175.741 175.741 175.574 0.167 18518
11949 1 18 . 1 1 90 90 SER CA C 90 57.717 57.717 57.323 0.394 18518
11950 1 18 . 1 1 90 90 SER CB C 90 63.223 63.223 64.349 -1.126 18518
11951 1 18 . 1 1 90 90 SER H H 90 8.482 8.482 8.449 0.033 18518
11952 1 18 . 1 1 91 91 VAL N N 91 120.466 120.466 122.375 -1.909 18518
11953 1 18 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.838 0.209 18518
11954 1 18 . 1 1 91 91 VAL C C 91 176.329 176.329 175.960 0.369 18518
11955 1 18 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.442 -0.950 18518
11956 1 18 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.817 0.751 18518
11957 1 18 . 1 1 91 91 VAL H H 91 8.188 8.188 8.668 -0.480 18518
11958 1 18 . 1 1 92 92 SER N N 92 116.398 116.398 114.169 2.229 18518
11959 1 18 . 1 1 92 92 SER HA H 92 4.636 4.636 4.669 -0.033 18518
11960 1 18 . 1 1 92 92 SER C C 92 174.159 174.159 173.626 0.533 18518
11961 1 18 . 1 1 92 92 SER CA C 92 57.805 57.805 57.729 0.076 18518
11962 1 18 . 1 1 92 92 SER CB C 92 63.046 63.046 63.257 -0.211 18518
11963 1 18 . 1 1 92 92 SER H H 92 8.370 8.370 8.155 0.215 18518
11964 1 18 . 1 1 93 93 THR N N 93 119.211 119.211 118.774 0.437 18518
11965 1 18 . 1 1 93 93 THR HA H 93 4.484 4.484 4.856 -0.372 18518
11966 1 18 . 1 1 93 93 THR CA C 93 60.884 60.884 60.048 0.836 18518
11967 1 18 . 1 1 93 93 THR CB C 93 70.609 70.609 69.624 0.985 18518
11968 1 18 . 1 1 93 93 THR H H 93 7.416 7.416 7.483 -0.067 18518
11969 1 18 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.780 -0.340 18518
11970 1 18 . 1 1 94 94 PRO C C 94 178.775 178.775 177.454 1.321 18518
11971 1 18 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.470 0.473 18518
11972 1 18 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.594 0.054 18518
11973 1 18 . 1 1 95 95 ILE N N 95 124.174 124.174 123.752 0.422 18518
11974 1 18 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.830 0.119 18518
11975 1 18 . 1 1 95 95 ILE C C 95 176.498 176.498 177.254 -0.756 18518
11976 1 18 . 1 1 95 95 ILE CA C 95 63.904 63.904 61.644 2.260 18518
11977 1 18 . 1 1 95 95 ILE CB C 95 38.182 38.182 37.974 0.208 18518
11978 1 18 . 1 1 95 95 ILE H H 95 9.305 9.305 8.657 0.648 18518
11979 1 18 . 1 1 96 96 SER N N 96 116.920 116.920 115.740 1.180 18518
11980 1 18 . 1 1 96 96 SER HA H 96 4.029 4.029 4.036 -0.007 18518
11981 1 18 . 1 1 96 96 SER C C 96 176.574 176.574 176.074 0.500 18518
11982 1 18 . 1 1 96 96 SER CA C 96 61.356 61.356 62.980 -1.624 18518
11983 1 18 . 1 1 96 96 SER CB C 96 61.723 61.723 62.854 -1.131 18518
11984 1 18 . 1 1 96 96 SER H H 96 8.335 8.335 8.021 0.314 18518
11985 1 18 . 1 1 97 97 GLU N N 97 123.255 123.255 121.161 2.094 18518
11986 1 18 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.171 0.107 18518
11987 1 18 . 1 1 97 97 GLU C C 97 179.716 179.716 178.820 0.896 18518
11988 1 18 . 1 1 97 97 GLU CA C 97 58.792 58.792 59.050 -0.258 18518
11989 1 18 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.254 0.308 18518
11990 1 18 . 1 1 97 97 GLU H H 97 7.376 7.376 7.794 -0.418 18518
11991 1 18 . 1 1 98 98 VAL N N 98 121.137 121.137 120.978 0.159 18518
11992 1 18 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.600 0.202 18518
11993 1 18 . 1 1 98 98 VAL C C 98 177.637 177.637 178.058 -0.421 18518
11994 1 18 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.496 -0.672 18518
11995 1 18 . 1 1 98 98 VAL CB C 98 32.154 32.154 31.513 0.641 18518
11996 1 18 . 1 1 98 98 VAL H H 98 7.387 7.387 7.857 -0.470 18518
11997 1 18 . 1 1 99 99 TYR N N 99 118.927 118.927 121.397 -2.470 18518
11998 1 18 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.034 -0.044 18518
11999 1 18 . 1 1 99 99 TYR C C 99 176.081 176.081 176.898 -0.817 18518
12000 1 18 . 1 1 99 99 TYR CA C 99 62.223 62.223 61.883 0.340 18518
12001 1 18 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.592 0.390 18518
12002 1 18 . 1 1 99 99 TYR H H 99 9.048 9.048 8.385 0.663 18518
12003 1 18 . 1 1 100 100 GLU N N 100 113.894 113.894 116.787 -2.893 18518
12004 1 18 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.743 0.103 18518
12005 1 18 . 1 1 100 100 GLU C C 100 177.989 177.989 179.434 -1.445 18518
12006 1 18 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.800 0.287 18518
12007 1 18 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.997 0.385 18518
12008 1 18 . 1 1 100 100 GLU H H 100 7.422 7.422 8.266 -0.844 18518
12009 1 18 . 1 1 101 101 SER N N 101 108.991 108.991 115.037 -6.046 18518
12010 1 18 . 1 1 101 101 SER HA H 101 4.524 4.524 4.357 0.167 18518
12011 1 18 . 1 1 101 101 SER C C 101 176.628 176.628 175.601 1.027 18518
12012 1 18 . 1 1 101 101 SER CA C 101 60.349 60.349 60.689 -0.340 18518
12013 1 18 . 1 1 101 101 SER CB C 101 64.741 64.741 63.468 1.273 18518
12014 1 18 . 1 1 101 101 SER H H 101 7.424 7.424 8.291 -0.867 18518
12015 1 18 . 1 1 102 102 GLU N N 102 116.533 116.533 118.426 -1.893 18518
12016 1 18 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.526 0.218 18518
12017 1 18 . 1 1 102 102 GLU C C 102 176.774 176.774 176.124 0.650 18518
12018 1 18 . 1 1 102 102 GLU CA C 102 55.581 55.581 54.922 0.659 18518
12019 1 18 . 1 1 102 102 GLU CB C 102 30.697 30.697 30.611 0.086 18518
12020 1 18 . 1 1 102 102 GLU H H 102 8.487 8.487 7.905 0.582 18518
12021 1 18 . 1 1 103 103 LYS N N 103 118.370 118.370 120.724 -2.354 18518
12022 1 18 . 1 1 103 103 LYS HA H 103 4.178 4.178 3.810 0.368 18518
12023 1 18 . 1 1 103 103 LYS C C 103 175.018 175.018 176.592 -1.574 18518
12024 1 18 . 1 1 103 103 LYS CA C 103 57.329 57.329 57.710 -0.381 18518
12025 1 18 . 1 1 103 103 LYS CB C 103 32.186 32.186 32.469 -0.284 18518
12026 1 18 . 1 1 103 103 LYS H H 103 7.831 7.831 7.600 0.231 18518
12027 1 18 . 1 1 104 104 ASP N N 104 123.500 123.500 125.590 -2.090 18518
12028 1 18 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.672 0.083 18518
12029 1 18 . 1 1 104 104 ASP C C 104 177.383 177.383 177.247 0.136 18518
12030 1 18 . 1 1 104 104 ASP CA C 104 53.846 53.846 53.264 0.582 18518
12031 1 18 . 1 1 104 104 ASP CB C 104 43.411 43.411 43.059 0.352 18518
12032 1 18 . 1 1 104 104 ASP H H 104 9.041 9.041 7.998 1.043 18518
12033 1 18 . 1 1 105 105 GLU N N 105 125.448 125.448 120.255 5.193 18518
12034 1 18 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.111 0.069 18518
12035 1 18 . 1 1 105 105 GLU C C 105 177.519 177.519 176.703 0.816 18518
12036 1 18 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.953 0.576 18518
12037 1 18 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.688 0.356 18518
12038 1 18 . 1 1 105 105 GLU H H 105 8.906 8.906 8.806 0.100 18518
12039 1 18 . 1 1 106 106 ASP N N 106 118.824 118.824 115.563 3.261 18518
12040 1 18 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.673 -0.494 18518
12041 1 18 . 1 1 106 106 ASP C C 106 176.223 176.223 177.064 -0.841 18518
12042 1 18 . 1 1 106 106 ASP CA C 106 54.756 54.756 53.553 1.203 18518
12043 1 18 . 1 1 106 106 ASP CB C 106 39.999 39.999 39.992 0.007 18518
12044 1 18 . 1 1 106 106 ASP H H 106 10.036 10.036 8.196 1.840 18518
12045 1 18 . 1 1 107 107 GLY N N 107 105.866 105.866 106.673 -0.807 18518
12046 1 18 . 1 1 107 107 GLY C C 107 175.136 175.136 174.373 0.763 18518
12047 1 18 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.440 -0.218 18518
12048 1 18 . 1 1 107 107 GLY H H 107 8.001 8.001 7.773 0.228 18518
12049 1 18 . 1 1 108 108 PHE N N 108 123.820 123.820 122.413 1.407 18518
12050 1 18 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.740 -0.078 18518
12051 1 18 . 1 1 108 108 PHE C C 108 174.899 174.899 174.711 0.188 18518
12052 1 18 . 1 1 108 108 PHE CA C 108 60.238 60.238 59.475 0.763 18518
12053 1 18 . 1 1 108 108 PHE CB C 108 40.365 40.365 40.881 -0.516 18518
12054 1 18 . 1 1 108 108 PHE H H 108 9.912 9.912 8.069 1.843 18518
12055 1 18 . 1 1 109 109 LEU N N 109 120.130 120.130 124.079 -3.949 18518
12056 1 18 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.908 0.122 18518
12057 1 18 . 1 1 109 109 LEU C C 109 173.916 173.916 174.745 -0.829 18518
12058 1 18 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.963 -0.539 18518
12059 1 18 . 1 1 109 109 LEU CB C 109 45.203 45.203 44.499 0.704 18518
12060 1 18 . 1 1 109 109 LEU H H 109 7.997 7.997 8.808 -0.811 18518
12061 1 18 . 1 1 110 110 TYR N N 110 126.579 126.579 126.725 -0.146 18518
12062 1 18 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.676 0.327 18518
12063 1 18 . 1 1 110 110 TYR C C 110 176.671 176.671 175.331 1.340 18518
12064 1 18 . 1 1 110 110 TYR CA C 110 59.058 59.058 58.296 0.762 18518
12065 1 18 . 1 1 110 110 TYR CB C 110 39.556 39.556 39.252 0.304 18518
12066 1 18 . 1 1 110 110 TYR H H 110 9.377 9.377 9.073 0.304 18518
12067 1 18 . 1 1 111 111 MET N N 111 119.240 119.240 121.958 -2.718 18518
12068 1 18 . 1 1 111 111 MET HA H 111 5.486 5.486 5.296 0.190 18518
12069 1 18 . 1 1 111 111 MET C C 111 175.695 175.695 174.712 0.983 18518
12070 1 18 . 1 1 111 111 MET CA C 111 54.124 54.124 54.690 -0.566 18518
12071 1 18 . 1 1 111 111 MET CB C 111 36.960 36.960 37.654 -0.694 18518
12072 1 18 . 1 1 111 111 MET H H 111 9.658 9.658 9.026 0.632 18518
12073 1 18 . 1 1 112 112 VAL N N 112 119.865 119.865 118.864 1.001 18518
12074 1 18 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.407 0.556 18518
12075 1 18 . 1 1 112 112 VAL C C 112 175.058 175.058 174.490 0.568 18518
12076 1 18 . 1 1 112 112 VAL CA C 112 58.911 58.911 60.472 -1.561 18518
12077 1 18 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.479 0.572 18518
12078 1 18 . 1 1 112 112 VAL H H 112 8.794 8.794 9.245 -0.451 18518
12079 1 18 . 1 1 113 113 TYR N N 113 119.664 119.664 121.000 -1.336 18518
12080 1 18 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.584 0.534 18518
12081 1 18 . 1 1 113 113 TYR C C 113 173.375 173.375 173.516 -0.141 18518
12082 1 18 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.144 -0.991 18518
12083 1 18 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.747 1.565 18518
12084 1 18 . 1 1 113 113 TYR H H 113 8.315 8.315 8.567 -0.252 18518
12085 1 18 . 1 1 114 114 ALA N N 114 119.763 119.763 123.624 -3.861 18518
12086 1 18 . 1 1 114 114 ALA HA H 114 4.800 4.800 5.035 -0.235 18518
12087 1 18 . 1 1 114 114 ALA C C 114 176.216 176.216 175.185 1.031 18518
12088 1 18 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.873 -0.741 18518
12089 1 18 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.471 2.125 18518
12090 1 18 . 1 1 114 114 ALA H H 114 8.465 8.465 8.861 -0.396 18518
12091 1 18 . 1 1 115 115 SER N N 115 114.763 114.763 116.002 -1.239 18518
12092 1 18 . 1 1 115 115 SER HA H 115 4.496 4.496 4.861 -0.365 18518
12093 1 18 . 1 1 115 115 SER C C 115 172.671 172.671 173.613 -0.942 18518
12094 1 18 . 1 1 115 115 SER CA C 115 58.651 58.651 57.297 1.354 18518
12095 1 18 . 1 1 115 115 SER CB C 115 63.526 63.526 62.559 0.966 18518
12096 1 18 . 1 1 115 115 SER H H 115 9.915 9.915 9.249 0.666 18518
12097 1 18 . 1 1 116 116 GLN N N 116 116.611 116.611 123.435 -6.824 18518
12098 1 18 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.647 -0.163 18518
12099 1 18 . 1 1 116 116 GLN C C 116 172.733 172.733 173.824 -1.091 18518
12100 1 18 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.964 -2.038 18518
12101 1 18 . 1 1 116 116 GLN CB C 116 32.358 32.358 31.271 1.087 18518
12102 1 18 . 1 1 116 116 GLN H H 116 7.219 7.219 8.110 -0.891 18518
12103 1 18 . 1 1 117 117 GLU N N 117 117.623 117.623 120.661 -3.038 18518
12104 1 18 . 1 1 117 117 GLU HA H 117 3.287 3.287 3.435 -0.148 18518
12105 1 18 . 1 1 117 117 GLU C C 117 175.168 175.168 175.531 -0.363 18518
12106 1 18 . 1 1 117 117 GLU CA C 117 56.882 56.882 56.178 0.704 18518
12107 1 18 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.520 1.002 18518
12108 1 18 . 1 1 117 117 GLU H H 117 7.882 7.882 8.529 -0.647 18518
12109 1 18 . 1 1 118 118 THR N N 118 109.820 109.820 112.372 -2.552 18518
12110 1 18 . 1 1 118 118 THR HA H 118 4.066 4.066 4.332 -0.266 18518
12111 1 18 . 1 1 118 118 THR C C 118 172.355 172.355 174.099 -1.744 18518
12112 1 18 . 1 1 118 118 THR CA C 118 60.029 60.029 61.092 -1.063 18518
12113 1 18 . 1 1 118 118 THR CB C 118 70.480 70.480 69.425 1.055 18518
12114 1 18 . 1 1 118 118 THR H H 118 6.992 6.992 7.461 -0.469 18518
12115 1 19 . 1 1 2 2 ALA HA H 2 4.336 4.336 5.215 -0.879 18518
12116 1 19 . 1 1 2 2 ALA C C 2 177.974 177.974 176.276 1.698 18518
12117 1 19 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.541 1.244 18518
12118 1 19 . 1 1 2 2 ALA CB C 2 19.444 19.444 21.183 -1.739 18518
12119 1 19 . 1 1 3 3 MET N N 3 119.311 119.311 119.855 -0.544 18518
12120 1 19 . 1 1 3 3 MET HA H 3 4.451 4.451 4.739 -0.288 18518
12121 1 19 . 1 1 3 3 MET C C 3 176.913 176.913 175.973 0.940 18518
12122 1 19 . 1 1 3 3 MET CA C 3 55.679 55.679 54.840 0.839 18518
12123 1 19 . 1 1 3 3 MET CB C 3 32.590 32.590 35.306 -2.716 18518
12124 1 19 . 1 1 3 3 MET H H 3 8.638 8.638 8.583 0.055 18518
12125 1 19 . 1 1 4 4 GLY N N 4 110.281 110.281 109.865 0.416 18518
12126 1 19 . 1 1 4 4 GLY C C 4 174.180 174.180 173.933 0.247 18518
12127 1 19 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.790 0.705 18518
12128 1 19 . 1 1 4 4 GLY H H 4 8.552 8.552 8.541 0.011 18518
12129 1 19 . 1 1 5 5 LYS N N 5 120.818 120.818 126.010 -5.192 18518
12130 1 19 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.538 -0.029 18518
12131 1 19 . 1 1 5 5 LYS C C 5 177.605 177.605 176.720 0.885 18518
12132 1 19 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.333 0.801 18518
12133 1 19 . 1 1 5 5 LYS CB C 5 34.813 34.813 33.571 1.242 18518
12134 1 19 . 1 1 5 5 LYS H H 5 8.133 8.133 8.326 -0.193 18518
12135 1 19 . 1 1 6 6 THR N N 6 114.781 114.781 114.329 0.452 18518
12136 1 19 . 1 1 6 6 THR HA H 6 4.421 4.421 4.397 0.024 18518
12137 1 19 . 1 1 6 6 THR C C 6 175.524 175.524 176.265 -0.741 18518
12138 1 19 . 1 1 6 6 THR CA C 6 61.127 61.127 60.839 0.288 18518
12139 1 19 . 1 1 6 6 THR CB C 6 69.926 69.926 70.115 -0.189 18518
12140 1 19 . 1 1 6 6 THR H H 6 8.483 8.483 8.366 0.117 18518
12141 1 19 . 1 1 7 7 PHE N N 7 125.552 125.552 118.732 6.820 18518
12142 1 19 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.210 -0.205 18518
12143 1 19 . 1 1 7 7 PHE C C 7 177.397 177.397 177.389 0.008 18518
12144 1 19 . 1 1 7 7 PHE CA C 7 63.393 63.393 60.459 2.933 18518
12145 1 19 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.165 1.402 18518
12146 1 19 . 1 1 7 7 PHE H H 7 10.245 10.245 8.554 1.691 18518
12147 1 19 . 1 1 8 8 LYS N N 8 114.053 114.053 119.398 -5.345 18518
12148 1 19 . 1 1 8 8 LYS HA H 8 3.835 3.835 4.007 -0.172 18518
12149 1 19 . 1 1 8 8 LYS C C 8 175.520 175.520 178.147 -2.627 18518
12150 1 19 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.915 1.078 18518
12151 1 19 . 1 1 8 8 LYS CB C 8 33.689 33.689 32.033 1.656 18518
12152 1 19 . 1 1 8 8 LYS H H 8 8.775 8.775 7.220 1.555 18518
12153 1 19 . 1 1 9 9 GLN N N 9 113.516 113.516 116.725 -3.209 18518
12154 1 19 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.120 0.029 18518
12155 1 19 . 1 1 9 9 GLN C C 9 177.615 177.615 178.535 -0.920 18518
12156 1 19 . 1 1 9 9 GLN CA C 9 56.819 56.819 57.827 -1.008 18518
12157 1 19 . 1 1 9 9 GLN CB C 9 30.019 30.019 28.898 1.121 18518
12158 1 19 . 1 1 9 9 GLN H H 9 7.355 7.355 7.314 0.041 18518
12159 1 19 . 1 1 10 10 ARG N N 10 118.294 118.294 117.527 0.767 18518
12160 1 19 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.263 0.039 18518
12161 1 19 . 1 1 10 10 ARG C C 10 179.380 179.380 177.414 1.966 18518
12162 1 19 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.383 -0.115 18518
12163 1 19 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.808 0.834 18518
12164 1 19 . 1 1 10 10 ARG H H 10 7.936 7.936 8.015 -0.079 18518
12165 1 19 . 1 1 11 11 ARG N N 11 121.137 121.137 119.950 1.187 18518
12166 1 19 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.613 0.067 18518
12167 1 19 . 1 1 11 11 ARG CA C 11 53.453 53.453 54.973 -1.520 18518
12168 1 19 . 1 1 11 11 ARG CB C 11 32.938 32.938 32.078 0.860 18518
12169 1 19 . 1 1 11 11 ARG H H 11 7.390 7.390 7.591 -0.201 18518
12170 1 19 . 1 1 12 12 THR N N 12 116.819 116.819 119.035 -2.216 18518
12171 1 19 . 1 1 12 12 THR HA H 12 4.359 4.359 4.376 -0.017 18518
12172 1 19 . 1 1 12 12 THR C C 12 174.989 174.989 176.591 -1.602 18518
12173 1 19 . 1 1 12 12 THR CA C 12 61.748 61.748 62.551 -0.803 18518
12174 1 19 . 1 1 12 12 THR CB C 12 71.068 71.068 70.190 0.878 18518
12175 1 19 . 1 1 12 12 THR H H 12 8.953 8.953 8.535 0.418 18518
12176 1 19 . 1 1 13 13 PHE N N 13 123.200 123.200 122.886 0.314 18518
12177 1 19 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.210 -0.182 18518
12178 1 19 . 1 1 13 13 PHE C C 13 176.029 176.029 177.018 -0.989 18518
12179 1 19 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.329 0.535 18518
12180 1 19 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.185 0.375 18518
12181 1 19 . 1 1 13 13 PHE H H 13 9.284 9.284 9.017 0.267 18518
12182 1 19 . 1 1 14 14 GLU N N 14 115.414 115.414 117.576 -2.162 18518
12183 1 19 . 1 1 14 14 GLU HA H 14 3.794 3.794 3.781 0.013 18518
12184 1 19 . 1 1 14 14 GLU C C 14 180.081 180.081 178.972 1.109 18518
12185 1 19 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.716 0.903 18518
12186 1 19 . 1 1 14 14 GLU CB C 14 28.852 28.852 29.042 -0.190 18518
12187 1 19 . 1 1 14 14 GLU H H 14 8.973 8.973 8.735 0.238 18518
12188 1 19 . 1 1 15 15 GLN N N 15 119.276 119.276 118.057 1.219 18518
12189 1 19 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.163 -0.163 18518
12190 1 19 . 1 1 15 15 GLN C C 15 177.978 177.978 178.641 -0.663 18518
12191 1 19 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.208 0.627 18518
12192 1 19 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.023 1.347 18518
12193 1 19 . 1 1 15 15 GLN H H 15 7.756 7.756 7.870 -0.114 18518
12194 1 19 . 1 1 16 16 ARG N N 16 121.336 121.336 119.978 1.358 18518
12195 1 19 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.171 0.099 18518
12196 1 19 . 1 1 16 16 ARG C C 16 177.416 177.416 178.747 -1.331 18518
12197 1 19 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.634 1.741 18518
12198 1 19 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.287 0.318 18518
12199 1 19 . 1 1 16 16 ARG H H 16 8.645 8.645 8.238 0.407 18518
12200 1 19 . 1 1 17 17 VAL N N 17 117.630 117.630 116.850 0.780 18518
12201 1 19 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.734 0.123 18518
12202 1 19 . 1 1 17 17 VAL C C 17 179.748 179.748 177.565 2.183 18518
12203 1 19 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.778 -0.052 18518
12204 1 19 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.297 0.897 18518
12205 1 19 . 1 1 17 17 VAL H H 17 8.373 8.373 8.075 0.298 18518
12206 1 19 . 1 1 18 18 GLU N N 18 120.864 120.864 120.293 0.571 18518
12207 1 19 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.849 0.453 18518
12208 1 19 . 1 1 18 18 GLU C C 18 177.728 177.728 178.173 -0.445 18518
12209 1 19 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.844 -1.358 18518
12210 1 19 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.391 -0.009 18518
12211 1 19 . 1 1 18 18 GLU H H 18 7.368 7.368 7.949 -0.581 18518
12212 1 19 . 1 1 19 19 ASP N N 19 121.425 121.425 119.813 1.612 18518
12213 1 19 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.420 0.014 18518
12214 1 19 . 1 1 19 19 ASP C C 19 179.978 179.978 178.464 1.514 18518
12215 1 19 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.170 0.252 18518
12216 1 19 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.839 0.448 18518
12217 1 19 . 1 1 19 19 ASP H H 19 8.671 8.671 7.975 0.696 18518
12218 1 19 . 1 1 20 20 VAL N N 20 119.730 119.730 120.788 -1.058 18518
12219 1 19 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.474 -0.269 18518
12220 1 19 . 1 1 20 20 VAL C C 20 176.284 176.284 177.110 -0.826 18518
12221 1 19 . 1 1 20 20 VAL CA C 20 66.315 66.315 65.689 0.626 18518
12222 1 19 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.202 -0.095 18518
12223 1 19 . 1 1 20 20 VAL H H 20 7.999 7.999 7.720 0.279 18518
12224 1 19 . 1 1 21 21 ARG N N 21 121.455 121.455 119.711 1.744 18518
12225 1 19 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.955 -0.141 18518
12226 1 19 . 1 1 21 21 ARG C C 21 180.120 180.120 178.690 1.430 18518
12227 1 19 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.920 0.910 18518
12228 1 19 . 1 1 21 21 ARG CB C 21 29.946 29.946 28.966 0.980 18518
12229 1 19 . 1 1 21 21 ARG H H 21 8.098 8.098 7.965 0.134 18518
12230 1 19 . 1 1 22 22 LEU N N 22 117.826 117.826 120.622 -2.796 18518
12231 1 19 . 1 1 22 22 LEU HA H 22 4.049 4.049 3.927 0.122 18518
12232 1 19 . 1 1 22 22 LEU C C 22 180.115 180.115 179.247 0.868 18518
12233 1 19 . 1 1 22 22 LEU CA C 22 57.790 57.790 58.056 -0.266 18518
12234 1 19 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.758 0.384 18518
12235 1 19 . 1 1 22 22 LEU H H 22 8.207 8.207 8.162 0.045 18518
12236 1 19 . 1 1 23 23 ILE N N 23 121.450 121.450 118.588 2.862 18518
12237 1 19 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.825 0.188 18518
12238 1 19 . 1 1 23 23 ILE C C 23 178.149 178.149 178.546 -0.397 18518
12239 1 19 . 1 1 23 23 ILE CA C 23 62.171 62.171 63.899 -1.728 18518
12240 1 19 . 1 1 23 23 ILE CB C 23 38.106 38.106 36.765 1.341 18518
12241 1 19 . 1 1 23 23 ILE H H 23 8.105 8.105 7.992 0.113 18518
12242 1 19 . 1 1 24 24 ARG N N 24 121.139 121.139 119.230 1.909 18518
12243 1 19 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.250 -0.263 18518
12244 1 19 . 1 1 24 24 ARG C C 24 178.702 178.702 179.165 -0.463 18518
12245 1 19 . 1 1 24 24 ARG CA C 24 57.718 57.718 59.281 -1.562 18518
12246 1 19 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.746 -0.977 18518
12247 1 19 . 1 1 24 24 ARG H H 24 8.601 8.601 8.487 0.114 18518
12248 1 19 . 1 1 25 25 GLU N N 25 118.054 118.054 119.479 -1.425 18518
12249 1 19 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.201 -0.175 18518
12250 1 19 . 1 1 25 25 GLU C C 25 178.492 178.492 178.808 -0.316 18518
12251 1 19 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.765 0.015 18518
12252 1 19 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.259 0.743 18518
12253 1 19 . 1 1 25 25 GLU H H 25 7.423 7.423 7.810 -0.387 18518
12254 1 19 . 1 1 26 26 GLN N N 26 116.350 116.350 117.687 -1.337 18518
12255 1 19 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.082 -0.146 18518
12256 1 19 . 1 1 26 26 GLN C C 26 176.305 176.305 177.145 -0.840 18518
12257 1 19 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.532 -0.029 18518
12258 1 19 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.699 0.508 18518
12259 1 19 . 1 1 26 26 GLN H H 26 7.524 7.524 7.736 -0.212 18518
12260 1 19 . 1 1 27 27 HIS N N 27 116.017 116.017 119.713 -3.696 18518
12261 1 19 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.044 -0.114 18518
12262 1 19 . 1 1 27 27 HIS CA C 27 53.054 53.054 53.633 -0.579 18518
12263 1 19 . 1 1 27 27 HIS CB C 27 30.747 30.747 29.849 0.898 18518
12264 1 19 . 1 1 27 27 HIS H H 27 8.284 8.284 8.328 -0.044 18518
12265 1 19 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.667 -0.086 18518
12266 1 19 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.618 0.301 18518
12267 1 19 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.425 0.030 18518
12268 1 19 . 1 1 29 29 THR N N 29 107.011 107.011 108.306 -1.295 18518
12269 1 19 . 1 1 29 29 THR HA H 29 4.599 4.599 4.341 0.258 18518
12270 1 19 . 1 1 29 29 THR C C 29 172.884 172.884 173.884 -1.000 18518
12271 1 19 . 1 1 29 29 THR CA C 29 60.810 60.810 61.285 -0.475 18518
12272 1 19 . 1 1 29 29 THR CB C 29 68.531 68.531 68.285 0.245 18518
12273 1 19 . 1 1 29 29 THR H H 29 7.890 7.890 8.280 -0.390 18518
12274 1 19 . 1 1 30 30 LYS N N 30 117.679 117.679 122.332 -4.653 18518
12275 1 19 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.944 -0.086 18518
12276 1 19 . 1 1 30 30 LYS C C 30 174.310 174.310 175.101 -0.791 18518
12277 1 19 . 1 1 30 30 LYS CA C 30 53.751 53.751 53.787 -0.036 18518
12278 1 19 . 1 1 30 30 LYS CB C 30 35.804 35.804 34.743 1.061 18518
12279 1 19 . 1 1 30 30 LYS H H 30 7.441 7.441 7.526 -0.085 18518
12280 1 19 . 1 1 31 31 ILE N N 31 122.849 122.849 123.760 -0.911 18518
12281 1 19 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.193 -0.088 18518
12282 1 19 . 1 1 31 31 ILE CA C 31 54.801 54.801 56.194 -1.393 18518
12283 1 19 . 1 1 31 31 ILE CB C 31 38.265 38.265 37.555 0.710 18518
12284 1 19 . 1 1 31 31 ILE H H 31 9.304 9.304 8.849 0.455 18518
12285 1 19 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.870 0.289 18518
12286 1 19 . 1 1 32 32 PRO C C 32 174.164 174.164 175.900 -1.736 18518
12287 1 19 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.195 -0.692 18518
12288 1 19 . 1 1 32 32 PRO CB C 32 31.145 31.145 30.875 0.271 18518
12289 1 19 . 1 1 33 33 VAL N N 33 125.606 125.606 125.254 0.352 18518
12290 1 19 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.110 0.103 18518
12291 1 19 . 1 1 33 33 VAL C C 33 173.654 173.654 173.784 -0.130 18518
12292 1 19 . 1 1 33 33 VAL CA C 33 60.044 60.044 58.947 1.097 18518
12293 1 19 . 1 1 33 33 VAL CB C 33 35.604 35.604 35.923 -0.319 18518
12294 1 19 . 1 1 33 33 VAL H H 33 9.424 9.424 8.779 0.645 18518
12295 1 19 . 1 1 34 34 ILE N N 34 128.241 128.241 126.255 1.986 18518
12296 1 19 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.795 0.038 18518
12297 1 19 . 1 1 34 34 ILE C C 34 175.605 175.605 175.048 0.557 18518
12298 1 19 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.063 -1.298 18518
12299 1 19 . 1 1 34 34 ILE CB C 34 36.799 36.799 38.260 -1.461 18518
12300 1 19 . 1 1 34 34 ILE H H 34 8.721 8.721 8.984 -0.263 18518
12301 1 19 . 1 1 35 35 ILE N N 35 125.650 125.650 127.940 -2.290 18518
12302 1 19 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.910 -0.074 18518
12303 1 19 . 1 1 35 35 ILE C C 35 174.887 174.887 175.016 -0.129 18518
12304 1 19 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.310 0.635 18518
12305 1 19 . 1 1 35 35 ILE CB C 35 39.210 39.210 38.614 0.596 18518
12306 1 19 . 1 1 35 35 ILE H H 35 9.034 9.034 9.116 -0.082 18518
12307 1 19 . 1 1 36 36 GLU N N 36 122.657 122.657 125.990 -3.333 18518
12308 1 19 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.963 -0.102 18518
12309 1 19 . 1 1 36 36 GLU C C 36 173.848 173.848 174.627 -0.779 18518
12310 1 19 . 1 1 36 36 GLU CA C 36 53.932 53.932 53.758 0.174 18518
12311 1 19 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.038 1.244 18518
12312 1 19 . 1 1 36 36 GLU H H 36 8.303 8.303 8.589 -0.286 18518
12313 1 19 . 1 1 37 37 ARG N N 37 123.228 123.228 122.692 0.536 18518
12314 1 19 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.578 -0.852 18518
12315 1 19 . 1 1 37 37 ARG C C 37 176.359 176.359 175.733 0.626 18518
12316 1 19 . 1 1 37 37 ARG CA C 37 56.359 56.359 55.538 0.821 18518
12317 1 19 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.827 0.514 18518
12318 1 19 . 1 1 37 37 ARG H H 37 8.856 8.856 8.574 0.282 18518
12319 1 19 . 1 1 38 38 TYR N N 38 128.981 128.981 128.511 0.470 18518
12320 1 19 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.280 0.072 18518
12321 1 19 . 1 1 38 38 TYR C C 38 177.316 177.316 177.112 0.204 18518
12322 1 19 . 1 1 38 38 TYR CA C 38 57.712 57.712 57.974 -0.262 18518
12323 1 19 . 1 1 38 38 TYR CB C 38 39.472 39.472 39.950 -0.478 18518
12324 1 19 . 1 1 38 38 TYR H H 38 8.628 8.628 8.393 0.235 18518
12325 1 19 . 1 1 39 39 LYS N N 39 130.635 130.635 127.102 3.533 18518
12326 1 19 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.759 0.063 18518
12327 1 19 . 1 1 39 39 LYS CA C 39 58.887 58.887 57.932 0.955 18518
12328 1 19 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.567 0.204 18518
12329 1 19 . 1 1 39 39 LYS H H 39 8.594 8.594 8.075 0.519 18518
12330 1 19 . 1 1 40 40 GLY C C 40 173.447 173.447 174.483 -1.036 18518
12331 1 19 . 1 1 40 40 GLY CA C 40 44.663 44.663 44.599 0.064 18518
12332 1 19 . 1 1 40 40 GLY H H 40 5.188 5.188 6.212 -1.024 18518
12333 1 19 . 1 1 41 41 GLU N N 41 122.836 122.836 120.990 1.846 18518
12334 1 19 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.255 0.002 18518
12335 1 19 . 1 1 41 41 GLU C C 41 176.524 176.524 176.215 0.309 18518
12336 1 19 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.612 -0.087 18518
12337 1 19 . 1 1 41 41 GLU CB C 41 30.985 30.985 29.645 1.341 18518
12338 1 19 . 1 1 41 41 GLU H H 41 7.380 7.380 7.468 -0.088 18518
12339 1 19 . 1 1 42 42 LYS N N 42 124.040 124.040 125.612 -1.572 18518
12340 1 19 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.471 0.204 18518
12341 1 19 . 1 1 42 42 LYS C C 42 177.538 177.538 176.972 0.566 18518
12342 1 19 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.755 -0.916 18518
12343 1 19 . 1 1 42 42 LYS CB C 42 34.979 34.979 32.984 1.995 18518
12344 1 19 . 1 1 42 42 LYS H H 42 9.034 9.034 8.497 0.537 18518
12345 1 19 . 1 1 43 43 GLN N N 43 119.259 119.259 118.466 0.793 18518
12346 1 19 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.402 0.140 18518
12347 1 19 . 1 1 43 43 GLN C C 43 177.336 177.336 176.445 0.891 18518
12348 1 19 . 1 1 43 43 GLN CA C 43 57.673 57.673 56.648 1.025 18518
12349 1 19 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.054 0.728 18518
12350 1 19 . 1 1 43 43 GLN H H 43 8.435 8.435 8.923 -0.488 18518
12351 1 19 . 1 1 44 44 LEU N N 44 120.760 120.760 123.723 -2.963 18518
12352 1 19 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.647 0.048 18518
12353 1 19 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.857 0.388 18518
12354 1 19 . 1 1 44 44 LEU CB C 44 43.596 43.596 41.909 1.687 18518
12355 1 19 . 1 1 44 44 LEU H H 44 9.126 9.126 8.460 0.666 18518
12356 1 19 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.635 0.082 18518
12357 1 19 . 1 1 45 45 PRO C C 45 175.797 175.797 176.741 -0.944 18518
12358 1 19 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.352 -0.242 18518
12359 1 19 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.378 0.214 18518
12360 1 19 . 1 1 46 46 VAL N N 46 119.052 119.052 121.512 -2.460 18518
12361 1 19 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.123 -0.256 18518
12362 1 19 . 1 1 46 46 VAL C C 46 175.640 175.640 176.349 -0.709 18518
12363 1 19 . 1 1 46 46 VAL CA C 46 62.944 62.944 62.306 0.638 18518
12364 1 19 . 1 1 46 46 VAL CB C 46 32.799 32.799 33.026 -0.227 18518
12365 1 19 . 1 1 46 46 VAL H H 46 8.543 8.543 8.322 0.221 18518
12366 1 19 . 1 1 47 47 LEU N N 47 130.203 130.203 123.357 6.846 18518
12367 1 19 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.687 -0.378 18518
12368 1 19 . 1 1 47 47 LEU C C 47 176.198 176.198 176.916 -0.718 18518
12369 1 19 . 1 1 47 47 LEU CA C 47 55.006 55.006 54.152 0.854 18518
12370 1 19 . 1 1 47 47 LEU CB C 47 43.832 43.832 43.837 -0.006 18518
12371 1 19 . 1 1 47 47 LEU H H 47 7.799 7.799 8.544 -0.745 18518
12372 1 19 . 1 1 48 48 ASP N N 48 122.403 122.403 122.350 0.053 18518
12373 1 19 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.517 -0.254 18518
12374 1 19 . 1 1 48 48 ASP C C 48 175.294 175.294 175.196 0.098 18518
12375 1 19 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.967 -0.135 18518
12376 1 19 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.145 -0.961 18518
12377 1 19 . 1 1 48 48 ASP H H 48 8.780 8.780 8.771 0.009 18518
12378 1 19 . 1 1 49 49 LYS N N 49 119.569 119.569 115.689 3.880 18518
12379 1 19 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.569 0.016 18518
12380 1 19 . 1 1 49 49 LYS C C 49 174.678 174.678 175.497 -0.819 18518
12381 1 19 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.261 -1.609 18518
12382 1 19 . 1 1 49 49 LYS CB C 49 35.945 35.945 35.146 0.799 18518
12383 1 19 . 1 1 49 49 LYS H H 49 7.280 7.280 7.543 -0.263 18518
12384 1 19 . 1 1 50 50 THR N N 50 110.862 110.862 111.891 -1.029 18518
12385 1 19 . 1 1 50 50 THR HA H 50 4.811 4.811 4.929 -0.118 18518
12386 1 19 . 1 1 50 50 THR C C 50 172.425 172.425 174.382 -1.957 18518
12387 1 19 . 1 1 50 50 THR CA C 50 62.645 62.645 63.165 -0.520 18518
12388 1 19 . 1 1 50 50 THR CB C 50 71.648 71.648 70.287 1.361 18518
12389 1 19 . 1 1 50 50 THR H H 50 8.042 8.042 8.186 -0.144 18518
12390 1 19 . 1 1 51 51 LYS N N 51 120.008 120.008 123.027 -3.019 18518
12391 1 19 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.494 0.131 18518
12392 1 19 . 1 1 51 51 LYS C C 51 175.082 175.082 175.937 -0.855 18518
12393 1 19 . 1 1 51 51 LYS CA C 51 54.704 54.704 57.072 -2.368 18518
12394 1 19 . 1 1 51 51 LYS CB C 51 32.376 32.376 32.431 -0.055 18518
12395 1 19 . 1 1 51 51 LYS H H 51 7.119 7.119 7.837 -0.718 18518
12396 1 19 . 1 1 52 52 PHE N N 52 122.640 122.640 124.847 -2.207 18518
12397 1 19 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.747 0.590 18518
12398 1 19 . 1 1 52 52 PHE C C 52 174.213 174.213 173.945 0.268 18518
12399 1 19 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.963 -0.352 18518
12400 1 19 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.265 -0.125 18518
12401 1 19 . 1 1 52 52 PHE H H 52 9.709 9.709 9.177 0.532 18518
12402 1 19 . 1 1 53 53 LEU N N 53 122.157 122.157 123.358 -1.201 18518
12403 1 19 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.976 -0.029 18518
12404 1 19 . 1 1 53 53 LEU C C 53 175.769 175.769 175.532 0.237 18518
12405 1 19 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.553 -0.596 18518
12406 1 19 . 1 1 53 53 LEU CB C 53 44.415 44.415 44.239 0.176 18518
12407 1 19 . 1 1 53 53 LEU H H 53 8.959 8.959 8.484 0.475 18518
12408 1 19 . 1 1 54 54 VAL N N 54 124.919 124.919 124.570 0.349 18518
12409 1 19 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.600 -0.041 18518
12410 1 19 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.165 0.965 18518
12411 1 19 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.666 1.302 18518
12412 1 19 . 1 1 54 54 VAL H H 54 8.922 8.922 8.466 0.456 18518
12413 1 19 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.980 -0.539 18518
12414 1 19 . 1 1 55 55 PRO C C 55 176.594 176.594 178.054 -1.460 18518
12415 1 19 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.075 2.240 18518
12416 1 19 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.444 0.221 18518
12417 1 19 . 1 1 56 56 ASP N N 56 120.522 120.522 122.663 -2.141 18518
12418 1 19 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.233 -0.371 18518
12419 1 19 . 1 1 56 56 ASP C C 56 175.809 175.809 176.400 -0.591 18518
12420 1 19 . 1 1 56 56 ASP CA C 56 56.749 56.749 56.380 0.369 18518
12421 1 19 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.358 0.152 18518
12422 1 19 . 1 1 56 56 ASP H H 56 8.347 8.347 8.802 -0.455 18518
12423 1 19 . 1 1 57 57 HIS N N 57 113.482 113.482 116.028 -2.546 18518
12424 1 19 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.546 0.174 18518
12425 1 19 . 1 1 57 57 HIS C C 57 176.507 176.507 174.686 1.821 18518
12426 1 19 . 1 1 57 57 HIS CA C 57 55.589 55.589 56.562 -0.973 18518
12427 1 19 . 1 1 57 57 HIS CB C 57 30.643 30.643 30.163 0.480 18518
12428 1 19 . 1 1 57 57 HIS H H 57 7.557 7.557 8.072 -0.515 18518
12429 1 19 . 1 1 58 58 VAL N N 58 123.279 123.279 121.103 2.176 18518
12430 1 19 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.194 -0.358 18518
12431 1 19 . 1 1 58 58 VAL C C 58 175.019 175.019 174.304 0.715 18518
12432 1 19 . 1 1 58 58 VAL CA C 58 62.823 62.823 60.490 2.333 18518
12433 1 19 . 1 1 58 58 VAL CB C 58 32.310 32.310 34.447 -2.137 18518
12434 1 19 . 1 1 58 58 VAL H H 58 7.345 7.345 7.316 0.029 18518
12435 1 19 . 1 1 59 59 ASN N N 59 123.781 123.781 121.826 1.955 18518
12436 1 19 . 1 1 59 59 ASN HA H 59 5.126 5.126 4.914 0.212 18518
12437 1 19 . 1 1 59 59 ASN C C 59 176.558 176.558 176.167 0.391 18518
12438 1 19 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.974 -0.489 18518
12439 1 19 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.173 -0.066 18518
12440 1 19 . 1 1 59 59 ASN H H 59 8.735 8.735 8.316 0.419 18518
12441 1 19 . 1 1 60 60 MET N N 60 117.453 117.453 117.912 -0.459 18518
12442 1 19 . 1 1 60 60 MET HA H 60 4.395 4.395 4.143 0.252 18518
12443 1 19 . 1 1 60 60 MET C C 60 178.144 178.144 178.058 0.086 18518
12444 1 19 . 1 1 60 60 MET CA C 60 57.097 57.097 57.820 -0.723 18518
12445 1 19 . 1 1 60 60 MET CB C 60 30.140 30.140 30.936 -0.796 18518
12446 1 19 . 1 1 60 60 MET H H 60 8.227 8.227 8.652 -0.425 18518
12447 1 19 . 1 1 61 61 SER N N 61 114.216 114.216 115.982 -1.766 18518
12448 1 19 . 1 1 61 61 SER HA H 61 4.111 4.111 4.139 -0.028 18518
12449 1 19 . 1 1 61 61 SER C C 61 177.335 177.335 177.012 0.323 18518
12450 1 19 . 1 1 61 61 SER CA C 61 61.590 61.590 62.311 -0.721 18518
12451 1 19 . 1 1 61 61 SER CB C 61 62.402 62.402 62.754 -0.352 18518
12452 1 19 . 1 1 61 61 SER H H 61 8.464 8.464 8.184 0.280 18518
12453 1 19 . 1 1 62 62 GLU N N 62 123.004 123.004 121.414 1.590 18518
12454 1 19 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.128 -0.081 18518
12455 1 19 . 1 1 62 62 GLU C C 62 178.686 178.686 178.763 -0.077 18518
12456 1 19 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.679 -0.054 18518
12457 1 19 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.283 0.371 18518
12458 1 19 . 1 1 62 62 GLU H H 62 7.994 7.994 7.857 0.137 18518
12459 1 19 . 1 1 63 63 LEU N N 63 120.818 120.818 121.803 -0.985 18518
12460 1 19 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.990 -0.025 18518
12461 1 19 . 1 1 63 63 LEU C C 63 178.046 178.046 178.798 -0.752 18518
12462 1 19 . 1 1 63 63 LEU CA C 63 57.920 57.920 58.100 -0.180 18518
12463 1 19 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.342 0.282 18518
12464 1 19 . 1 1 63 63 LEU H H 63 8.130 8.130 7.778 0.352 18518
12465 1 19 . 1 1 64 64 ILE N N 64 118.528 118.528 119.439 -0.911 18518
12466 1 19 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.569 -0.200 18518
12467 1 19 . 1 1 64 64 ILE C C 64 177.127 177.127 177.641 -0.514 18518
12468 1 19 . 1 1 64 64 ILE CA C 64 66.678 66.678 65.790 0.888 18518
12469 1 19 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.733 0.711 18518
12470 1 19 . 1 1 64 64 ILE H H 64 8.488 8.488 8.544 -0.056 18518
12471 1 19 . 1 1 65 65 LYS N N 65 118.336 118.336 120.937 -2.601 18518
12472 1 19 . 1 1 65 65 LYS HA H 65 3.701 3.701 3.969 -0.268 18518
12473 1 19 . 1 1 65 65 LYS C C 65 179.291 179.291 179.208 0.083 18518
12474 1 19 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.681 0.759 18518
12475 1 19 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.165 0.206 18518
12476 1 19 . 1 1 65 65 LYS H H 65 7.347 7.347 7.692 -0.345 18518
12477 1 19 . 1 1 66 66 ILE N N 66 120.171 120.171 120.232 -0.061 18518
12478 1 19 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.696 -0.118 18518
12479 1 19 . 1 1 66 66 ILE C C 66 178.873 178.873 178.156 0.717 18518
12480 1 19 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.419 -0.259 18518
12481 1 19 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.879 0.754 18518
12482 1 19 . 1 1 66 66 ILE H H 66 7.901 7.901 8.320 -0.419 18518
12483 1 19 . 1 1 67 67 ILE N N 67 121.185 121.185 121.212 -0.027 18518
12484 1 19 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.419 0.027 18518
12485 1 19 . 1 1 67 67 ILE C C 67 177.150 177.150 177.613 -0.463 18518
12486 1 19 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.912 -2.106 18518
12487 1 19 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.369 -2.374 18518
12488 1 19 . 1 1 67 67 ILE H H 67 8.290 8.290 8.041 0.249 18518
12489 1 19 . 1 1 68 68 ARG N N 68 119.173 119.173 118.655 0.518 18518
12490 1 19 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.728 -0.797 18518
12491 1 19 . 1 1 68 68 ARG C C 68 178.496 178.496 178.673 -0.177 18518
12492 1 19 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.525 1.111 18518
12493 1 19 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.800 0.640 18518
12494 1 19 . 1 1 68 68 ARG H H 68 8.438 8.438 8.482 -0.044 18518
12495 1 19 . 1 1 69 69 ARG N N 69 116.511 116.511 120.493 -3.982 18518
12496 1 19 . 1 1 69 69 ARG HA H 69 4.134 4.134 4.042 0.092 18518
12497 1 19 . 1 1 69 69 ARG C C 69 180.262 180.262 178.623 1.639 18518
12498 1 19 . 1 1 69 69 ARG CA C 69 58.707 58.707 58.702 0.005 18518
12499 1 19 . 1 1 69 69 ARG CB C 69 29.953 29.953 29.894 0.059 18518
12500 1 19 . 1 1 69 69 ARG H H 69 7.497 7.497 8.279 -0.782 18518
12501 1 19 . 1 1 70 70 ARG N N 70 123.297 123.297 118.328 4.969 18518
12502 1 19 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.106 -0.090 18518
12503 1 19 . 1 1 70 70 ARG C C 70 178.700 178.700 178.469 0.231 18518
12504 1 19 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.563 0.897 18518
12505 1 19 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.580 0.732 18518
12506 1 19 . 1 1 70 70 ARG H H 70 8.075 8.075 7.889 0.186 18518
12507 1 19 . 1 1 71 71 LEU N N 71 116.829 116.829 119.180 -2.351 18518
12508 1 19 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.129 -0.064 18518
12509 1 19 . 1 1 71 71 LEU C C 71 174.956 174.956 176.159 -1.203 18518
12510 1 19 . 1 1 71 71 LEU CA C 71 55.126 55.126 56.066 -0.940 18518
12511 1 19 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.627 0.619 18518
12512 1 19 . 1 1 71 71 LEU H H 71 7.719 7.719 7.678 0.041 18518
12513 1 19 . 1 1 72 72 GLN N N 72 114.991 114.991 114.389 0.602 18518
12514 1 19 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.968 -0.132 18518
12515 1 19 . 1 1 72 72 GLN C C 72 175.683 175.683 174.879 0.804 18518
12516 1 19 . 1 1 72 72 GLN CA C 72 56.325 56.325 55.752 0.573 18518
12517 1 19 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.527 0.476 18518
12518 1 19 . 1 1 72 72 GLN H H 72 7.744 7.744 7.633 0.111 18518
12519 1 19 . 1 1 73 73 LEU N N 73 115.045 115.045 120.583 -5.538 18518
12520 1 19 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.113 0.123 18518
12521 1 19 . 1 1 73 73 LEU C C 73 178.762 178.762 176.690 2.072 18518
12522 1 19 . 1 1 73 73 LEU CA C 73 54.386 54.386 54.778 -0.392 18518
12523 1 19 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.986 0.105 18518
12524 1 19 . 1 1 73 73 LEU H H 73 7.500 7.500 7.795 -0.295 18518
12525 1 19 . 1 1 74 74 ASN N N 74 121.700 121.700 123.833 -2.133 18518
12526 1 19 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.485 0.205 18518
12527 1 19 . 1 1 74 74 ASN C C 74 176.617 176.617 176.081 0.536 18518
12528 1 19 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.980 -1.295 18518
12529 1 19 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.917 -0.319 18518
12530 1 19 . 1 1 74 74 ASN H H 74 9.045 9.045 8.607 0.438 18518
12531 1 19 . 1 1 75 75 ALA N N 75 123.952 123.952 121.541 2.411 18518
12532 1 19 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.405 -0.441 18518
12533 1 19 . 1 1 75 75 ALA C C 75 178.131 178.131 178.035 0.096 18518
12534 1 19 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.282 1.586 18518
12535 1 19 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.558 -0.840 18518
12536 1 19 . 1 1 75 75 ALA H H 75 8.784 8.784 8.470 0.314 18518
12537 1 19 . 1 1 76 76 ASN N N 76 112.295 112.295 116.358 -4.063 18518
12538 1 19 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.661 -0.081 18518
12539 1 19 . 1 1 76 76 ASN C C 76 175.448 175.448 175.428 0.020 18518
12540 1 19 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.721 -0.507 18518
12541 1 19 . 1 1 76 76 ASN CB C 76 38.320 38.320 39.138 -0.818 18518
12542 1 19 . 1 1 76 76 ASN H H 76 8.391 8.391 8.586 -0.195 18518
12543 1 19 . 1 1 77 77 GLN N N 77 120.577 120.577 118.571 2.006 18518
12544 1 19 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.745 -0.472 18518
12545 1 19 . 1 1 77 77 GLN C C 77 175.045 175.045 173.422 1.623 18518
12546 1 19 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.987 0.818 18518
12547 1 19 . 1 1 77 77 GLN CB C 77 30.157 30.157 31.912 -1.755 18518
12548 1 19 . 1 1 77 77 GLN H H 77 7.552 7.552 7.515 0.037 18518
12549 1 19 . 1 1 78 78 ALA N N 78 130.670 130.670 122.922 7.748 18518
12550 1 19 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.674 -0.503 18518
12551 1 19 . 1 1 78 78 ALA C C 78 176.512 176.512 175.280 1.232 18518
12552 1 19 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.105 1.737 18518
12553 1 19 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.626 -1.566 18518
12554 1 19 . 1 1 78 78 ALA H H 78 8.799 8.799 8.721 0.078 18518
12555 1 19 . 1 1 79 79 PHE N N 79 119.325 119.325 116.943 2.382 18518
12556 1 19 . 1 1 79 79 PHE HA H 79 4.434 4.434 5.213 -0.779 18518
12557 1 19 . 1 1 79 79 PHE C C 79 171.726 171.726 173.001 -1.275 18518
12558 1 19 . 1 1 79 79 PHE CA C 79 59.145 59.145 55.366 3.779 18518
12559 1 19 . 1 1 79 79 PHE CB C 79 42.171 42.171 42.011 0.161 18518
12560 1 19 . 1 1 79 79 PHE H H 79 7.664 7.664 8.211 -0.547 18518
12561 1 19 . 1 1 80 80 PHE N N 80 126.314 126.314 117.964 8.350 18518
12562 1 19 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.184 0.208 18518
12563 1 19 . 1 1 80 80 PHE C C 80 177.169 177.169 173.144 4.025 18518
12564 1 19 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.317 0.336 18518
12565 1 19 . 1 1 80 80 PHE CB C 80 41.933 41.933 42.904 -0.971 18518
12566 1 19 . 1 1 80 80 PHE H H 80 8.508 8.508 8.951 -0.443 18518
12567 1 19 . 1 1 81 81 LEU N N 81 121.426 121.426 122.145 -0.719 18518
12568 1 19 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.243 -0.392 18518
12569 1 19 . 1 1 81 81 LEU C C 81 174.488 174.488 175.001 -0.513 18518
12570 1 19 . 1 1 81 81 LEU CA C 81 53.197 53.197 53.976 -0.779 18518
12571 1 19 . 1 1 81 81 LEU CB C 81 45.100 45.100 44.600 0.500 18518
12572 1 19 . 1 1 81 81 LEU H H 81 8.229 8.229 8.551 -0.322 18518
12573 1 19 . 1 1 82 82 LEU N N 82 125.155 125.155 127.555 -2.400 18518
12574 1 19 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.597 0.236 18518
12575 1 19 . 1 1 82 82 LEU C C 82 177.166 177.166 175.558 1.608 18518
12576 1 19 . 1 1 82 82 LEU CA C 82 54.197 54.197 53.945 0.252 18518
12577 1 19 . 1 1 82 82 LEU CB C 82 43.442 43.442 44.715 -1.274 18518
12578 1 19 . 1 1 82 82 LEU H H 82 9.400 9.400 9.304 0.096 18518
12579 1 19 . 1 1 83 83 VAL N N 83 123.886 123.886 119.938 3.948 18518
12580 1 19 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.562 -0.183 18518
12581 1 19 . 1 1 83 83 VAL C C 83 175.810 175.810 176.149 -0.339 18518
12582 1 19 . 1 1 83 83 VAL CA C 83 61.677 61.677 61.260 0.417 18518
12583 1 19 . 1 1 83 83 VAL CB C 83 33.758 33.758 33.504 0.254 18518
12584 1 19 . 1 1 83 83 VAL H H 83 8.721 8.721 8.320 0.401 18518
12585 1 19 . 1 1 84 84 ASN N N 84 126.474 126.474 127.335 -0.861 18518
12586 1 19 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.456 -0.060 18518
12587 1 19 . 1 1 84 84 ASN C C 84 175.164 175.164 175.271 -0.107 18518
12588 1 19 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.633 0.105 18518
12589 1 19 . 1 1 84 84 ASN CB C 84 37.950 37.950 37.333 0.617 18518
12590 1 19 . 1 1 84 84 ASN H H 84 9.707 9.707 9.659 0.048 18518
12591 1 19 . 1 1 85 85 GLY N N 85 101.296 101.296 104.358 -3.062 18518
12592 1 19 . 1 1 85 85 GLY C C 85 173.680 173.680 173.527 0.153 18518
12593 1 19 . 1 1 85 85 GLY CA C 85 45.603 45.603 45.376 0.227 18518
12594 1 19 . 1 1 85 85 GLY H H 85 8.644 8.644 8.670 -0.026 18518
12595 1 19 . 1 1 86 86 HIS N N 86 117.238 117.238 115.793 1.445 18518
12596 1 19 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.793 0.224 18518
12597 1 19 . 1 1 86 86 HIS C C 86 173.841 173.841 173.787 0.054 18518
12598 1 19 . 1 1 86 86 HIS CA C 86 53.796 53.796 52.996 0.800 18518
12599 1 19 . 1 1 86 86 HIS CB C 86 31.280 31.280 31.948 -0.668 18518
12600 1 19 . 1 1 86 86 HIS H H 86 7.918 7.918 8.175 -0.257 18518
12601 1 19 . 1 1 87 87 SER N N 87 118.179 118.179 120.176 -1.997 18518
12602 1 19 . 1 1 87 87 SER HA H 87 4.699 4.699 4.439 0.260 18518
12603 1 19 . 1 1 87 87 SER C C 87 175.904 175.904 174.313 1.591 18518
12604 1 19 . 1 1 87 87 SER CA C 87 58.271 58.271 58.189 0.082 18518
12605 1 19 . 1 1 87 87 SER CB C 87 63.735 63.735 62.151 1.584 18518
12606 1 19 . 1 1 87 87 SER H H 87 8.977 8.977 8.816 0.161 18518
12607 1 19 . 1 1 88 88 MET N N 88 125.472 125.472 122.963 2.509 18518
12608 1 19 . 1 1 88 88 MET HA H 88 4.830 4.830 4.626 0.204 18518
12609 1 19 . 1 1 88 88 MET C C 88 176.419 176.419 175.154 1.265 18518
12610 1 19 . 1 1 88 88 MET CA C 88 54.899 54.899 55.403 -0.504 18518
12611 1 19 . 1 1 88 88 MET CB C 88 33.336 33.336 33.786 -0.450 18518
12612 1 19 . 1 1 88 88 MET H H 88 9.184 9.184 7.986 1.198 18518
12613 1 19 . 1 1 89 89 VAL N N 89 120.747 120.747 122.062 -1.315 18518
12614 1 19 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.207 0.025 18518
12615 1 19 . 1 1 89 89 VAL C C 89 175.958 175.958 176.046 -0.088 18518
12616 1 19 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.496 1.658 18518
12617 1 19 . 1 1 89 89 VAL CB C 89 31.878 31.878 32.993 -1.115 18518
12618 1 19 . 1 1 89 89 VAL H H 89 8.233 8.233 7.548 0.685 18518
12619 1 19 . 1 1 90 90 SER N N 90 117.362 117.362 121.382 -4.020 18518
12620 1 19 . 1 1 90 90 SER HA H 90 4.590 4.590 4.595 -0.005 18518
12621 1 19 . 1 1 90 90 SER C C 90 175.741 175.741 176.000 -0.259 18518
12622 1 19 . 1 1 90 90 SER CA C 90 57.717 57.717 58.329 -0.612 18518
12623 1 19 . 1 1 90 90 SER CB C 90 63.223 63.223 63.724 -0.501 18518
12624 1 19 . 1 1 90 90 SER H H 90 8.482 8.482 8.673 -0.191 18518
12625 1 19 . 1 1 91 91 VAL N N 91 120.466 120.466 122.688 -2.222 18518
12626 1 19 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.725 0.322 18518
12627 1 19 . 1 1 91 91 VAL C C 91 176.329 176.329 175.841 0.488 18518
12628 1 19 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.863 -1.371 18518
12629 1 19 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.738 0.830 18518
12630 1 19 . 1 1 91 91 VAL H H 91 8.188 8.188 8.591 -0.403 18518
12631 1 19 . 1 1 92 92 SER N N 92 116.398 116.398 112.850 3.548 18518
12632 1 19 . 1 1 92 92 SER HA H 92 4.636 4.636 4.468 0.168 18518
12633 1 19 . 1 1 92 92 SER C C 92 174.159 174.159 174.590 -0.431 18518
12634 1 19 . 1 1 92 92 SER CA C 92 57.805 57.805 58.501 -0.696 18518
12635 1 19 . 1 1 92 92 SER CB C 92 63.046 63.046 62.752 0.295 18518
12636 1 19 . 1 1 92 92 SER H H 92 8.370 8.370 8.120 0.250 18518
12637 1 19 . 1 1 93 93 THR N N 93 119.211 119.211 119.981 -0.770 18518
12638 1 19 . 1 1 93 93 THR HA H 93 4.484 4.484 4.636 -0.152 18518
12639 1 19 . 1 1 93 93 THR CA C 93 60.884 60.884 60.612 0.272 18518
12640 1 19 . 1 1 93 93 THR CB C 93 70.609 70.609 68.988 1.621 18518
12641 1 19 . 1 1 93 93 THR H H 93 7.416 7.416 7.661 -0.245 18518
12642 1 19 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.479 -0.039 18518
12643 1 19 . 1 1 94 94 PRO C C 94 178.775 178.775 177.226 1.549 18518
12644 1 19 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.572 0.371 18518
12645 1 19 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.290 0.359 18518
12646 1 19 . 1 1 95 95 ILE N N 95 124.174 124.174 124.321 -0.147 18518
12647 1 19 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.788 0.161 18518
12648 1 19 . 1 1 95 95 ILE C C 95 176.498 176.498 176.874 -0.376 18518
12649 1 19 . 1 1 95 95 ILE CA C 95 63.904 63.904 62.781 1.123 18518
12650 1 19 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.116 0.066 18518
12651 1 19 . 1 1 95 95 ILE H H 95 9.305 9.305 7.815 1.490 18518
12652 1 19 . 1 1 96 96 SER N N 96 116.920 116.920 115.052 1.868 18518
12653 1 19 . 1 1 96 96 SER HA H 96 4.029 4.029 4.089 -0.060 18518
12654 1 19 . 1 1 96 96 SER C C 96 176.574 176.574 176.215 0.359 18518
12655 1 19 . 1 1 96 96 SER CA C 96 61.356 61.356 62.102 -0.746 18518
12656 1 19 . 1 1 96 96 SER CB C 96 61.723 61.723 62.670 -0.947 18518
12657 1 19 . 1 1 96 96 SER H H 96 8.335 8.335 8.604 -0.269 18518
12658 1 19 . 1 1 97 97 GLU N N 97 123.255 123.255 122.373 0.882 18518
12659 1 19 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.171 0.107 18518
12660 1 19 . 1 1 97 97 GLU C C 97 179.716 179.716 178.856 0.860 18518
12661 1 19 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.680 0.112 18518
12662 1 19 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.277 0.285 18518
12663 1 19 . 1 1 97 97 GLU H H 97 7.376 7.376 7.785 -0.409 18518
12664 1 19 . 1 1 98 98 VAL N N 98 121.137 121.137 121.158 -0.021 18518
12665 1 19 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.653 0.149 18518
12666 1 19 . 1 1 98 98 VAL C C 98 177.637 177.637 178.014 -0.377 18518
12667 1 19 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.723 -0.899 18518
12668 1 19 . 1 1 98 98 VAL CB C 98 32.154 32.154 31.600 0.554 18518
12669 1 19 . 1 1 98 98 VAL H H 98 7.387 7.387 7.818 -0.431 18518
12670 1 19 . 1 1 99 99 TYR N N 99 118.927 118.927 121.331 -2.404 18518
12671 1 19 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.007 -0.017 18518
12672 1 19 . 1 1 99 99 TYR C C 99 176.081 176.081 177.147 -1.066 18518
12673 1 19 . 1 1 99 99 TYR CA C 99 62.223 62.223 61.301 0.922 18518
12674 1 19 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.420 0.561 18518
12675 1 19 . 1 1 99 99 TYR H H 99 9.048 9.048 8.458 0.590 18518
12676 1 19 . 1 1 100 100 GLU N N 100 113.894 113.894 116.363 -2.469 18518
12677 1 19 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.855 -0.009 18518
12678 1 19 . 1 1 100 100 GLU C C 100 177.989 177.989 178.283 -0.294 18518
12679 1 19 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.531 0.556 18518
12680 1 19 . 1 1 100 100 GLU CB C 100 29.382 29.382 29.051 0.331 18518
12681 1 19 . 1 1 100 100 GLU H H 100 7.422 7.422 8.063 -0.641 18518
12682 1 19 . 1 1 101 101 SER N N 101 108.991 108.991 113.984 -4.993 18518
12683 1 19 . 1 1 101 101 SER HA H 101 4.524 4.524 4.398 0.126 18518
12684 1 19 . 1 1 101 101 SER C C 101 176.628 176.628 175.482 1.146 18518
12685 1 19 . 1 1 101 101 SER CA C 101 60.349 60.349 60.493 -0.144 18518
12686 1 19 . 1 1 101 101 SER CB C 101 64.741 64.741 64.166 0.575 18518
12687 1 19 . 1 1 101 101 SER H H 101 7.424 7.424 7.847 -0.423 18518
12688 1 19 . 1 1 102 102 GLU N N 102 116.533 116.533 119.460 -2.927 18518
12689 1 19 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.669 0.075 18518
12690 1 19 . 1 1 102 102 GLU C C 102 176.774 176.774 175.569 1.205 18518
12691 1 19 . 1 1 102 102 GLU CA C 102 55.581 55.581 55.247 0.334 18518
12692 1 19 . 1 1 102 102 GLU CB C 102 30.697 30.697 30.271 0.426 18518
12693 1 19 . 1 1 102 102 GLU H H 102 8.487 8.487 8.101 0.386 18518
12694 1 19 . 1 1 103 103 LYS N N 103 118.370 118.370 119.665 -1.295 18518
12695 1 19 . 1 1 103 103 LYS HA H 103 4.178 4.178 3.916 0.262 18518
12696 1 19 . 1 1 103 103 LYS C C 103 175.018 175.018 176.654 -1.636 18518
12697 1 19 . 1 1 103 103 LYS CA C 103 57.329 57.329 56.991 0.338 18518
12698 1 19 . 1 1 103 103 LYS CB C 103 32.186 32.186 32.035 0.151 18518
12699 1 19 . 1 1 103 103 LYS H H 103 7.831 7.831 7.673 0.158 18518
12700 1 19 . 1 1 104 104 ASP N N 104 123.500 123.500 123.794 -0.294 18518
12701 1 19 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.760 -0.005 18518
12702 1 19 . 1 1 104 104 ASP C C 104 177.383 177.383 177.566 -0.183 18518
12703 1 19 . 1 1 104 104 ASP CA C 104 53.846 53.846 52.881 0.965 18518
12704 1 19 . 1 1 104 104 ASP CB C 104 43.411 43.411 43.497 -0.086 18518
12705 1 19 . 1 1 104 104 ASP H H 104 9.041 9.041 8.148 0.893 18518
12706 1 19 . 1 1 105 105 GLU N N 105 125.448 125.448 120.133 5.315 18518
12707 1 19 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.173 0.007 18518
12708 1 19 . 1 1 105 105 GLU C C 105 177.519 177.519 176.939 0.580 18518
12709 1 19 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.857 0.672 18518
12710 1 19 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.638 0.406 18518
12711 1 19 . 1 1 105 105 GLU H H 105 8.906 8.906 8.836 0.070 18518
12712 1 19 . 1 1 106 106 ASP N N 106 118.824 118.824 119.266 -0.442 18518
12713 1 19 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.741 -0.562 18518
12714 1 19 . 1 1 106 106 ASP C C 106 176.223 176.223 176.861 -0.638 18518
12715 1 19 . 1 1 106 106 ASP CA C 106 54.756 54.756 55.394 -0.638 18518
12716 1 19 . 1 1 106 106 ASP CB C 106 39.999 39.999 41.357 -1.358 18518
12717 1 19 . 1 1 106 106 ASP H H 106 10.036 10.036 8.508 1.528 18518
12718 1 19 . 1 1 107 107 GLY N N 107 105.866 105.866 104.594 1.272 18518
12719 1 19 . 1 1 107 107 GLY C C 107 175.136 175.136 173.915 1.221 18518
12720 1 19 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.053 0.168 18518
12721 1 19 . 1 1 107 107 GLY H H 107 8.001 8.001 8.125 -0.124 18518
12722 1 19 . 1 1 108 108 PHE N N 108 123.820 123.820 121.084 2.736 18518
12723 1 19 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.999 -0.337 18518
12724 1 19 . 1 1 108 108 PHE C C 108 174.899 174.899 174.951 -0.052 18518
12725 1 19 . 1 1 108 108 PHE CA C 108 60.238 60.238 59.083 1.155 18518
12726 1 19 . 1 1 108 108 PHE CB C 108 40.365 40.365 40.034 0.331 18518
12727 1 19 . 1 1 108 108 PHE H H 108 9.912 9.912 7.716 2.196 18518
12728 1 19 . 1 1 109 109 LEU N N 109 120.130 120.130 120.355 -0.225 18518
12729 1 19 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.852 0.178 18518
12730 1 19 . 1 1 109 109 LEU C C 109 173.916 173.916 174.931 -1.015 18518
12731 1 19 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.646 -0.222 18518
12732 1 19 . 1 1 109 109 LEU CB C 109 45.203 45.203 44.964 0.239 18518
12733 1 19 . 1 1 109 109 LEU H H 109 7.997 7.997 8.499 -0.502 18518
12734 1 19 . 1 1 110 110 TYR N N 110 126.579 126.579 125.415 1.164 18518
12735 1 19 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.720 0.283 18518
12736 1 19 . 1 1 110 110 TYR C C 110 176.671 176.671 175.159 1.512 18518
12737 1 19 . 1 1 110 110 TYR CA C 110 59.058 59.058 58.259 0.799 18518
12738 1 19 . 1 1 110 110 TYR CB C 110 39.556 39.556 39.918 -0.362 18518
12739 1 19 . 1 1 110 110 TYR H H 110 9.377 9.377 9.036 0.341 18518
12740 1 19 . 1 1 111 111 MET N N 111 119.240 119.240 122.009 -2.769 18518
12741 1 19 . 1 1 111 111 MET HA H 111 5.486 5.486 5.254 0.232 18518
12742 1 19 . 1 1 111 111 MET C C 111 175.695 175.695 174.607 1.088 18518
12743 1 19 . 1 1 111 111 MET CA C 111 54.124 54.124 54.937 -0.813 18518
12744 1 19 . 1 1 111 111 MET CB C 111 36.960 36.960 37.111 -0.151 18518
12745 1 19 . 1 1 111 111 MET H H 111 9.658 9.658 9.154 0.504 18518
12746 1 19 . 1 1 112 112 VAL N N 112 119.865 119.865 121.177 -1.312 18518
12747 1 19 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.398 0.565 18518
12748 1 19 . 1 1 112 112 VAL C C 112 175.058 175.058 174.892 0.166 18518
12749 1 19 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.958 -1.047 18518
12750 1 19 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.564 0.487 18518
12751 1 19 . 1 1 112 112 VAL H H 112 8.794 8.794 8.623 0.171 18518
12752 1 19 . 1 1 113 113 TYR N N 113 119.664 119.664 120.674 -1.010 18518
12753 1 19 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.851 0.267 18518
12754 1 19 . 1 1 113 113 TYR C C 113 173.375 173.375 173.387 -0.012 18518
12755 1 19 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.319 -1.166 18518
12756 1 19 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.968 1.344 18518
12757 1 19 . 1 1 113 113 TYR H H 113 8.315 8.315 8.612 -0.297 18518
12758 1 19 . 1 1 114 114 ALA N N 114 119.763 119.763 123.782 -4.019 18518
12759 1 19 . 1 1 114 114 ALA HA H 114 4.800 4.800 5.074 -0.274 18518
12760 1 19 . 1 1 114 114 ALA C C 114 176.216 176.216 175.202 1.014 18518
12761 1 19 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.941 -0.809 18518
12762 1 19 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.480 2.116 18518
12763 1 19 . 1 1 114 114 ALA H H 114 8.465 8.465 9.058 -0.593 18518
12764 1 19 . 1 1 115 115 SER N N 115 114.763 114.763 115.919 -1.156 18518
12765 1 19 . 1 1 115 115 SER HA H 115 4.496 4.496 4.846 -0.350 18518
12766 1 19 . 1 1 115 115 SER C C 115 172.671 172.671 173.879 -1.208 18518
12767 1 19 . 1 1 115 115 SER CA C 115 58.651 58.651 57.821 0.831 18518
12768 1 19 . 1 1 115 115 SER CB C 115 63.526 63.526 62.163 1.363 18518
12769 1 19 . 1 1 115 115 SER H H 115 9.915 9.915 9.165 0.750 18518
12770 1 19 . 1 1 116 116 GLN N N 116 116.611 116.611 122.925 -6.314 18518
12771 1 19 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.563 -0.079 18518
12772 1 19 . 1 1 116 116 GLN C C 116 172.733 172.733 173.725 -0.992 18518
12773 1 19 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.747 -1.821 18518
12774 1 19 . 1 1 116 116 GLN CB C 116 32.358 32.358 31.402 0.956 18518
12775 1 19 . 1 1 116 116 GLN H H 116 7.219 7.219 7.931 -0.712 18518
12776 1 19 . 1 1 117 117 GLU N N 117 117.623 117.623 120.925 -3.302 18518
12777 1 19 . 1 1 117 117 GLU HA H 117 3.287 3.287 2.476 0.811 18518
12778 1 19 . 1 1 117 117 GLU C C 117 175.168 175.168 175.164 0.004 18518
12779 1 19 . 1 1 117 117 GLU CA C 117 56.882 56.882 57.231 -0.349 18518
12780 1 19 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.578 0.944 18518
12781 1 19 . 1 1 117 117 GLU H H 117 7.882 7.882 8.513 -0.631 18518
12782 1 19 . 1 1 118 118 THR N N 118 109.820 109.820 108.624 1.196 18518
12783 1 19 . 1 1 118 118 THR HA H 118 4.066 4.066 4.260 -0.194 18518
12784 1 19 . 1 1 118 118 THR C C 118 172.355 172.355 174.241 -1.886 18518
12785 1 19 . 1 1 118 118 THR CA C 118 60.029 60.029 60.203 -0.174 18518
12786 1 19 . 1 1 118 118 THR CB C 118 70.480 70.480 70.186 0.294 18518
12787 1 19 . 1 1 118 118 THR H H 118 6.992 6.992 7.185 -0.193 18518
12788 1 20 . 1 1 2 2 ALA HA H 2 4.336 4.336 4.768 -0.432 18518
12789 1 20 . 1 1 2 2 ALA C C 2 177.974 177.974 177.383 0.591 18518
12790 1 20 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.505 1.280 18518
12791 1 20 . 1 1 2 2 ALA CB C 2 19.444 19.444 19.985 -0.541 18518
12792 1 20 . 1 1 3 3 MET N N 3 119.311 119.311 121.119 -1.808 18518
12793 1 20 . 1 1 3 3 MET HA H 3 4.451 4.451 4.641 -0.190 18518
12794 1 20 . 1 1 3 3 MET C C 3 176.913 176.913 176.065 0.848 18518
12795 1 20 . 1 1 3 3 MET CA C 3 55.679 55.679 54.685 0.994 18518
12796 1 20 . 1 1 3 3 MET CB C 3 32.590 32.590 33.217 -0.626 18518
12797 1 20 . 1 1 3 3 MET H H 3 8.638 8.638 8.420 0.218 18518
12798 1 20 . 1 1 4 4 GLY N N 4 110.281 110.281 110.377 -0.096 18518
12799 1 20 . 1 1 4 4 GLY C C 4 174.180 174.180 174.126 0.054 18518
12800 1 20 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.651 0.843 18518
12801 1 20 . 1 1 4 4 GLY H H 4 8.552 8.552 8.441 0.111 18518
12802 1 20 . 1 1 5 5 LYS N N 5 120.818 120.818 122.160 -1.342 18518
12803 1 20 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.441 0.068 18518
12804 1 20 . 1 1 5 5 LYS C C 5 177.605 177.605 176.431 1.174 18518
12805 1 20 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.358 0.776 18518
12806 1 20 . 1 1 5 5 LYS CB C 5 34.813 34.813 32.891 1.922 18518
12807 1 20 . 1 1 5 5 LYS H H 5 8.133 8.133 8.314 -0.181 18518
12808 1 20 . 1 1 6 6 THR N N 6 114.781 114.781 117.522 -2.741 18518
12809 1 20 . 1 1 6 6 THR HA H 6 4.421 4.421 4.393 0.028 18518
12810 1 20 . 1 1 6 6 THR C C 6 175.524 175.524 175.375 0.149 18518
12811 1 20 . 1 1 6 6 THR CA C 6 61.127 61.127 60.855 0.272 18518
12812 1 20 . 1 1 6 6 THR CB C 6 69.926 69.926 69.974 -0.048 18518
12813 1 20 . 1 1 6 6 THR H H 6 8.483 8.483 8.453 0.030 18518
12814 1 20 . 1 1 7 7 PHE N N 7 125.552 125.552 120.136 5.416 18518
12815 1 20 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.207 -0.202 18518
12816 1 20 . 1 1 7 7 PHE C C 7 177.397 177.397 177.136 0.261 18518
12817 1 20 . 1 1 7 7 PHE CA C 7 63.393 63.393 61.506 1.887 18518
12818 1 20 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.448 1.119 18518
12819 1 20 . 1 1 7 7 PHE H H 7 10.245 10.245 9.178 1.067 18518
12820 1 20 . 1 1 8 8 LYS N N 8 114.053 114.053 118.360 -4.307 18518
12821 1 20 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.892 -0.057 18518
12822 1 20 . 1 1 8 8 LYS C C 8 175.520 175.520 178.555 -3.035 18518
12823 1 20 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.418 1.575 18518
12824 1 20 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.761 1.928 18518
12825 1 20 . 1 1 8 8 LYS H H 8 8.775 8.775 7.290 1.485 18518
12826 1 20 . 1 1 9 9 GLN N N 9 113.516 113.516 117.012 -3.496 18518
12827 1 20 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.126 0.023 18518
12828 1 20 . 1 1 9 9 GLN C C 9 177.615 177.615 177.769 -0.154 18518
12829 1 20 . 1 1 9 9 GLN CA C 9 56.819 56.819 57.633 -0.813 18518
12830 1 20 . 1 1 9 9 GLN CB C 9 30.019 30.019 29.059 0.959 18518
12831 1 20 . 1 1 9 9 GLN H H 9 7.355 7.355 7.619 -0.264 18518
12832 1 20 . 1 1 10 10 ARG N N 10 118.294 118.294 117.507 0.787 18518
12833 1 20 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.217 0.085 18518
12834 1 20 . 1 1 10 10 ARG C C 10 179.380 179.380 177.483 1.897 18518
12835 1 20 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.564 -0.296 18518
12836 1 20 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.992 0.650 18518
12837 1 20 . 1 1 10 10 ARG H H 10 7.936 7.936 7.977 -0.041 18518
12838 1 20 . 1 1 11 11 ARG N N 11 121.137 121.137 120.270 0.867 18518
12839 1 20 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.735 -0.055 18518
12840 1 20 . 1 1 11 11 ARG CA C 11 53.453 53.453 53.662 -0.209 18518
12841 1 20 . 1 1 11 11 ARG CB C 11 32.938 32.938 31.266 1.672 18518
12842 1 20 . 1 1 11 11 ARG H H 11 7.390 7.390 8.174 -0.784 18518
12843 1 20 . 1 1 12 12 THR N N 12 116.819 116.819 118.689 -1.870 18518
12844 1 20 . 1 1 12 12 THR HA H 12 4.359 4.359 4.336 0.023 18518
12845 1 20 . 1 1 12 12 THR C C 12 174.989 174.989 175.725 -0.736 18518
12846 1 20 . 1 1 12 12 THR CA C 12 61.748 61.748 61.619 0.129 18518
12847 1 20 . 1 1 12 12 THR CB C 12 71.068 71.068 70.189 0.879 18518
12848 1 20 . 1 1 12 12 THR H H 12 8.953 8.953 8.540 0.413 18518
12849 1 20 . 1 1 13 13 PHE N N 13 123.200 123.200 123.833 -0.633 18518
12850 1 20 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.151 -0.123 18518
12851 1 20 . 1 1 13 13 PHE C C 13 176.029 176.029 177.036 -1.007 18518
12852 1 20 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.751 0.113 18518
12853 1 20 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.406 0.154 18518
12854 1 20 . 1 1 13 13 PHE H H 13 9.284 9.284 9.177 0.107 18518
12855 1 20 . 1 1 14 14 GLU N N 14 115.414 115.414 117.788 -2.374 18518
12856 1 20 . 1 1 14 14 GLU HA H 14 3.794 3.794 3.839 -0.045 18518
12857 1 20 . 1 1 14 14 GLU C C 14 180.081 180.081 179.070 1.011 18518
12858 1 20 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.829 0.790 18518
12859 1 20 . 1 1 14 14 GLU CB C 14 28.852 28.852 28.945 -0.093 18518
12860 1 20 . 1 1 14 14 GLU H H 14 8.973 8.973 8.822 0.151 18518
12861 1 20 . 1 1 15 15 GLN N N 15 119.276 119.276 118.050 1.226 18518
12862 1 20 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.098 -0.098 18518
12863 1 20 . 1 1 15 15 GLN C C 15 177.978 177.978 178.718 -0.740 18518
12864 1 20 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.492 0.343 18518
12865 1 20 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.174 1.196 18518
12866 1 20 . 1 1 15 15 GLN H H 15 7.756 7.756 7.742 0.014 18518
12867 1 20 . 1 1 16 16 ARG N N 16 121.336 121.336 120.725 0.611 18518
12868 1 20 . 1 1 16 16 ARG HA H 16 4.270 4.270 3.989 0.281 18518
12869 1 20 . 1 1 16 16 ARG C C 16 177.416 177.416 178.549 -1.133 18518
12870 1 20 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.738 1.637 18518
12871 1 20 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.247 0.358 18518
12872 1 20 . 1 1 16 16 ARG H H 16 8.645 8.645 8.151 0.494 18518
12873 1 20 . 1 1 17 17 VAL N N 17 117.630 117.630 119.479 -1.849 18518
12874 1 20 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.503 0.354 18518
12875 1 20 . 1 1 17 17 VAL C C 17 179.748 179.748 178.106 1.642 18518
12876 1 20 . 1 1 17 17 VAL CA C 17 65.726 65.726 66.697 -0.971 18518
12877 1 20 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.545 0.649 18518
12878 1 20 . 1 1 17 17 VAL H H 17 8.373 8.373 8.387 -0.014 18518
12879 1 20 . 1 1 18 18 GLU N N 18 120.864 120.864 119.189 1.675 18518
12880 1 20 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.906 0.396 18518
12881 1 20 . 1 1 18 18 GLU C C 18 177.728 177.728 178.316 -0.588 18518
12882 1 20 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.650 -1.164 18518
12883 1 20 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.292 0.090 18518
12884 1 20 . 1 1 18 18 GLU H H 18 7.368 7.368 7.874 -0.506 18518
12885 1 20 . 1 1 19 19 ASP N N 19 121.425 121.425 119.863 1.562 18518
12886 1 20 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.338 0.096 18518
12887 1 20 . 1 1 19 19 ASP C C 19 179.978 179.978 178.489 1.489 18518
12888 1 20 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.427 -0.005 18518
12889 1 20 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.979 0.308 18518
12890 1 20 . 1 1 19 19 ASP H H 19 8.671 8.671 8.015 0.656 18518
12891 1 20 . 1 1 20 20 VAL N N 20 119.730 119.730 120.303 -0.573 18518
12892 1 20 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.520 -0.315 18518
12893 1 20 . 1 1 20 20 VAL C C 20 176.284 176.284 178.251 -1.967 18518
12894 1 20 . 1 1 20 20 VAL CA C 20 66.315 66.315 66.031 0.284 18518
12895 1 20 . 1 1 20 20 VAL CB C 20 31.107 31.107 30.958 0.149 18518
12896 1 20 . 1 1 20 20 VAL H H 20 7.999 7.999 8.373 -0.374 18518
12897 1 20 . 1 1 21 21 ARG N N 21 121.455 121.455 119.602 1.853 18518
12898 1 20 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.984 -0.170 18518
12899 1 20 . 1 1 21 21 ARG C C 21 180.120 180.120 178.667 1.453 18518
12900 1 20 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.900 0.930 18518
12901 1 20 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.108 0.838 18518
12902 1 20 . 1 1 21 21 ARG H H 21 8.098 8.098 7.901 0.197 18518
12903 1 20 . 1 1 22 22 LEU N N 22 117.826 117.826 121.579 -3.753 18518
12904 1 20 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.118 -0.069 18518
12905 1 20 . 1 1 22 22 LEU C C 22 180.115 180.115 178.445 1.670 18518
12906 1 20 . 1 1 22 22 LEU CA C 22 57.790 57.790 57.678 0.112 18518
12907 1 20 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.602 0.540 18518
12908 1 20 . 1 1 22 22 LEU H H 22 8.207 8.207 8.238 -0.031 18518
12909 1 20 . 1 1 23 23 ILE N N 23 121.450 121.450 119.855 1.595 18518
12910 1 20 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.674 0.339 18518
12911 1 20 . 1 1 23 23 ILE C C 23 178.149 178.149 178.018 0.131 18518
12912 1 20 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.862 -2.692 18518
12913 1 20 . 1 1 23 23 ILE CB C 23 38.106 38.106 37.706 0.400 18518
12914 1 20 . 1 1 23 23 ILE H H 23 8.105 8.105 8.467 -0.362 18518
12915 1 20 . 1 1 24 24 ARG N N 24 121.139 121.139 118.949 2.190 18518
12916 1 20 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.055 -0.068 18518
12917 1 20 . 1 1 24 24 ARG C C 24 178.702 178.702 178.345 0.357 18518
12918 1 20 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.937 -1.219 18518
12919 1 20 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.811 -1.042 18518
12920 1 20 . 1 1 24 24 ARG H H 24 8.601 8.601 8.359 0.242 18518
12921 1 20 . 1 1 25 25 GLU N N 25 118.054 118.054 119.157 -1.103 18518
12922 1 20 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.138 -0.112 18518
12923 1 20 . 1 1 25 25 GLU C C 25 178.492 178.492 178.750 -0.258 18518
12924 1 20 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.564 0.216 18518
12925 1 20 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.956 0.045 18518
12926 1 20 . 1 1 25 25 GLU H H 25 7.423 7.423 7.662 -0.239 18518
12927 1 20 . 1 1 26 26 GLN N N 26 116.350 116.350 116.445 -0.095 18518
12928 1 20 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.018 -0.082 18518
12929 1 20 . 1 1 26 26 GLN C C 26 176.305 176.305 177.100 -0.795 18518
12930 1 20 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.477 0.026 18518
12931 1 20 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.634 0.573 18518
12932 1 20 . 1 1 26 26 GLN H H 26 7.524 7.524 7.723 -0.199 18518
12933 1 20 . 1 1 27 27 HIS N N 27 116.017 116.017 118.588 -2.571 18518
12934 1 20 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.123 -0.193 18518
12935 1 20 . 1 1 27 27 HIS CA C 27 53.054 53.054 53.258 -0.204 18518
12936 1 20 . 1 1 27 27 HIS CB C 27 30.747 30.747 30.237 0.510 18518
12937 1 20 . 1 1 27 27 HIS H H 27 8.284 8.284 8.257 0.027 18518
12938 1 20 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.525 0.056 18518
12939 1 20 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.383 0.536 18518
12940 1 20 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.370 0.085 18518
12941 1 20 . 1 1 29 29 THR N N 29 107.011 107.011 107.845 -0.834 18518
12942 1 20 . 1 1 29 29 THR HA H 29 4.599 4.599 4.679 -0.080 18518
12943 1 20 . 1 1 29 29 THR C C 29 172.884 172.884 174.187 -1.303 18518
12944 1 20 . 1 1 29 29 THR CA C 29 60.810 60.810 61.608 -0.798 18518
12945 1 20 . 1 1 29 29 THR CB C 29 68.531 68.531 68.610 -0.079 18518
12946 1 20 . 1 1 29 29 THR H H 29 7.890 7.890 8.420 -0.530 18518
12947 1 20 . 1 1 30 30 LYS N N 30 117.679 117.679 120.722 -3.043 18518
12948 1 20 . 1 1 30 30 LYS HA H 30 4.858 4.858 5.040 -0.182 18518
12949 1 20 . 1 1 30 30 LYS C C 30 174.310 174.310 174.253 0.057 18518
12950 1 20 . 1 1 30 30 LYS CA C 30 53.751 53.751 53.915 -0.164 18518
12951 1 20 . 1 1 30 30 LYS CB C 30 35.804 35.804 36.289 -0.485 18518
12952 1 20 . 1 1 30 30 LYS H H 30 7.441 7.441 7.442 -0.001 18518
12953 1 20 . 1 1 31 31 ILE N N 31 122.849 122.849 120.956 1.893 18518
12954 1 20 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.404 -0.299 18518
12955 1 20 . 1 1 31 31 ILE CA C 31 54.801 54.801 56.661 -1.860 18518
12956 1 20 . 1 1 31 31 ILE CB C 31 38.265 38.265 40.152 -1.887 18518
12957 1 20 . 1 1 31 31 ILE H H 31 9.304 9.304 8.682 0.622 18518
12958 1 20 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.852 0.307 18518
12959 1 20 . 1 1 32 32 PRO C C 32 174.164 174.164 175.552 -1.388 18518
12960 1 20 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.315 -0.812 18518
12961 1 20 . 1 1 32 32 PRO CB C 32 31.145 31.145 31.378 -0.233 18518
12962 1 20 . 1 1 33 33 VAL N N 33 125.606 125.606 125.322 0.284 18518
12963 1 20 . 1 1 33 33 VAL HA H 33 5.213 5.213 4.798 0.415 18518
12964 1 20 . 1 1 33 33 VAL C C 33 173.654 173.654 173.254 0.400 18518
12965 1 20 . 1 1 33 33 VAL CA C 33 60.044 60.044 58.923 1.121 18518
12966 1 20 . 1 1 33 33 VAL CB C 33 35.604 35.604 35.968 -0.363 18518
12967 1 20 . 1 1 33 33 VAL H H 33 9.424 9.424 8.555 0.869 18518
12968 1 20 . 1 1 34 34 ILE N N 34 128.241 128.241 126.957 1.284 18518
12969 1 20 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.789 0.044 18518
12970 1 20 . 1 1 34 34 ILE C C 34 175.605 175.605 175.018 0.587 18518
12971 1 20 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.551 -1.786 18518
12972 1 20 . 1 1 34 34 ILE CB C 34 36.799 36.799 39.462 -2.663 18518
12973 1 20 . 1 1 34 34 ILE H H 34 8.721 8.721 8.859 -0.138 18518
12974 1 20 . 1 1 35 35 ILE N N 35 125.650 125.650 127.295 -1.645 18518
12975 1 20 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.622 0.214 18518
12976 1 20 . 1 1 35 35 ILE C C 35 174.887 174.887 174.308 0.579 18518
12977 1 20 . 1 1 35 35 ILE CA C 35 60.945 60.945 60.297 0.648 18518
12978 1 20 . 1 1 35 35 ILE CB C 35 39.210 39.210 39.810 -0.601 18518
12979 1 20 . 1 1 35 35 ILE H H 35 9.034 9.034 9.154 -0.120 18518
12980 1 20 . 1 1 36 36 GLU N N 36 122.657 122.657 127.503 -4.846 18518
12981 1 20 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.809 0.052 18518
12982 1 20 . 1 1 36 36 GLU C C 36 173.848 173.848 174.724 -0.876 18518
12983 1 20 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.349 -0.417 18518
12984 1 20 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.237 1.045 18518
12985 1 20 . 1 1 36 36 GLU H H 36 8.303 8.303 8.471 -0.168 18518
12986 1 20 . 1 1 37 37 ARG N N 37 123.228 123.228 126.284 -3.056 18518
12987 1 20 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.087 -0.361 18518
12988 1 20 . 1 1 37 37 ARG C C 37 176.359 176.359 175.717 0.642 18518
12989 1 20 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.152 0.207 18518
12990 1 20 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.583 0.758 18518
12991 1 20 . 1 1 37 37 ARG H H 37 8.856 8.856 8.656 0.200 18518
12992 1 20 . 1 1 38 38 TYR N N 38 128.981 128.981 128.101 0.880 18518
12993 1 20 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.171 0.181 18518
12994 1 20 . 1 1 38 38 TYR C C 38 177.316 177.316 176.321 0.995 18518
12995 1 20 . 1 1 38 38 TYR CA C 38 57.712 57.712 58.384 -0.672 18518
12996 1 20 . 1 1 38 38 TYR CB C 38 39.472 39.472 39.931 -0.459 18518
12997 1 20 . 1 1 38 38 TYR H H 38 8.628 8.628 8.393 0.235 18518
12998 1 20 . 1 1 39 39 LYS N N 39 130.635 130.635 126.200 4.435 18518
12999 1 20 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.818 0.004 18518
13000 1 20 . 1 1 39 39 LYS CA C 39 58.887 58.887 58.517 0.370 18518
13001 1 20 . 1 1 39 39 LYS CB C 39 31.771 31.771 32.079 -0.308 18518
13002 1 20 . 1 1 39 39 LYS H H 39 8.594 8.594 8.298 0.296 18518
13003 1 20 . 1 1 40 40 GLY C C 40 173.447 173.447 174.688 -1.241 18518
13004 1 20 . 1 1 40 40 GLY CA C 40 44.663 44.663 44.167 0.496 18518
13005 1 20 . 1 1 40 40 GLY H H 40 5.188 5.188 6.520 -1.332 18518
13006 1 20 . 1 1 41 41 GLU N N 41 122.836 122.836 121.516 1.320 18518
13007 1 20 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.379 -0.122 18518
13008 1 20 . 1 1 41 41 GLU C C 41 176.524 176.524 175.955 0.569 18518
13009 1 20 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.569 -0.043 18518
13010 1 20 . 1 1 41 41 GLU CB C 41 30.985 30.985 30.242 0.743 18518
13011 1 20 . 1 1 41 41 GLU H H 41 7.380 7.380 7.579 -0.199 18518
13012 1 20 . 1 1 42 42 LYS N N 42 124.040 124.040 122.210 1.830 18518
13013 1 20 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.486 0.189 18518
13014 1 20 . 1 1 42 42 LYS C C 42 177.538 177.538 177.312 0.226 18518
13015 1 20 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.772 -0.932 18518
13016 1 20 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.645 1.334 18518
13017 1 20 . 1 1 42 42 LYS H H 42 9.034 9.034 8.409 0.625 18518
13018 1 20 . 1 1 43 43 GLN N N 43 119.259 119.259 117.578 1.681 18518
13019 1 20 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.303 0.239 18518
13020 1 20 . 1 1 43 43 GLN C C 43 177.336 177.336 176.101 1.235 18518
13021 1 20 . 1 1 43 43 GLN CA C 43 57.673 57.673 57.066 0.607 18518
13022 1 20 . 1 1 43 43 GLN CB C 43 30.782 30.782 30.188 0.594 18518
13023 1 20 . 1 1 43 43 GLN H H 43 8.435 8.435 8.769 -0.334 18518
13024 1 20 . 1 1 44 44 LEU N N 44 120.760 120.760 123.470 -2.710 18518
13025 1 20 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.819 -0.124 18518
13026 1 20 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.261 0.984 18518
13027 1 20 . 1 1 44 44 LEU CB C 44 43.596 43.596 41.840 1.756 18518
13028 1 20 . 1 1 44 44 LEU H H 44 9.126 9.126 8.256 0.870 18518
13029 1 20 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.576 0.141 18518
13030 1 20 . 1 1 45 45 PRO C C 45 175.797 175.797 176.282 -0.485 18518
13031 1 20 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.063 0.048 18518
13032 1 20 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.376 0.216 18518
13033 1 20 . 1 1 46 46 VAL N N 46 119.052 119.052 120.468 -1.416 18518
13034 1 20 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.206 -0.339 18518
13035 1 20 . 1 1 46 46 VAL C C 46 175.640 175.640 176.850 -1.210 18518
13036 1 20 . 1 1 46 46 VAL CA C 46 62.944 62.944 62.665 0.279 18518
13037 1 20 . 1 1 46 46 VAL CB C 46 32.799 32.799 32.328 0.471 18518
13038 1 20 . 1 1 46 46 VAL H H 46 8.543 8.543 8.356 0.187 18518
13039 1 20 . 1 1 47 47 LEU N N 47 130.203 130.203 127.509 2.694 18518
13040 1 20 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.247 0.062 18518
13041 1 20 . 1 1 47 47 LEU C C 47 176.198 176.198 177.071 -0.873 18518
13042 1 20 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.466 -0.460 18518
13043 1 20 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.454 1.378 18518
13044 1 20 . 1 1 47 47 LEU H H 47 7.799 7.799 8.391 -0.592 18518
13045 1 20 . 1 1 48 48 ASP N N 48 122.403 122.403 120.344 2.059 18518
13046 1 20 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.511 -0.248 18518
13047 1 20 . 1 1 48 48 ASP C C 48 175.294 175.294 176.135 -0.841 18518
13048 1 20 . 1 1 48 48 ASP CA C 48 55.832 55.832 56.118 -0.286 18518
13049 1 20 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.236 -1.052 18518
13050 1 20 . 1 1 48 48 ASP H H 48 8.780 8.780 8.732 0.048 18518
13051 1 20 . 1 1 49 49 LYS N N 49 119.569 119.569 114.680 4.889 18518
13052 1 20 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.527 0.058 18518
13053 1 20 . 1 1 49 49 LYS C C 49 174.678 174.678 175.513 -0.835 18518
13054 1 20 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.292 -1.640 18518
13055 1 20 . 1 1 49 49 LYS CB C 49 35.945 35.945 35.238 0.707 18518
13056 1 20 . 1 1 49 49 LYS H H 49 7.280 7.280 7.727 -0.447 18518
13057 1 20 . 1 1 50 50 THR N N 50 110.862 110.862 112.168 -1.306 18518
13058 1 20 . 1 1 50 50 THR HA H 50 4.811 4.811 4.764 0.047 18518
13059 1 20 . 1 1 50 50 THR C C 50 172.425 172.425 174.245 -1.820 18518
13060 1 20 . 1 1 50 50 THR CA C 50 62.645 62.645 63.383 -0.738 18518
13061 1 20 . 1 1 50 50 THR CB C 50 71.648 71.648 70.360 1.288 18518
13062 1 20 . 1 1 50 50 THR H H 50 8.042 8.042 8.344 -0.302 18518
13063 1 20 . 1 1 51 51 LYS N N 51 120.008 120.008 123.182 -3.174 18518
13064 1 20 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.957 -0.332 18518
13065 1 20 . 1 1 51 51 LYS C C 51 175.082 175.082 176.022 -0.940 18518
13066 1 20 . 1 1 51 51 LYS CA C 51 54.704 54.704 55.553 -0.850 18518
13067 1 20 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.217 -0.841 18518
13068 1 20 . 1 1 51 51 LYS H H 51 7.119 7.119 7.558 -0.439 18518
13069 1 20 . 1 1 52 52 PHE N N 52 122.640 122.640 124.045 -1.405 18518
13070 1 20 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.723 0.614 18518
13071 1 20 . 1 1 52 52 PHE C C 52 174.213 174.213 174.384 -0.171 18518
13072 1 20 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.775 -0.164 18518
13073 1 20 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.001 0.139 18518
13074 1 20 . 1 1 52 52 PHE H H 52 9.709 9.709 9.202 0.507 18518
13075 1 20 . 1 1 53 53 LEU N N 53 122.157 122.157 124.245 -2.088 18518
13076 1 20 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.890 0.057 18518
13077 1 20 . 1 1 53 53 LEU C C 53 175.769 175.769 176.136 -0.367 18518
13078 1 20 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.981 -1.024 18518
13079 1 20 . 1 1 53 53 LEU CB C 53 44.415 44.415 42.946 1.469 18518
13080 1 20 . 1 1 53 53 LEU H H 53 8.959 8.959 8.562 0.397 18518
13081 1 20 . 1 1 54 54 VAL N N 54 124.919 124.919 122.178 2.741 18518
13082 1 20 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.726 -0.167 18518
13083 1 20 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.173 0.957 18518
13084 1 20 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.601 1.367 18518
13085 1 20 . 1 1 54 54 VAL H H 54 8.922 8.922 8.395 0.527 18518
13086 1 20 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.917 -0.476 18518
13087 1 20 . 1 1 55 55 PRO C C 55 176.594 176.594 177.885 -1.291 18518
13088 1 20 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.082 2.233 18518
13089 1 20 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.690 -0.025 18518
13090 1 20 . 1 1 56 56 ASP N N 56 120.522 120.522 122.711 -2.189 18518
13091 1 20 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.225 -0.363 18518
13092 1 20 . 1 1 56 56 ASP C C 56 175.809 175.809 177.174 -1.365 18518
13093 1 20 . 1 1 56 56 ASP CA C 56 56.749 56.749 56.920 -0.171 18518
13094 1 20 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.453 0.057 18518
13095 1 20 . 1 1 56 56 ASP H H 56 8.347 8.347 8.355 -0.008 18518
13096 1 20 . 1 1 57 57 HIS N N 57 113.482 113.482 115.453 -1.971 18518
13097 1 20 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.505 0.215 18518
13098 1 20 . 1 1 57 57 HIS C C 57 176.507 176.507 175.391 1.116 18518
13099 1 20 . 1 1 57 57 HIS CA C 57 55.589 55.589 56.551 -0.962 18518
13100 1 20 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.501 1.142 18518
13101 1 20 . 1 1 57 57 HIS H H 57 7.557 7.557 8.147 -0.590 18518
13102 1 20 . 1 1 58 58 VAL N N 58 123.279 123.279 121.228 2.051 18518
13103 1 20 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.110 -0.274 18518
13104 1 20 . 1 1 58 58 VAL C C 58 175.019 175.019 174.680 0.339 18518
13105 1 20 . 1 1 58 58 VAL CA C 58 62.823 62.823 60.725 2.098 18518
13106 1 20 . 1 1 58 58 VAL CB C 58 32.310 32.310 33.633 -1.323 18518
13107 1 20 . 1 1 58 58 VAL H H 58 7.345 7.345 7.288 0.057 18518
13108 1 20 . 1 1 59 59 ASN N N 59 123.781 123.781 123.911 -0.130 18518
13109 1 20 . 1 1 59 59 ASN HA H 59 5.126 5.126 4.799 0.327 18518
13110 1 20 . 1 1 59 59 ASN C C 59 176.558 176.558 176.154 0.404 18518
13111 1 20 . 1 1 59 59 ASN CA C 59 51.485 51.485 52.484 -0.999 18518
13112 1 20 . 1 1 59 59 ASN CB C 59 40.107 40.107 39.697 0.409 18518
13113 1 20 . 1 1 59 59 ASN H H 59 8.735 8.735 8.532 0.203 18518
13114 1 20 . 1 1 60 60 MET N N 60 117.453 117.453 118.658 -1.205 18518
13115 1 20 . 1 1 60 60 MET HA H 60 4.395 4.395 4.168 0.227 18518
13116 1 20 . 1 1 60 60 MET C C 60 178.144 178.144 178.066 0.078 18518
13117 1 20 . 1 1 60 60 MET CA C 60 57.097 57.097 58.924 -1.827 18518
13118 1 20 . 1 1 60 60 MET CB C 60 30.140 30.140 31.816 -1.676 18518
13119 1 20 . 1 1 60 60 MET H H 60 8.227 8.227 8.204 0.023 18518
13120 1 20 . 1 1 61 61 SER N N 61 114.216 114.216 114.964 -0.748 18518
13121 1 20 . 1 1 61 61 SER HA H 61 4.111 4.111 4.015 0.096 18518
13122 1 20 . 1 1 61 61 SER C C 61 177.335 177.335 176.679 0.656 18518
13123 1 20 . 1 1 61 61 SER CA C 61 61.590 61.590 62.106 -0.516 18518
13124 1 20 . 1 1 61 61 SER CB C 61 62.402 62.402 62.836 -0.433 18518
13125 1 20 . 1 1 61 61 SER H H 61 8.464 8.464 8.337 0.127 18518
13126 1 20 . 1 1 62 62 GLU N N 62 123.004 123.004 121.009 1.995 18518
13127 1 20 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.073 -0.026 18518
13128 1 20 . 1 1 62 62 GLU C C 62 178.686 178.686 178.883 -0.197 18518
13129 1 20 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.971 -0.346 18518
13130 1 20 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.326 0.328 18518
13131 1 20 . 1 1 62 62 GLU H H 62 7.994 7.994 7.557 0.437 18518
13132 1 20 . 1 1 63 63 LEU N N 63 120.818 120.818 122.031 -1.213 18518
13133 1 20 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.977 -0.012 18518
13134 1 20 . 1 1 63 63 LEU C C 63 178.046 178.046 178.841 -0.795 18518
13135 1 20 . 1 1 63 63 LEU CA C 63 57.920 57.920 57.868 0.052 18518
13136 1 20 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.419 0.205 18518
13137 1 20 . 1 1 63 63 LEU H H 63 8.130 8.130 7.717 0.413 18518
13138 1 20 . 1 1 64 64 ILE N N 64 118.528 118.528 119.004 -0.476 18518
13139 1 20 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.640 -0.271 18518
13140 1 20 . 1 1 64 64 ILE C C 64 177.127 177.127 177.988 -0.861 18518
13141 1 20 . 1 1 64 64 ILE CA C 64 66.678 66.678 63.910 2.768 18518
13142 1 20 . 1 1 64 64 ILE CB C 64 38.444 38.444 36.016 2.428 18518
13143 1 20 . 1 1 64 64 ILE H H 64 8.488 8.488 8.629 -0.141 18518
13144 1 20 . 1 1 65 65 LYS N N 65 118.336 118.336 121.090 -2.754 18518
13145 1 20 . 1 1 65 65 LYS HA H 65 3.701 3.701 4.013 -0.312 18518
13146 1 20 . 1 1 65 65 LYS C C 65 179.291 179.291 179.310 -0.019 18518
13147 1 20 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.654 0.786 18518
13148 1 20 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.013 0.358 18518
13149 1 20 . 1 1 65 65 LYS H H 65 7.347 7.347 7.804 -0.457 18518
13150 1 20 . 1 1 66 66 ILE N N 66 120.171 120.171 120.500 -0.329 18518
13151 1 20 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.735 -0.157 18518
13152 1 20 . 1 1 66 66 ILE C C 66 178.873 178.873 178.188 0.685 18518
13153 1 20 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.327 -0.167 18518
13154 1 20 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.868 0.765 18518
13155 1 20 . 1 1 66 66 ILE H H 66 7.901 7.901 8.007 -0.106 18518
13156 1 20 . 1 1 67 67 ILE N N 67 121.185 121.185 121.148 0.037 18518
13157 1 20 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.527 -0.081 18518
13158 1 20 . 1 1 67 67 ILE C C 67 177.150 177.150 177.680 -0.530 18518
13159 1 20 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.861 -2.055 18518
13160 1 20 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.214 -2.219 18518
13161 1 20 . 1 1 67 67 ILE H H 67 8.290 8.290 7.899 0.391 18518
13162 1 20 . 1 1 68 68 ARG N N 68 119.173 119.173 119.067 0.106 18518
13163 1 20 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.835 -0.904 18518
13164 1 20 . 1 1 68 68 ARG C C 68 178.496 178.496 178.749 -0.253 18518
13165 1 20 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.893 0.743 18518
13166 1 20 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.881 0.559 18518
13167 1 20 . 1 1 68 68 ARG H H 68 8.438 8.438 8.333 0.105 18518
13168 1 20 . 1 1 69 69 ARG N N 69 116.511 116.511 119.368 -2.857 18518
13169 1 20 . 1 1 69 69 ARG HA H 69 4.134 4.134 4.005 0.129 18518
13170 1 20 . 1 1 69 69 ARG C C 69 180.262 180.262 178.948 1.314 18518
13171 1 20 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.342 -0.635 18518
13172 1 20 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.267 -0.314 18518
13173 1 20 . 1 1 69 69 ARG H H 69 7.497 7.497 8.381 -0.884 18518
13174 1 20 . 1 1 70 70 ARG N N 70 123.297 123.297 119.076 4.221 18518
13175 1 20 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.127 -0.111 18518
13176 1 20 . 1 1 70 70 ARG C C 70 178.700 178.700 178.255 0.445 18518
13177 1 20 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.579 0.881 18518
13178 1 20 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.835 0.476 18518
13179 1 20 . 1 1 70 70 ARG H H 70 8.075 8.075 8.019 0.056 18518
13180 1 20 . 1 1 71 71 LEU N N 71 116.829 116.829 120.163 -3.334 18518
13181 1 20 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.147 -0.082 18518
13182 1 20 . 1 1 71 71 LEU C C 71 174.956 174.956 176.221 -1.265 18518
13183 1 20 . 1 1 71 71 LEU CA C 71 55.126 55.126 55.608 -0.482 18518
13184 1 20 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.285 0.961 18518
13185 1 20 . 1 1 71 71 LEU H H 71 7.719 7.719 8.087 -0.368 18518
13186 1 20 . 1 1 72 72 GLN N N 72 114.991 114.991 115.575 -0.584 18518
13187 1 20 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.949 -0.113 18518
13188 1 20 . 1 1 72 72 GLN C C 72 175.683 175.683 175.116 0.567 18518
13189 1 20 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.293 0.032 18518
13190 1 20 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.738 0.266 18518
13191 1 20 . 1 1 72 72 GLN H H 72 7.744 7.744 7.503 0.241 18518
13192 1 20 . 1 1 73 73 LEU N N 73 115.045 115.045 119.623 -4.578 18518
13193 1 20 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.128 0.108 18518
13194 1 20 . 1 1 73 73 LEU C C 73 178.762 178.762 177.108 1.654 18518
13195 1 20 . 1 1 73 73 LEU CA C 73 54.386 54.386 54.998 -0.612 18518
13196 1 20 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.966 0.125 18518
13197 1 20 . 1 1 73 73 LEU H H 73 7.500 7.500 7.623 -0.123 18518
13198 1 20 . 1 1 74 74 ASN N N 74 121.700 121.700 122.929 -1.229 18518
13199 1 20 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.524 0.166 18518
13200 1 20 . 1 1 74 74 ASN C C 74 176.617 176.617 175.774 0.843 18518
13201 1 20 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.932 -1.247 18518
13202 1 20 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.471 0.127 18518
13203 1 20 . 1 1 74 74 ASN H H 74 9.045 9.045 8.548 0.497 18518
13204 1 20 . 1 1 75 75 ALA N N 75 123.952 123.952 121.734 2.218 18518
13205 1 20 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.302 -0.338 18518
13206 1 20 . 1 1 75 75 ALA C C 75 178.131 178.131 177.099 1.032 18518
13207 1 20 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.418 1.450 18518
13208 1 20 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.520 -0.802 18518
13209 1 20 . 1 1 75 75 ALA H H 75 8.784 8.784 8.492 0.292 18518
13210 1 20 . 1 1 76 76 ASN N N 76 112.295 112.295 115.194 -2.899 18518
13211 1 20 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.747 -0.167 18518
13212 1 20 . 1 1 76 76 ASN C C 76 175.448 175.448 174.573 0.875 18518
13213 1 20 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.094 0.120 18518
13214 1 20 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.793 -0.473 18518
13215 1 20 . 1 1 76 76 ASN H H 76 8.391 8.391 8.136 0.255 18518
13216 1 20 . 1 1 77 77 GLN N N 77 120.577 120.577 118.982 1.595 18518
13217 1 20 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.531 -0.258 18518
13218 1 20 . 1 1 77 77 GLN C C 77 175.045 175.045 173.798 1.247 18518
13219 1 20 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.868 0.937 18518
13220 1 20 . 1 1 77 77 GLN CB C 77 30.157 30.157 30.961 -0.804 18518
13221 1 20 . 1 1 77 77 GLN H H 77 7.552 7.552 7.488 0.064 18518
13222 1 20 . 1 1 78 78 ALA N N 78 130.670 130.670 123.878 6.792 18518
13223 1 20 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.609 -0.438 18518
13224 1 20 . 1 1 78 78 ALA C C 78 176.512 176.512 175.808 0.704 18518
13225 1 20 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.461 1.381 18518
13226 1 20 . 1 1 78 78 ALA CB C 78 20.060 20.060 20.659 -0.599 18518
13227 1 20 . 1 1 78 78 ALA H H 78 8.799 8.799 8.232 0.567 18518
13228 1 20 . 1 1 79 79 PHE N N 79 119.325 119.325 115.778 3.547 18518
13229 1 20 . 1 1 79 79 PHE HA H 79 4.434 4.434 4.806 -0.372 18518
13230 1 20 . 1 1 79 79 PHE C C 79 171.726 171.726 172.524 -0.798 18518
13231 1 20 . 1 1 79 79 PHE CA C 79 59.145 59.145 57.051 2.094 18518
13232 1 20 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.153 1.018 18518
13233 1 20 . 1 1 79 79 PHE H H 79 7.664 7.664 7.815 -0.151 18518
13234 1 20 . 1 1 80 80 PHE N N 80 126.314 126.314 118.158 8.156 18518
13235 1 20 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.619 -0.227 18518
13236 1 20 . 1 1 80 80 PHE C C 80 177.169 177.169 173.704 3.465 18518
13237 1 20 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.841 -0.188 18518
13238 1 20 . 1 1 80 80 PHE CB C 80 41.933 41.933 43.098 -1.165 18518
13239 1 20 . 1 1 80 80 PHE H H 80 8.508 8.508 9.180 -0.672 18518
13240 1 20 . 1 1 81 81 LEU N N 81 121.426 121.426 124.010 -2.584 18518
13241 1 20 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.036 -0.185 18518
13242 1 20 . 1 1 81 81 LEU C C 81 174.488 174.488 175.250 -0.762 18518
13243 1 20 . 1 1 81 81 LEU CA C 81 53.197 53.197 54.019 -0.822 18518
13244 1 20 . 1 1 81 81 LEU CB C 81 45.100 45.100 43.551 1.549 18518
13245 1 20 . 1 1 81 81 LEU H H 81 8.229 8.229 8.605 -0.376 18518
13246 1 20 . 1 1 82 82 LEU N N 82 125.155 125.155 127.283 -2.128 18518
13247 1 20 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.689 0.144 18518
13248 1 20 . 1 1 82 82 LEU C C 82 177.166 177.166 175.636 1.530 18518
13249 1 20 . 1 1 82 82 LEU CA C 82 54.197 54.197 52.186 2.011 18518
13250 1 20 . 1 1 82 82 LEU CB C 82 43.442 43.442 42.775 0.667 18518
13251 1 20 . 1 1 82 82 LEU H H 82 9.400 9.400 9.154 0.246 18518
13252 1 20 . 1 1 83 83 VAL N N 83 123.886 123.886 122.685 1.201 18518
13253 1 20 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.290 0.089 18518
13254 1 20 . 1 1 83 83 VAL C C 83 175.810 175.810 176.883 -1.073 18518
13255 1 20 . 1 1 83 83 VAL CA C 83 61.677 61.677 61.911 -0.234 18518
13256 1 20 . 1 1 83 83 VAL CB C 83 33.758 33.758 32.353 1.405 18518
13257 1 20 . 1 1 83 83 VAL H H 83 8.721 8.721 8.713 0.008 18518
13258 1 20 . 1 1 84 84 ASN N N 84 126.474 126.474 128.811 -2.337 18518
13259 1 20 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.477 -0.081 18518
13260 1 20 . 1 1 84 84 ASN C C 84 175.164 175.164 175.034 0.130 18518
13261 1 20 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.708 0.030 18518
13262 1 20 . 1 1 84 84 ASN CB C 84 37.950 37.950 37.566 0.384 18518
13263 1 20 . 1 1 84 84 ASN H H 84 9.707 9.707 9.359 0.348 18518
13264 1 20 . 1 1 85 85 GLY N N 85 101.296 101.296 104.783 -3.487 18518
13265 1 20 . 1 1 85 85 GLY C C 85 173.680 173.680 173.279 0.401 18518
13266 1 20 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.869 0.734 18518
13267 1 20 . 1 1 85 85 GLY H H 85 8.644 8.644 8.394 0.250 18518
13268 1 20 . 1 1 86 86 HIS N N 86 117.238 117.238 118.228 -0.990 18518
13269 1 20 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.957 0.060 18518
13270 1 20 . 1 1 86 86 HIS C C 86 173.841 173.841 174.176 -0.335 18518
13271 1 20 . 1 1 86 86 HIS CA C 86 53.796 53.796 54.415 -0.619 18518
13272 1 20 . 1 1 86 86 HIS CB C 86 31.280 31.280 32.765 -1.485 18518
13273 1 20 . 1 1 86 86 HIS H H 86 7.918 7.918 8.394 -0.476 18518
13274 1 20 . 1 1 87 87 SER N N 87 118.179 118.179 120.585 -2.406 18518
13275 1 20 . 1 1 87 87 SER HA H 87 4.699 4.699 4.483 0.216 18518
13276 1 20 . 1 1 87 87 SER C C 87 175.904 175.904 174.887 1.017 18518
13277 1 20 . 1 1 87 87 SER CA C 87 58.271 58.271 59.457 -1.186 18518
13278 1 20 . 1 1 87 87 SER CB C 87 63.735 63.735 62.173 1.562 18518
13279 1 20 . 1 1 87 87 SER H H 87 8.977 8.977 8.926 0.051 18518
13280 1 20 . 1 1 88 88 MET N N 88 125.472 125.472 123.872 1.600 18518
13281 1 20 . 1 1 88 88 MET HA H 88 4.830 4.830 4.740 0.089 18518
13282 1 20 . 1 1 88 88 MET C C 88 176.419 176.419 174.472 1.947 18518
13283 1 20 . 1 1 88 88 MET CA C 88 54.899 54.899 54.739 0.161 18518
13284 1 20 . 1 1 88 88 MET CB C 88 33.336 33.336 33.730 -0.395 18518
13285 1 20 . 1 1 88 88 MET H H 88 9.184 9.184 8.250 0.934 18518
13286 1 20 . 1 1 89 89 VAL N N 89 120.747 120.747 121.830 -1.083 18518
13287 1 20 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.405 -0.173 18518
13288 1 20 . 1 1 89 89 VAL C C 89 175.958 175.958 174.626 1.332 18518
13289 1 20 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.435 1.719 18518
13290 1 20 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.346 -1.468 18518
13291 1 20 . 1 1 89 89 VAL H H 89 8.233 8.233 7.754 0.479 18518
13292 1 20 . 1 1 90 90 SER N N 90 117.362 117.362 123.832 -6.470 18518
13293 1 20 . 1 1 90 90 SER HA H 90 4.590 4.590 4.710 -0.120 18518
13294 1 20 . 1 1 90 90 SER C C 90 175.741 175.741 175.821 -0.080 18518
13295 1 20 . 1 1 90 90 SER CA C 90 57.717 57.717 56.977 0.740 18518
13296 1 20 . 1 1 90 90 SER CB C 90 63.223 63.223 64.520 -1.297 18518
13297 1 20 . 1 1 90 90 SER H H 90 8.482 8.482 8.462 0.020 18518
13298 1 20 . 1 1 91 91 VAL N N 91 120.466 120.466 120.672 -0.206 18518
13299 1 20 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.753 0.294 18518
13300 1 20 . 1 1 91 91 VAL C C 91 176.329 176.329 176.471 -0.142 18518
13301 1 20 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.701 -1.209 18518
13302 1 20 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.340 1.228 18518
13303 1 20 . 1 1 91 91 VAL H H 91 8.188 8.188 8.739 -0.551 18518
13304 1 20 . 1 1 92 92 SER N N 92 116.398 116.398 115.326 1.072 18518
13305 1 20 . 1 1 92 92 SER HA H 92 4.636 4.636 4.522 0.114 18518
13306 1 20 . 1 1 92 92 SER C C 92 174.159 174.159 174.442 -0.283 18518
13307 1 20 . 1 1 92 92 SER CA C 92 57.805 57.805 58.886 -1.081 18518
13308 1 20 . 1 1 92 92 SER CB C 92 63.046 63.046 63.352 -0.306 18518
13309 1 20 . 1 1 92 92 SER H H 92 8.370 8.370 8.276 0.094 18518
13310 1 20 . 1 1 93 93 THR N N 93 119.211 119.211 119.273 -0.062 18518
13311 1 20 . 1 1 93 93 THR HA H 93 4.484 4.484 4.712 -0.228 18518
13312 1 20 . 1 1 93 93 THR CA C 93 60.884 60.884 60.336 0.548 18518
13313 1 20 . 1 1 93 93 THR CB C 93 70.609 70.609 69.302 1.307 18518
13314 1 20 . 1 1 93 93 THR H H 93 7.416 7.416 7.726 -0.310 18518
13315 1 20 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.593 -0.153 18518
13316 1 20 . 1 1 94 94 PRO C C 94 178.775 178.775 176.917 1.858 18518
13317 1 20 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.454 0.489 18518
13318 1 20 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.448 0.201 18518
13319 1 20 . 1 1 95 95 ILE N N 95 124.174 124.174 123.809 0.365 18518
13320 1 20 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.787 0.162 18518
13321 1 20 . 1 1 95 95 ILE C C 95 176.498 176.498 176.732 -0.234 18518
13322 1 20 . 1 1 95 95 ILE CA C 95 63.904 63.904 62.642 1.262 18518
13323 1 20 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.195 -0.013 18518
13324 1 20 . 1 1 95 95 ILE H H 95 9.305 9.305 7.900 1.405 18518
13325 1 20 . 1 1 96 96 SER N N 96 116.920 116.920 116.452 0.468 18518
13326 1 20 . 1 1 96 96 SER HA H 96 4.029 4.029 4.130 -0.101 18518
13327 1 20 . 1 1 96 96 SER C C 96 176.574 176.574 176.253 0.321 18518
13328 1 20 . 1 1 96 96 SER CA C 96 61.356 61.356 62.454 -1.098 18518
13329 1 20 . 1 1 96 96 SER CB C 96 61.723 61.723 62.455 -0.732 18518
13330 1 20 . 1 1 96 96 SER H H 96 8.335 8.335 8.556 -0.221 18518
13331 1 20 . 1 1 97 97 GLU N N 97 123.255 123.255 122.570 0.685 18518
13332 1 20 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.140 0.138 18518
13333 1 20 . 1 1 97 97 GLU C C 97 179.716 179.716 178.814 0.902 18518
13334 1 20 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.797 -0.005 18518
13335 1 20 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.271 0.291 18518
13336 1 20 . 1 1 97 97 GLU H H 97 7.376 7.376 7.752 -0.376 18518
13337 1 20 . 1 1 98 98 VAL N N 98 121.137 121.137 120.225 0.912 18518
13338 1 20 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.688 0.114 18518
13339 1 20 . 1 1 98 98 VAL C C 98 177.637 177.637 177.964 -0.327 18518
13340 1 20 . 1 1 98 98 VAL CA C 98 65.824 65.824 67.224 -1.400 18518
13341 1 20 . 1 1 98 98 VAL CB C 98 32.154 32.154 31.378 0.775 18518
13342 1 20 . 1 1 98 98 VAL H H 98 7.387 7.387 7.821 -0.434 18518
13343 1 20 . 1 1 99 99 TYR N N 99 118.927 118.927 121.553 -2.626 18518
13344 1 20 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.049 -0.059 18518
13345 1 20 . 1 1 99 99 TYR C C 99 176.081 176.081 176.959 -0.878 18518
13346 1 20 . 1 1 99 99 TYR CA C 99 62.223 62.223 61.650 0.573 18518
13347 1 20 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.530 0.452 18518
13348 1 20 . 1 1 99 99 TYR H H 99 9.048 9.048 8.286 0.762 18518
13349 1 20 . 1 1 100 100 GLU N N 100 113.894 113.894 116.612 -2.718 18518
13350 1 20 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.654 0.192 18518
13351 1 20 . 1 1 100 100 GLU C C 100 177.989 177.989 177.901 0.088 18518
13352 1 20 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.266 0.821 18518
13353 1 20 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.788 0.594 18518
13354 1 20 . 1 1 100 100 GLU H H 100 7.422 7.422 8.060 -0.638 18518
13355 1 20 . 1 1 101 101 SER N N 101 108.991 108.991 113.528 -4.537 18518
13356 1 20 . 1 1 101 101 SER HA H 101 4.524 4.524 4.374 0.150 18518
13357 1 20 . 1 1 101 101 SER C C 101 176.628 176.628 175.757 0.871 18518
13358 1 20 . 1 1 101 101 SER CA C 101 60.349 60.349 59.600 0.749 18518
13359 1 20 . 1 1 101 101 SER CB C 101 64.741 64.741 64.051 0.690 18518
13360 1 20 . 1 1 101 101 SER H H 101 7.424 7.424 7.737 -0.313 18518
13361 1 20 . 1 1 102 102 GLU N N 102 116.533 116.533 119.323 -2.790 18518
13362 1 20 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.534 0.210 18518
13363 1 20 . 1 1 102 102 GLU C C 102 176.774 176.774 176.180 0.594 18518
13364 1 20 . 1 1 102 102 GLU CA C 102 55.581 55.581 54.936 0.645 18518
13365 1 20 . 1 1 102 102 GLU CB C 102 30.697 30.697 30.476 0.221 18518
13366 1 20 . 1 1 102 102 GLU H H 102 8.487 8.487 7.973 0.514 18518
13367 1 20 . 1 1 103 103 LYS N N 103 118.370 118.370 119.383 -1.013 18518
13368 1 20 . 1 1 103 103 LYS HA H 103 4.178 4.178 3.989 0.189 18518
13369 1 20 . 1 1 103 103 LYS C C 103 175.018 175.018 176.732 -1.714 18518
13370 1 20 . 1 1 103 103 LYS CA C 103 57.329 57.329 56.877 0.452 18518
13371 1 20 . 1 1 103 103 LYS CB C 103 32.186 32.186 31.659 0.527 18518
13372 1 20 . 1 1 103 103 LYS H H 103 7.831 7.831 7.582 0.249 18518
13373 1 20 . 1 1 104 104 ASP N N 104 123.500 123.500 124.463 -0.963 18518
13374 1 20 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.574 0.181 18518
13375 1 20 . 1 1 104 104 ASP C C 104 177.383 177.383 177.938 -0.555 18518
13376 1 20 . 1 1 104 104 ASP CA C 104 53.846 53.846 54.337 -0.491 18518
13377 1 20 . 1 1 104 104 ASP CB C 104 43.411 43.411 42.113 1.298 18518
13378 1 20 . 1 1 104 104 ASP H H 104 9.041 9.041 8.335 0.706 18518
13379 1 20 . 1 1 105 105 GLU N N 105 125.448 125.448 120.194 5.254 18518
13380 1 20 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.070 0.110 18518
13381 1 20 . 1 1 105 105 GLU C C 105 177.519 177.519 176.424 1.095 18518
13382 1 20 . 1 1 105 105 GLU CA C 105 59.529 59.529 59.026 0.502 18518
13383 1 20 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.508 0.536 18518
13384 1 20 . 1 1 105 105 GLU H H 105 8.906 8.906 8.883 0.023 18518
13385 1 20 . 1 1 106 106 ASP N N 106 118.824 118.824 118.144 0.680 18518
13386 1 20 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.635 -0.456 18518
13387 1 20 . 1 1 106 106 ASP C C 106 176.223 176.223 177.126 -0.903 18518
13388 1 20 . 1 1 106 106 ASP CA C 106 54.756 54.756 54.069 0.687 18518
13389 1 20 . 1 1 106 106 ASP CB C 106 39.999 39.999 40.337 -0.337 18518
13390 1 20 . 1 1 106 106 ASP H H 106 10.036 10.036 8.076 1.960 18518
13391 1 20 . 1 1 107 107 GLY N N 107 105.866 105.866 106.472 -0.606 18518
13392 1 20 . 1 1 107 107 GLY C C 107 175.136 175.136 173.646 1.490 18518
13393 1 20 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.402 -0.180 18518
13394 1 20 . 1 1 107 107 GLY H H 107 8.001 8.001 8.028 -0.027 18518
13395 1 20 . 1 1 108 108 PHE N N 108 123.820 123.820 121.386 2.434 18518
13396 1 20 . 1 1 108 108 PHE HA H 108 4.662 4.662 5.063 -0.401 18518
13397 1 20 . 1 1 108 108 PHE C C 108 174.899 174.899 174.028 0.871 18518
13398 1 20 . 1 1 108 108 PHE CA C 108 60.238 60.238 55.256 4.982 18518
13399 1 20 . 1 1 108 108 PHE CB C 108 40.365 40.365 41.101 -0.736 18518
13400 1 20 . 1 1 108 108 PHE H H 108 9.912 9.912 7.783 2.129 18518
13401 1 20 . 1 1 109 109 LEU N N 109 120.130 120.130 124.388 -4.258 18518
13402 1 20 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.643 0.387 18518
13403 1 20 . 1 1 109 109 LEU C C 109 173.916 173.916 174.857 -0.941 18518
13404 1 20 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.931 -0.507 18518
13405 1 20 . 1 1 109 109 LEU CB C 109 45.203 45.203 43.675 1.528 18518
13406 1 20 . 1 1 109 109 LEU H H 109 7.997 7.997 8.568 -0.571 18518
13407 1 20 . 1 1 110 110 TYR N N 110 126.579 126.579 125.424 1.155 18518
13408 1 20 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.554 0.449 18518
13409 1 20 . 1 1 110 110 TYR C C 110 176.671 176.671 174.759 1.912 18518
13410 1 20 . 1 1 110 110 TYR CA C 110 59.058 59.058 56.776 2.282 18518
13411 1 20 . 1 1 110 110 TYR CB C 110 39.556 39.556 38.537 1.019 18518
13412 1 20 . 1 1 110 110 TYR H H 110 9.377 9.377 8.878 0.499 18518
13413 1 20 . 1 1 111 111 MET N N 111 119.240 119.240 121.041 -1.801 18518
13414 1 20 . 1 1 111 111 MET HA H 111 5.486 5.486 5.152 0.334 18518
13415 1 20 . 1 1 111 111 MET C C 111 175.695 175.695 174.604 1.091 18518
13416 1 20 . 1 1 111 111 MET CA C 111 54.124 54.124 54.857 -0.733 18518
13417 1 20 . 1 1 111 111 MET CB C 111 36.960 36.960 37.586 -0.626 18518
13418 1 20 . 1 1 111 111 MET H H 111 9.658 9.658 8.739 0.919 18518
13419 1 20 . 1 1 112 112 VAL N N 112 119.865 119.865 119.013 0.852 18518
13420 1 20 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.424 0.539 18518
13421 1 20 . 1 1 112 112 VAL C C 112 175.058 175.058 174.670 0.388 18518
13422 1 20 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.985 -1.074 18518
13423 1 20 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.256 0.795 18518
13424 1 20 . 1 1 112 112 VAL H H 112 8.794 8.794 9.134 -0.340 18518
13425 1 20 . 1 1 113 113 TYR N N 113 119.664 119.664 121.233 -1.569 18518
13426 1 20 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.755 0.363 18518
13427 1 20 . 1 1 113 113 TYR C C 113 173.375 173.375 173.385 -0.010 18518
13428 1 20 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.191 -1.038 18518
13429 1 20 . 1 1 113 113 TYR CB C 113 43.312 43.312 42.046 1.266 18518
13430 1 20 . 1 1 113 113 TYR H H 113 8.315 8.315 8.572 -0.257 18518
13431 1 20 . 1 1 114 114 ALA N N 114 119.763 119.763 122.501 -2.738 18518
13432 1 20 . 1 1 114 114 ALA HA H 114 4.800 4.800 5.015 -0.215 18518
13433 1 20 . 1 1 114 114 ALA C C 114 176.216 176.216 175.295 0.921 18518
13434 1 20 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.783 -0.651 18518
13435 1 20 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.264 2.332 18518
13436 1 20 . 1 1 114 114 ALA H H 114 8.465 8.465 9.008 -0.543 18518
13437 1 20 . 1 1 115 115 SER N N 115 114.763 114.763 115.862 -1.099 18518
13438 1 20 . 1 1 115 115 SER HA H 115 4.496 4.496 4.880 -0.384 18518
13439 1 20 . 1 1 115 115 SER C C 115 172.671 172.671 173.628 -0.957 18518
13440 1 20 . 1 1 115 115 SER CA C 115 58.651 58.651 57.387 1.264 18518
13441 1 20 . 1 1 115 115 SER CB C 115 63.526 63.526 61.679 1.847 18518
13442 1 20 . 1 1 115 115 SER H H 115 9.915 9.915 8.843 1.072 18518
13443 1 20 . 1 1 116 116 GLN N N 116 116.611 116.611 123.770 -7.159 18518
13444 1 20 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.322 0.162 18518
13445 1 20 . 1 1 116 116 GLN C C 116 172.733 172.733 173.572 -0.839 18518
13446 1 20 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.534 -1.608 18518
13447 1 20 . 1 1 116 116 GLN CB C 116 32.358 32.358 30.832 1.526 18518
13448 1 20 . 1 1 116 116 GLN H H 116 7.219 7.219 7.917 -0.698 18518
13449 1 20 . 1 1 117 117 GLU N N 117 117.623 117.623 120.683 -3.060 18518
13450 1 20 . 1 1 117 117 GLU HA H 117 3.287 3.287 1.983 1.304 18518
13451 1 20 . 1 1 117 117 GLU C C 117 175.168 175.168 175.309 -0.141 18518
13452 1 20 . 1 1 117 117 GLU CA C 117 56.882 56.882 57.358 -0.477 18518
13453 1 20 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.709 0.813 18518
13454 1 20 . 1 1 117 117 GLU H H 117 7.882 7.882 8.409 -0.527 18518
13455 1 20 . 1 1 118 118 THR N N 118 109.820 109.820 109.324 0.496 18518
13456 1 20 . 1 1 118 118 THR HA H 118 4.066 4.066 4.070 -0.004 18518
13457 1 20 . 1 1 118 118 THR C C 118 172.355 172.355 173.318 -0.963 18518
13458 1 20 . 1 1 118 118 THR CA C 118 60.029 60.029 60.435 -0.406 18518
13459 1 20 . 1 1 118 118 THR CB C 118 70.480 70.480 69.280 1.200 18518
13460 1 20 . 1 1 118 118 THR H H 118 6.992 6.992 7.152 -0.160 18518
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 110 2.745 0.557 2.700 18518
2 1 1 "Average Difference" HA 121 0.280 0.044 0.277 18518
3 1 1 "Average Difference" C 109 1.058 -0.112 1.057 18518
4 1 1 "Average Difference" CA 117 0.996 -0.101 0.996 18518
5 1 1 "Average Difference" CB 113 1.073 -0.317 1.030 18518
6 1 1 "Average Difference" HN 111 0.572 -0.085 0.568 18518
7 1 2 "Average Difference" N 110 2.957 0.223 2.962 18518
8 1 2 "Average Difference" HA 121 0.283 0.039 0.281 18518
9 1 2 "Average Difference" C 109 1.111 -0.108 1.111 18518
10 1 2 "Average Difference" CA 117 1.049 -0.073 1.051 18518
11 1 2 "Average Difference" CB 113 0.991 -0.277 0.956 18518
12 1 2 "Average Difference" HN 111 0.579 -0.105 0.572 18518
13 1 3 "Average Difference" N 110 2.670 0.185 2.676 18518
14 1 3 "Average Difference" HA 121 0.280 0.024 0.280 18518
15 1 3 "Average Difference" C 109 1.077 -0.139 1.073 18518
16 1 3 "Average Difference" CA 117 0.990 -0.037 0.994 18518
17 1 3 "Average Difference" CB 113 0.991 -0.226 0.969 18518
18 1 3 "Average Difference" HN 111 0.543 -0.079 0.539 18518
19 1 4 "Average Difference" N 110 2.606 0.317 2.598 18518
20 1 4 "Average Difference" HA 121 0.262 0.027 0.262 18518
21 1 4 "Average Difference" C 109 1.021 -0.071 1.023 18518
22 1 4 "Average Difference" CA 117 1.038 -0.013 1.043 18518
23 1 4 "Average Difference" CB 113 0.965 -0.276 0.929 18518
24 1 4 "Average Difference" HN 111 0.547 -0.077 0.544 18518
25 1 5 "Average Difference" N 110 2.874 0.129 2.884 18518
26 1 5 "Average Difference" HA 121 0.283 0.046 0.280 18518
27 1 5 "Average Difference" C 109 1.095 -0.071 1.098 18518
28 1 5 "Average Difference" CA 117 1.019 -0.071 1.021 18518
29 1 5 "Average Difference" CB 113 1.035 -0.219 1.016 18518
30 1 5 "Average Difference" HN 111 0.577 -0.106 0.570 18518
31 1 6 "Average Difference" N 110 2.702 0.299 2.697 18518
32 1 6 "Average Difference" HA 121 0.255 0.025 0.255 18518
33 1 6 "Average Difference" C 109 1.065 -0.093 1.066 18518
34 1 6 "Average Difference" CA 117 1.125 -0.019 1.130 18518
35 1 6 "Average Difference" CB 113 1.001 -0.287 0.963 18518
36 1 6 "Average Difference" HN 111 0.568 -0.110 0.560 18518
37 1 7 "Average Difference" N 110 2.723 0.340 2.714 18518
38 1 7 "Average Difference" HA 121 0.294 0.022 0.295 18518
39 1 7 "Average Difference" C 109 1.081 -0.126 1.079 18518
40 1 7 "Average Difference" CA 117 0.980 -0.019 0.984 18518
41 1 7 "Average Difference" CB 113 1.004 -0.295 0.964 18518
42 1 7 "Average Difference" HN 111 0.530 -0.103 0.522 18518
43 1 8 "Average Difference" N 110 2.839 0.190 2.845 18518
44 1 8 "Average Difference" HA 121 0.284 0.038 0.283 18518
45 1 8 "Average Difference" C 109 1.074 -0.116 1.073 18518
46 1 8 "Average Difference" CA 117 1.030 -0.040 1.034 18518
47 1 8 "Average Difference" CB 113 1.013 -0.270 0.981 18518
48 1 8 "Average Difference" HN 111 0.538 -0.069 0.536 18518
49 1 9 "Average Difference" N 110 2.846 0.387 2.833 18518
50 1 9 "Average Difference" HA 121 0.282 0.005 0.284 18518
51 1 9 "Average Difference" C 109 1.097 -0.092 1.099 18518
52 1 9 "Average Difference" CA 117 1.094 0.009 1.099 18518
53 1 9 "Average Difference" CB 113 1.016 -0.284 0.980 18518
54 1 9 "Average Difference" HN 111 0.583 -0.137 0.569 18518
55 1 10 "Average Difference" N 110 2.922 0.383 2.910 18518
56 1 10 "Average Difference" HA 121 0.266 0.013 0.267 18518
57 1 10 "Average Difference" C 109 1.090 -0.100 1.091 18518
58 1 10 "Average Difference" CA 117 0.975 -0.096 0.974 18518
59 1 10 "Average Difference" CB 113 1.046 -0.303 1.005 18518
60 1 10 "Average Difference" HN 111 0.596 -0.092 0.591 18518
61 1 11 "Average Difference" N 110 2.810 0.272 2.810 18518
62 1 11 "Average Difference" HA 121 0.261 0.020 0.261 18518
63 1 11 "Average Difference" C 109 1.095 -0.094 1.096 18518
64 1 11 "Average Difference" CA 117 0.998 -0.002 1.003 18518
65 1 11 "Average Difference" CB 113 0.976 -0.252 0.948 18518
66 1 11 "Average Difference" HN 111 0.575 -0.084 0.571 18518
67 1 12 "Average Difference" N 110 2.700 0.300 2.696 18518
68 1 12 "Average Difference" HA 121 0.275 0.024 0.275 18518
69 1 12 "Average Difference" C 109 1.054 -0.102 1.054 18518
70 1 12 "Average Difference" CA 117 1.017 -0.062 1.020 18518
71 1 12 "Average Difference" CB 113 0.979 -0.271 0.945 18518
72 1 12 "Average Difference" HN 111 0.551 -0.081 0.548 18518
73 1 13 "Average Difference" N 110 2.757 0.410 2.739 18518
74 1 13 "Average Difference" HA 121 0.265 0.023 0.265 18518
75 1 13 "Average Difference" C 109 1.055 -0.090 1.056 18518
76 1 13 "Average Difference" CA 117 1.079 -0.085 1.081 18518
77 1 13 "Average Difference" CB 113 1.067 -0.200 1.052 18518
78 1 13 "Average Difference" HN 111 0.567 -0.086 0.563 18518
79 1 14 "Average Difference" N 110 2.593 0.371 2.578 18518
80 1 14 "Average Difference" HA 121 0.270 0.010 0.271 18518
81 1 14 "Average Difference" C 109 1.054 -0.054 1.057 18518
82 1 14 "Average Difference" CA 117 1.040 0.024 1.044 18518
83 1 14 "Average Difference" CB 113 1.037 -0.301 0.997 18518
84 1 14 "Average Difference" HN 111 0.580 -0.075 0.578 18518
85 1 15 "Average Difference" N 110 2.851 0.563 2.808 18518
86 1 15 "Average Difference" HA 121 0.302 0.026 0.302 18518
87 1 15 "Average Difference" C 109 1.042 -0.083 1.044 18518
88 1 15 "Average Difference" CA 117 1.097 -0.040 1.101 18518
89 1 15 "Average Difference" CB 113 1.082 -0.336 1.033 18518
90 1 15 "Average Difference" HN 111 0.575 -0.096 0.570 18518
91 1 16 "Average Difference" N 110 2.656 0.386 2.640 18518
92 1 16 "Average Difference" HA 121 0.277 0.005 0.279 18518
93 1 16 "Average Difference" C 109 1.048 -0.099 1.048 18518
94 1 16 "Average Difference" CA 117 1.064 -0.014 1.069 18518
95 1 16 "Average Difference" CB 113 1.080 -0.247 1.056 18518
96 1 16 "Average Difference" HN 111 0.528 -0.094 0.522 18518
97 1 17 "Average Difference" N 110 2.682 0.182 2.688 18518
98 1 17 "Average Difference" HA 121 0.274 0.033 0.273 18518
99 1 17 "Average Difference" C 109 1.091 -0.137 1.088 18518
100 1 17 "Average Difference" CA 117 1.115 -0.076 1.117 18518
101 1 17 "Average Difference" CB 113 1.049 -0.257 1.022 18518
102 1 17 "Average Difference" HN 111 0.594 -0.113 0.585 18518
103 1 18 "Average Difference" N 110 2.768 0.487 2.738 18518
104 1 18 "Average Difference" HA 121 0.284 0.043 0.282 18518
105 1 18 "Average Difference" C 109 1.037 -0.057 1.041 18518
106 1 18 "Average Difference" CA 117 1.035 -0.046 1.038 18518
107 1 18 "Average Difference" CB 113 0.949 -0.280 0.911 18518
108 1 18 "Average Difference" HN 111 0.551 -0.047 0.552 18518
109 1 19 "Average Difference" N 110 2.794 0.315 2.789 18518
110 1 19 "Average Difference" HA 121 0.288 0.035 0.287 18518
111 1 19 "Average Difference" C 109 1.060 -0.065 1.063 18518
112 1 19 "Average Difference" CA 117 1.011 -0.082 1.012 18518
113 1 19 "Average Difference" CB 113 0.927 -0.228 0.903 18518
114 1 19 "Average Difference" HN 111 0.539 -0.077 0.536 18518
115 1 20 "Average Difference" N 110 2.639 0.433 2.615 18518
116 1 20 "Average Difference" HA 121 0.286 -0.006 0.287 18518
117 1 20 "Average Difference" C 109 1.047 -0.100 1.047 18518
118 1 20 "Average Difference" CA 117 1.119 -0.081 1.121 18518
119 1 20 "Average Difference" CB 113 1.004 -0.310 0.959 18518
120 1 20 "Average Difference" HN 111 0.553 -0.082 0.550 18518
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 18518
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 ALA HA H 2 4.336 4.336 5.019 -0.683 18518
2 1 . 1 1 2 2 ALA C C 2 177.974 177.974 176.558 1.416 18518
3 1 . 1 1 2 2 ALA CA C 2 52.785 52.785 51.804 0.981 18518
4 1 . 1 1 2 2 ALA CB C 2 19.444 19.444 20.275 -0.831 18518
5 1 . 1 1 3 3 MET N N 3 119.311 119.311 121.049 -1.738 18518
6 1 . 1 1 3 3 MET HA H 3 4.451 4.451 4.713 -0.262 18518
7 1 . 1 1 3 3 MET C C 3 176.913 176.913 175.651 1.262 18518
8 1 . 1 1 3 3 MET CA C 3 55.679 55.679 55.032 0.647 18518
9 1 . 1 1 3 3 MET CB C 3 32.590 32.590 34.965 -2.374 18518
10 1 . 1 1 3 3 MET H H 3 8.638 8.638 8.572 0.066 18518
11 1 . 1 1 4 4 GLY N N 4 110.281 110.281 110.514 -0.233 18518
12 1 . 1 1 4 4 GLY C C 4 174.180 174.180 173.892 0.288 18518
13 1 . 1 1 4 4 GLY CA C 4 45.495 45.495 44.856 0.639 18518
14 1 . 1 1 4 4 GLY H H 4 8.552 8.552 8.517 0.035 18518
15 1 . 1 1 5 5 LYS N N 5 120.818 120.818 125.059 -4.241 18518
16 1 . 1 1 5 5 LYS HA H 5 4.509 4.509 4.445 0.064 18518
17 1 . 1 1 5 5 LYS C C 5 177.605 177.605 176.601 1.004 18518
18 1 . 1 1 5 5 LYS CA C 5 56.134 56.134 55.577 0.557 18518
19 1 . 1 1 5 5 LYS CB C 5 34.813 34.813 32.932 1.881 18518
20 1 . 1 1 5 5 LYS H H 5 8.133 8.133 8.185 -0.052 18518
21 1 . 1 1 6 6 THR N N 6 114.781 114.781 116.773 -1.992 18518
22 1 . 1 1 6 6 THR HA H 6 4.421 4.421 4.390 0.031 18518
23 1 . 1 1 6 6 THR C C 6 175.524 175.524 175.852 -0.328 18518
24 1 . 1 1 6 6 THR CA C 6 61.127 61.127 61.328 -0.201 18518
25 1 . 1 1 6 6 THR CB C 6 69.926 69.926 70.100 -0.174 18518
26 1 . 1 1 6 6 THR H H 6 8.483 8.483 8.200 0.283 18518
27 1 . 1 1 7 7 PHE N N 7 125.552 125.552 121.333 4.219 18518
28 1 . 1 1 7 7 PHE HA H 7 4.005 4.005 4.142 -0.137 18518
29 1 . 1 1 7 7 PHE C C 7 177.397 177.397 176.912 0.485 18518
30 1 . 1 1 7 7 PHE CA C 7 63.393 63.393 61.170 2.223 18518
31 1 . 1 1 7 7 PHE CB C 7 39.567 39.567 38.174 1.393 18518
32 1 . 1 1 7 7 PHE H H 7 10.245 10.245 9.039 1.206 18518
33 1 . 1 1 8 8 LYS N N 8 114.053 114.053 117.690 -3.637 18518
34 1 . 1 1 8 8 LYS HA H 8 3.835 3.835 3.798 0.037 18518
35 1 . 1 1 8 8 LYS C C 8 175.520 175.520 178.445 -2.925 18518
36 1 . 1 1 8 8 LYS CA C 8 59.993 59.993 58.355 1.638 18518
37 1 . 1 1 8 8 LYS CB C 8 33.689 33.689 31.392 2.298 18518
38 1 . 1 1 8 8 LYS H H 8 8.775 8.775 6.997 1.778 18518
39 1 . 1 1 9 9 GLN N N 9 113.516 113.516 117.897 -4.381 18518
40 1 . 1 1 9 9 GLN HA H 9 4.149 4.149 4.111 0.038 18518
41 1 . 1 1 9 9 GLN C C 9 177.615 177.615 177.787 -0.172 18518
42 1 . 1 1 9 9 GLN CA C 9 56.819 56.819 58.073 -1.254 18518
43 1 . 1 1 9 9 GLN CB C 9 30.019 30.019 28.955 1.064 18518
44 1 . 1 1 9 9 GLN H H 9 7.355 7.355 7.586 -0.231 18518
45 1 . 1 1 10 10 ARG N N 10 118.294 118.294 116.747 1.547 18518
46 1 . 1 1 10 10 ARG HA H 10 4.302 4.302 4.225 0.077 18518
47 1 . 1 1 10 10 ARG C C 10 179.380 179.380 177.063 2.317 18518
48 1 . 1 1 10 10 ARG CA C 10 57.268 57.268 57.204 0.064 18518
49 1 . 1 1 10 10 ARG CB C 10 31.642 31.642 30.753 0.889 18518
50 1 . 1 1 10 10 ARG H H 10 7.936 7.936 7.794 0.142 18518
51 1 . 1 1 11 11 ARG N N 11 121.137 121.137 119.778 1.359 18518
52 1 . 1 1 11 11 ARG HA H 11 4.680 4.680 4.719 -0.039 18518
53 1 . 1 1 11 11 ARG CA C 11 53.453 53.453 54.375 -0.922 18518
54 1 . 1 1 11 11 ARG CB C 11 32.938 32.938 32.064 0.874 18518
55 1 . 1 1 11 11 ARG H H 11 7.390 7.390 7.647 -0.257 18518
56 1 . 1 1 12 12 THR N N 12 116.819 116.819 119.597 -2.778 18518
57 1 . 1 1 12 12 THR HA H 12 4.359 4.359 4.309 0.050 18518
58 1 . 1 1 12 12 THR C C 12 174.989 174.989 176.058 -1.069 18518
59 1 . 1 1 12 12 THR CA C 12 61.748 61.748 62.824 -1.076 18518
60 1 . 1 1 12 12 THR CB C 12 71.068 71.068 70.063 1.005 18518
61 1 . 1 1 12 12 THR H H 12 8.953 8.953 8.543 0.411 18518
62 1 . 1 1 13 13 PHE N N 13 123.200 123.200 123.309 -0.109 18518
63 1 . 1 1 13 13 PHE HA H 13 4.028 4.028 4.197 -0.169 18518
64 1 . 1 1 13 13 PHE C C 13 176.029 176.029 177.063 -1.034 18518
65 1 . 1 1 13 13 PHE CA C 13 62.864 62.864 62.585 0.279 18518
66 1 . 1 1 13 13 PHE CB C 13 39.560 39.560 39.301 0.259 18518
67 1 . 1 1 13 13 PHE H H 13 9.284 9.284 8.984 0.300 18518
68 1 . 1 1 14 14 GLU N N 14 115.414 115.414 117.977 -2.563 18518
69 1 . 1 1 14 14 GLU HA H 14 3.794 3.794 3.969 -0.175 18518
70 1 . 1 1 14 14 GLU C C 14 180.081 180.081 179.040 1.041 18518
71 1 . 1 1 14 14 GLU CA C 14 60.619 60.619 59.978 0.641 18518
72 1 . 1 1 14 14 GLU CB C 14 28.852 28.852 28.882 -0.030 18518
73 1 . 1 1 14 14 GLU H H 14 8.973 8.973 8.815 0.158 18518
74 1 . 1 1 15 15 GLN N N 15 119.276 119.276 118.373 0.903 18518
75 1 . 1 1 15 15 GLN HA H 15 4.000 4.000 4.136 -0.136 18518
76 1 . 1 1 15 15 GLN C C 15 177.978 177.978 178.697 -0.719 18518
77 1 . 1 1 15 15 GLN CA C 15 58.835 58.835 58.701 0.134 18518
78 1 . 1 1 15 15 GLN CB C 15 29.370 29.370 28.264 1.107 18518
79 1 . 1 1 15 15 GLN H H 15 7.756 7.756 8.252 -0.496 18518
80 1 . 1 1 16 16 ARG N N 16 121.336 121.336 120.475 0.862 18518
81 1 . 1 1 16 16 ARG HA H 16 4.270 4.270 4.189 0.081 18518
82 1 . 1 1 16 16 ARG C C 16 177.416 177.416 178.713 -1.297 18518
83 1 . 1 1 16 16 ARG CA C 16 61.375 61.375 59.705 1.670 18518
84 1 . 1 1 16 16 ARG CB C 16 30.605 30.605 30.289 0.316 18518
85 1 . 1 1 16 16 ARG H H 16 8.645 8.645 8.057 0.588 18518
86 1 . 1 1 17 17 VAL N N 17 117.630 117.630 119.582 -1.952 18518
87 1 . 1 1 17 17 VAL HA H 17 3.857 3.857 3.673 0.184 18518
88 1 . 1 1 17 17 VAL C C 17 179.748 179.748 177.588 2.160 18518
89 1 . 1 1 17 17 VAL CA C 17 65.726 65.726 65.985 -0.259 18518
90 1 . 1 1 17 17 VAL CB C 17 32.194 32.194 31.601 0.593 18518
91 1 . 1 1 17 17 VAL H H 17 8.373 8.373 8.185 0.188 18518
92 1 . 1 1 18 18 GLU N N 18 120.864 120.864 119.822 1.042 18518
93 1 . 1 1 18 18 GLU HA H 18 4.302 4.302 3.932 0.370 18518
94 1 . 1 1 18 18 GLU C C 18 177.728 177.728 178.494 -0.766 18518
95 1 . 1 1 18 18 GLU CA C 18 58.486 58.486 59.889 -1.403 18518
96 1 . 1 1 18 18 GLU CB C 18 29.382 29.382 29.372 0.010 18518
97 1 . 1 1 18 18 GLU H H 18 7.368 7.368 8.160 -0.792 18518
98 1 . 1 1 19 19 ASP N N 19 121.425 121.425 120.176 1.249 18518
99 1 . 1 1 19 19 ASP HA H 19 4.434 4.434 4.430 0.004 18518
100 1 . 1 1 19 19 ASP C C 19 179.978 179.978 178.630 1.348 18518
101 1 . 1 1 19 19 ASP CA C 19 57.422 57.422 57.328 0.094 18518
102 1 . 1 1 19 19 ASP CB C 19 41.287 41.287 40.811 0.476 18518
103 1 . 1 1 19 19 ASP H H 19 8.671 8.671 8.049 0.622 18518
104 1 . 1 1 20 20 VAL N N 20 119.730 119.730 120.024 -0.294 18518
105 1 . 1 1 20 20 VAL HA H 20 3.205 3.205 3.383 -0.178 18518
106 1 . 1 1 20 20 VAL C C 20 176.284 176.284 177.635 -1.351 18518
107 1 . 1 1 20 20 VAL CA C 20 66.315 66.315 66.348 -0.033 18518
108 1 . 1 1 20 20 VAL CB C 20 31.107 31.107 31.297 -0.190 18518
109 1 . 1 1 20 20 VAL H H 20 7.999 7.999 8.029 -0.030 18518
110 1 . 1 1 21 21 ARG N N 21 121.455 121.455 119.660 1.795 18518
111 1 . 1 1 21 21 ARG HA H 21 3.814 3.814 3.959 -0.145 18518
112 1 . 1 1 21 21 ARG C C 21 180.120 180.120 178.656 1.464 18518
113 1 . 1 1 21 21 ARG CA C 21 59.830 59.830 58.864 0.966 18518
114 1 . 1 1 21 21 ARG CB C 21 29.946 29.946 29.145 0.800 18518
115 1 . 1 1 21 21 ARG H H 21 8.098 8.098 8.016 0.082 18518
116 1 . 1 1 22 22 LEU N N 22 117.826 117.826 121.182 -3.356 18518
117 1 . 1 1 22 22 LEU HA H 22 4.049 4.049 4.032 0.017 18518
118 1 . 1 1 22 22 LEU C C 22 180.115 180.115 178.655 1.460 18518
119 1 . 1 1 22 22 LEU CA C 22 57.790 57.790 57.963 -0.173 18518
120 1 . 1 1 22 22 LEU CB C 22 42.142 42.142 41.694 0.448 18518
121 1 . 1 1 22 22 LEU H H 22 8.207 8.207 8.114 0.093 18518
122 1 . 1 1 23 23 ILE N N 23 121.450 121.450 119.354 2.096 18518
123 1 . 1 1 23 23 ILE HA H 23 4.013 4.013 3.732 0.281 18518
124 1 . 1 1 23 23 ILE C C 23 178.149 178.149 178.186 -0.037 18518
125 1 . 1 1 23 23 ILE CA C 23 62.171 62.171 64.273 -2.102 18518
126 1 . 1 1 23 23 ILE CB C 23 38.106 38.106 37.308 0.798 18518
127 1 . 1 1 23 23 ILE H H 23 8.105 8.105 8.149 -0.044 18518
128 1 . 1 1 24 24 ARG N N 24 121.139 121.139 118.943 2.196 18518
129 1 . 1 1 24 24 ARG HA H 24 3.987 3.987 4.103 -0.116 18518
130 1 . 1 1 24 24 ARG C C 24 178.702 178.702 178.849 -0.147 18518
131 1 . 1 1 24 24 ARG CA C 24 57.718 57.718 58.909 -1.191 18518
132 1 . 1 1 24 24 ARG CB C 24 28.769 28.769 29.715 -0.946 18518
133 1 . 1 1 24 24 ARG H H 24 8.601 8.601 8.353 0.248 18518
134 1 . 1 1 25 25 GLU N N 25 118.054 118.054 119.144 -1.090 18518
135 1 . 1 1 25 25 GLU HA H 25 4.026 4.026 4.134 -0.108 18518
136 1 . 1 1 25 25 GLU C C 25 178.492 178.492 178.390 0.102 18518
137 1 . 1 1 25 25 GLU CA C 25 58.780 58.780 58.505 0.275 18518
138 1 . 1 1 25 25 GLU CB C 25 30.001 30.001 29.616 0.385 18518
139 1 . 1 1 25 25 GLU H H 25 7.423 7.423 7.810 -0.387 18518
140 1 . 1 1 26 26 GLN N N 26 116.350 116.350 116.855 -0.505 18518
141 1 . 1 1 26 26 GLN HA H 26 3.936 3.936 4.046 -0.110 18518
142 1 . 1 1 26 26 GLN C C 26 176.305 176.305 176.916 -0.611 18518
143 1 . 1 1 26 26 GLN CA C 26 57.503 57.503 57.429 0.074 18518
144 1 . 1 1 26 26 GLN CB C 26 30.207 30.207 29.507 0.700 18518
145 1 . 1 1 26 26 GLN H H 26 7.524 7.524 7.829 -0.305 18518
146 1 . 1 1 27 27 HIS N N 27 116.017 116.017 118.450 -2.433 18518
147 1 . 1 1 27 27 HIS HA H 27 4.930 4.930 5.100 -0.170 18518
148 1 . 1 1 27 27 HIS CA C 27 53.054 53.054 52.891 0.163 18518
149 1 . 1 1 27 27 HIS CB C 27 30.747 30.747 30.219 0.528 18518
150 1 . 1 1 27 27 HIS H H 27 8.284 8.284 8.175 0.109 18518
151 1 . 1 1 28 28 PRO HA H 28 4.581 4.581 4.580 0.001 18518
152 1 . 1 1 28 28 PRO CA C 28 64.919 64.919 64.453 0.466 18518
153 1 . 1 1 28 28 PRO CB C 28 32.455 32.455 32.197 0.258 18518
154 1 . 1 1 29 29 THR N N 29 107.011 107.011 107.057 -0.046 18518
155 1 . 1 1 29 29 THR HA H 29 4.599 4.599 4.429 0.170 18518
156 1 . 1 1 29 29 THR C C 29 172.884 172.884 173.941 -1.057 18518
157 1 . 1 1 29 29 THR CA C 29 60.810 60.810 61.533 -0.723 18518
158 1 . 1 1 29 29 THR CB C 29 68.531 68.531 68.628 -0.098 18518
159 1 . 1 1 29 29 THR H H 29 7.890 7.890 8.282 -0.392 18518
160 1 . 1 1 30 30 LYS N N 30 117.679 117.679 121.342 -3.663 18518
161 1 . 1 1 30 30 LYS HA H 30 4.858 4.858 4.957 -0.099 18518
162 1 . 1 1 30 30 LYS C C 30 174.310 174.310 174.764 -0.454 18518
163 1 . 1 1 30 30 LYS CA C 30 53.751 53.751 53.962 -0.211 18518
164 1 . 1 1 30 30 LYS CB C 30 35.804 35.804 35.756 0.048 18518
165 1 . 1 1 30 30 LYS H H 30 7.441 7.441 7.612 -0.171 18518
166 1 . 1 1 31 31 ILE N N 31 122.849 122.849 122.870 -0.021 18518
167 1 . 1 1 31 31 ILE HA H 31 4.105 4.105 4.322 -0.217 18518
168 1 . 1 1 31 31 ILE CA C 31 54.801 54.801 56.842 -2.041 18518
169 1 . 1 1 31 31 ILE CB C 31 38.265 38.265 38.691 -0.426 18518
170 1 . 1 1 31 31 ILE H H 31 9.304 9.304 8.900 0.403 18518
171 1 . 1 1 32 32 PRO HA H 32 5.159 5.159 4.912 0.247 18518
172 1 . 1 1 32 32 PRO C C 32 174.164 174.164 175.916 -1.752 18518
173 1 . 1 1 32 32 PRO CA C 32 61.503 61.503 62.102 -0.599 18518
174 1 . 1 1 32 32 PRO CB C 32 31.145 31.145 30.876 0.269 18518
175 1 . 1 1 33 33 VAL N N 33 125.606 125.606 124.032 1.574 18518
176 1 . 1 1 33 33 VAL HA H 33 5.213 5.213 5.074 0.139 18518
177 1 . 1 1 33 33 VAL C C 33 173.654 173.654 173.893 -0.239 18518
178 1 . 1 1 33 33 VAL CA C 33 60.044 60.044 59.241 0.803 18518
179 1 . 1 1 33 33 VAL CB C 33 35.604 35.604 35.986 -0.382 18518
180 1 . 1 1 33 33 VAL H H 33 9.424 9.424 8.645 0.779 18518
181 1 . 1 1 34 34 ILE N N 34 128.241 128.241 126.337 1.904 18518
182 1 . 1 1 34 34 ILE HA H 34 4.833 4.833 4.744 0.089 18518
183 1 . 1 1 34 34 ILE C C 34 175.605 175.605 174.878 0.727 18518
184 1 . 1 1 34 34 ILE CA C 34 56.765 56.765 58.435 -1.670 18518
185 1 . 1 1 34 34 ILE CB C 34 36.799 36.799 38.475 -1.676 18518
186 1 . 1 1 34 34 ILE H H 34 8.721 8.721 8.942 -0.221 18518
187 1 . 1 1 35 35 ILE N N 35 125.650 125.650 128.067 -2.417 18518
188 1 . 1 1 35 35 ILE HA H 35 4.836 4.836 4.724 0.112 18518
189 1 . 1 1 35 35 ILE C C 35 174.887 174.887 174.496 0.391 18518
190 1 . 1 1 35 35 ILE CA C 35 60.945 60.945 59.975 0.970 18518
191 1 . 1 1 35 35 ILE CB C 35 39.210 39.210 39.181 0.029 18518
192 1 . 1 1 35 35 ILE H H 35 9.034 9.034 8.965 0.069 18518
193 1 . 1 1 36 36 GLU N N 36 122.657 122.657 126.750 -4.093 18518
194 1 . 1 1 36 36 GLU HA H 36 4.861 4.861 4.840 0.022 18518
195 1 . 1 1 36 36 GLU C C 36 173.848 173.848 174.597 -0.749 18518
196 1 . 1 1 36 36 GLU CA C 36 53.932 53.932 54.117 -0.185 18518
197 1 . 1 1 36 36 GLU CB C 36 35.282 35.282 34.281 1.001 18518
198 1 . 1 1 36 36 GLU H H 36 8.303 8.303 8.530 -0.227 18518
199 1 . 1 1 37 37 ARG N N 37 123.228 123.228 125.445 -2.218 18518
200 1 . 1 1 37 37 ARG HA H 37 2.726 2.726 3.481 -0.755 18518
201 1 . 1 1 37 37 ARG C C 37 176.359 176.359 175.790 0.569 18518
202 1 . 1 1 37 37 ARG CA C 37 56.359 56.359 56.183 0.176 18518
203 1 . 1 1 37 37 ARG CB C 37 31.341 31.341 30.785 0.556 18518
204 1 . 1 1 37 37 ARG H H 37 8.856 8.856 8.626 0.230 18518
205 1 . 1 1 38 38 TYR N N 38 128.981 128.981 127.799 1.182 18518
206 1 . 1 1 38 38 TYR HA H 38 4.352 4.352 4.271 0.081 18518
207 1 . 1 1 38 38 TYR C C 38 177.316 177.316 176.591 0.725 18518
208 1 . 1 1 38 38 TYR CA C 38 57.712 57.712 58.184 -0.472 18518
209 1 . 1 1 38 38 TYR CB C 38 39.472 39.472 40.065 -0.593 18518
210 1 . 1 1 38 38 TYR H H 38 8.628 8.628 8.323 0.305 18518
211 1 . 1 1 39 39 LYS N N 39 130.635 130.635 125.899 4.736 18518
212 1 . 1 1 39 39 LYS HA H 39 3.822 3.822 3.815 0.007 18518
213 1 . 1 1 39 39 LYS CA C 39 58.887 58.887 58.111 0.776 18518
214 1 . 1 1 39 39 LYS CB C 39 31.771 31.771 31.890 -0.119 18518
215 1 . 1 1 39 39 LYS H H 39 8.594 8.594 8.085 0.509 18518
216 1 . 1 1 40 40 GLY C C 40 173.447 173.447 173.923 -0.476 18518
217 1 . 1 1 40 40 GLY CA C 40 44.663 44.663 44.048 0.615 18518
218 1 . 1 1 40 40 GLY H H 40 5.188 5.188 6.464 -1.276 18518
219 1 . 1 1 41 41 GLU N N 41 122.836 122.836 120.997 1.839 18518
220 1 . 1 1 41 41 GLU HA H 41 4.257 4.257 4.321 -0.064 18518
221 1 . 1 1 41 41 GLU C C 41 176.524 176.524 175.969 0.555 18518
222 1 . 1 1 41 41 GLU CA C 41 56.525 56.525 56.368 0.157 18518
223 1 . 1 1 41 41 GLU CB C 41 30.985 30.985 29.641 1.345 18518
224 1 . 1 1 41 41 GLU H H 41 7.380 7.380 7.493 -0.113 18518
225 1 . 1 1 42 42 LYS N N 42 124.040 124.040 125.082 -1.042 18518
226 1 . 1 1 42 42 LYS HA H 42 4.675 4.675 4.467 0.208 18518
227 1 . 1 1 42 42 LYS C C 42 177.538 177.538 177.183 0.355 18518
228 1 . 1 1 42 42 LYS CA C 42 55.840 55.840 56.759 -0.919 18518
229 1 . 1 1 42 42 LYS CB C 42 34.979 34.979 33.373 1.606 18518
230 1 . 1 1 42 42 LYS H H 42 9.034 9.034 8.545 0.489 18518
231 1 . 1 1 43 43 GLN N N 43 119.259 119.259 118.557 0.702 18518
232 1 . 1 1 43 43 GLN HA H 43 4.542 4.542 4.366 0.176 18518
233 1 . 1 1 43 43 GLN C C 43 177.336 177.336 176.251 1.085 18518
234 1 . 1 1 43 43 GLN CA C 43 57.673 57.673 56.919 0.754 18518
235 1 . 1 1 43 43 GLN CB C 43 30.782 30.782 29.860 0.921 18518
236 1 . 1 1 43 43 GLN H H 43 8.435 8.435 8.714 -0.279 18518
237 1 . 1 1 44 44 LEU N N 44 120.760 120.760 123.328 -2.568 18518
238 1 . 1 1 44 44 LEU HA H 44 4.695 4.695 4.711 -0.016 18518
239 1 . 1 1 44 44 LEU CA C 44 53.245 53.245 52.614 0.630 18518
240 1 . 1 1 44 44 LEU CB C 44 43.596 43.596 41.953 1.643 18518
241 1 . 1 1 44 44 LEU H H 44 9.126 9.126 8.223 0.903 18518
242 1 . 1 1 45 45 PRO HA H 45 4.717 4.717 4.576 0.141 18518
243 1 . 1 1 45 45 PRO C C 45 175.797 175.797 176.345 -0.548 18518
244 1 . 1 1 45 45 PRO CA C 45 62.111 62.111 62.246 -0.135 18518
245 1 . 1 1 45 45 PRO CB C 45 32.592 32.592 32.411 0.181 18518
246 1 . 1 1 46 46 VAL N N 46 119.052 119.052 120.729 -1.677 18518
247 1 . 1 1 46 46 VAL HA H 46 3.867 3.867 4.371 -0.504 18518
248 1 . 1 1 46 46 VAL C C 46 175.640 175.640 176.481 -0.841 18518
249 1 . 1 1 46 46 VAL CA C 46 62.944 62.944 61.934 1.010 18518
250 1 . 1 1 46 46 VAL CB C 46 32.799 32.799 32.917 -0.118 18518
251 1 . 1 1 46 46 VAL H H 46 8.543 8.543 8.252 0.291 18518
252 1 . 1 1 47 47 LEU N N 47 130.203 130.203 126.509 3.694 18518
253 1 . 1 1 47 47 LEU HA H 47 4.309 4.309 4.445 -0.136 18518
254 1 . 1 1 47 47 LEU C C 47 176.198 176.198 177.375 -1.176 18518
255 1 . 1 1 47 47 LEU CA C 47 55.006 55.006 55.119 -0.113 18518
256 1 . 1 1 47 47 LEU CB C 47 43.832 43.832 42.692 1.140 18518
257 1 . 1 1 47 47 LEU H H 47 7.799 7.799 8.498 -0.699 18518
258 1 . 1 1 48 48 ASP N N 48 122.403 122.403 121.675 0.728 18518
259 1 . 1 1 48 48 ASP HA H 48 4.263 4.263 4.539 -0.276 18518
260 1 . 1 1 48 48 ASP C C 48 175.294 175.294 175.804 -0.510 18518
261 1 . 1 1 48 48 ASP CA C 48 55.832 55.832 55.782 0.050 18518
262 1 . 1 1 48 48 ASP CB C 48 40.184 40.184 41.336 -1.152 18518
263 1 . 1 1 48 48 ASP H H 48 8.780 8.780 8.592 0.188 18518
264 1 . 1 1 49 49 LYS N N 49 119.569 119.569 116.588 2.981 18518
265 1 . 1 1 49 49 LYS HA H 49 4.585 4.585 4.525 0.060 18518
266 1 . 1 1 49 49 LYS C C 49 174.678 174.678 175.433 -0.755 18518
267 1 . 1 1 49 49 LYS CA C 49 53.652 53.652 55.277 -1.625 18518
268 1 . 1 1 49 49 LYS CB C 49 35.945 35.945 34.566 1.379 18518
269 1 . 1 1 49 49 LYS H H 49 7.280 7.280 7.607 -0.327 18518
270 1 . 1 1 50 50 THR N N 50 110.862 110.862 112.624 -1.762 18518
271 1 . 1 1 50 50 THR HA H 50 4.811 4.811 4.792 0.019 18518
272 1 . 1 1 50 50 THR C C 50 172.425 172.425 174.198 -1.773 18518
273 1 . 1 1 50 50 THR CA C 50 62.645 62.645 62.611 0.034 18518
274 1 . 1 1 50 50 THR CB C 50 71.648 71.648 70.315 1.333 18518
275 1 . 1 1 50 50 THR H H 50 8.042 8.042 8.248 -0.206 18518
276 1 . 1 1 51 51 LYS N N 51 120.008 120.008 122.606 -2.598 18518
277 1 . 1 1 51 51 LYS HA H 51 4.625 4.625 4.628 -0.003 18518
278 1 . 1 1 51 51 LYS C C 51 175.082 175.082 175.842 -0.760 18518
279 1 . 1 1 51 51 LYS CA C 51 54.704 54.704 56.417 -1.713 18518
280 1 . 1 1 51 51 LYS CB C 51 32.376 32.376 33.089 -0.713 18518
281 1 . 1 1 51 51 LYS H H 51 7.119 7.119 7.631 -0.512 18518
282 1 . 1 1 52 52 PHE N N 52 122.640 122.640 123.463 -0.823 18518
283 1 . 1 1 52 52 PHE HA H 52 5.337 5.337 4.749 0.588 18518
284 1 . 1 1 52 52 PHE C C 52 174.213 174.213 174.168 0.045 18518
285 1 . 1 1 52 52 PHE CA C 52 56.611 56.611 56.776 -0.165 18518
286 1 . 1 1 52 52 PHE CB C 52 43.140 43.140 43.247 -0.107 18518
287 1 . 1 1 52 52 PHE H H 52 9.709 9.709 9.216 0.493 18518
288 1 . 1 1 53 53 LEU N N 53 122.157 122.157 123.102 -0.945 18518
289 1 . 1 1 53 53 LEU HA H 53 4.947 4.947 4.975 -0.028 18518
290 1 . 1 1 53 53 LEU C C 53 175.769 175.769 175.631 0.138 18518
291 1 . 1 1 53 53 LEU CA C 53 52.957 52.957 53.842 -0.885 18518
292 1 . 1 1 53 53 LEU CB C 53 44.415 44.415 43.815 0.600 18518
293 1 . 1 1 53 53 LEU H H 53 8.959 8.959 8.457 0.502 18518
294 1 . 1 1 54 54 VAL N N 54 124.919 124.919 123.886 1.033 18518
295 1 . 1 1 54 54 VAL HA H 54 4.559 4.559 4.625 -0.066 18518
296 1 . 1 1 54 54 VAL CA C 54 59.130 59.130 58.274 0.856 18518
297 1 . 1 1 54 54 VAL CB C 54 34.968 34.968 33.824 1.144 18518
298 1 . 1 1 54 54 VAL H H 54 8.922 8.922 8.538 0.384 18518
299 1 . 1 1 55 55 PRO HA H 55 4.441 4.441 4.848 -0.407 18518
300 1 . 1 1 55 55 PRO C C 55 176.594 176.594 178.014 -1.420 18518
301 1 . 1 1 55 55 PRO CA C 55 64.315 64.315 62.140 2.175 18518
302 1 . 1 1 55 55 PRO CB C 55 32.665 32.665 32.186 0.479 18518
303 1 . 1 1 56 56 ASP N N 56 120.522 120.522 122.780 -2.258 18518
304 1 . 1 1 56 56 ASP HA H 56 3.862 3.862 4.218 -0.356 18518
305 1 . 1 1 56 56 ASP C C 56 175.809 175.809 176.662 -0.853 18518
306 1 . 1 1 56 56 ASP CA C 56 56.749 56.749 56.942 -0.193 18518
307 1 . 1 1 56 56 ASP CB C 56 40.510 40.510 40.482 0.028 18518
308 1 . 1 1 56 56 ASP H H 56 8.347 8.347 8.414 -0.067 18518
309 1 . 1 1 57 57 HIS N N 57 113.482 113.482 114.782 -1.300 18518
310 1 . 1 1 57 57 HIS HA H 57 4.720 4.720 4.610 0.110 18518
311 1 . 1 1 57 57 HIS C C 57 176.507 176.507 175.242 1.265 18518
312 1 . 1 1 57 57 HIS CA C 57 55.589 55.589 55.997 -0.408 18518
313 1 . 1 1 57 57 HIS CB C 57 30.643 30.643 29.689 0.954 18518
314 1 . 1 1 57 57 HIS H H 57 7.557 7.557 8.024 -0.467 18518
315 1 . 1 1 58 58 VAL N N 58 123.279 123.279 120.787 2.492 18518
316 1 . 1 1 58 58 VAL HA H 58 3.836 3.836 4.192 -0.356 18518
317 1 . 1 1 58 58 VAL C C 58 175.019 175.019 174.762 0.257 18518
318 1 . 1 1 58 58 VAL CA C 58 62.823 62.823 60.985 1.838 18518
319 1 . 1 1 58 58 VAL CB C 58 32.310 32.310 33.667 -1.357 18518
320 1 . 1 1 58 58 VAL H H 58 7.345 7.345 7.411 -0.066 18518
321 1 . 1 1 59 59 ASN N N 59 123.781 123.781 121.492 2.289 18518
322 1 . 1 1 59 59 ASN HA H 59 5.126 5.126 5.080 0.046 18518
323 1 . 1 1 59 59 ASN C C 59 176.558 176.558 176.436 0.122 18518
324 1 . 1 1 59 59 ASN CA C 59 51.485 51.485 51.806 -0.321 18518
325 1 . 1 1 59 59 ASN CB C 59 40.107 40.107 40.488 -0.381 18518
326 1 . 1 1 59 59 ASN H H 59 8.735 8.735 8.389 0.346 18518
327 1 . 1 1 60 60 MET N N 60 117.453 117.453 118.609 -1.156 18518
328 1 . 1 1 60 60 MET HA H 60 4.395 4.395 4.107 0.288 18518
329 1 . 1 1 60 60 MET C C 60 178.144 178.144 178.199 -0.055 18518
330 1 . 1 1 60 60 MET CA C 60 57.097 57.097 58.278 -1.181 18518
331 1 . 1 1 60 60 MET CB C 60 30.140 30.140 31.332 -1.192 18518
332 1 . 1 1 60 60 MET H H 60 8.227 8.227 8.531 -0.304 18518
333 1 . 1 1 61 61 SER N N 61 114.216 114.216 115.467 -1.251 18518
334 1 . 1 1 61 61 SER HA H 61 4.111 4.111 4.076 0.035 18518
335 1 . 1 1 61 61 SER C C 61 177.335 177.335 176.809 0.526 18518
336 1 . 1 1 61 61 SER CA C 61 61.590 61.590 62.352 -0.762 18518
337 1 . 1 1 61 61 SER CB C 61 62.402 62.402 62.754 -0.352 18518
338 1 . 1 1 61 61 SER H H 61 8.464 8.464 8.417 0.047 18518
339 1 . 1 1 62 62 GLU N N 62 123.004 123.004 121.185 1.819 18518
340 1 . 1 1 62 62 GLU HA H 62 4.047 4.047 4.104 -0.057 18518
341 1 . 1 1 62 62 GLU C C 62 178.686 178.686 178.777 -0.091 18518
342 1 . 1 1 62 62 GLU CA C 62 58.625 58.625 58.829 -0.204 18518
343 1 . 1 1 62 62 GLU CB C 62 29.654 29.654 29.281 0.372 18518
344 1 . 1 1 62 62 GLU H H 62 7.994 7.994 7.680 0.314 18518
345 1 . 1 1 63 63 LEU N N 63 120.818 120.818 122.037 -1.219 18518
346 1 . 1 1 63 63 LEU HA H 63 3.965 3.965 3.988 -0.023 18518
347 1 . 1 1 63 63 LEU C C 63 178.046 178.046 178.797 -0.751 18518
348 1 . 1 1 63 63 LEU CA C 63 57.920 57.920 58.011 -0.091 18518
349 1 . 1 1 63 63 LEU CB C 63 41.624 41.624 41.486 0.138 18518
350 1 . 1 1 63 63 LEU H H 63 8.130 8.130 7.832 0.298 18518
351 1 . 1 1 64 64 ILE N N 64 118.528 118.528 119.355 -0.827 18518
352 1 . 1 1 64 64 ILE HA H 64 3.369 3.369 3.585 -0.216 18518
353 1 . 1 1 64 64 ILE C C 64 177.127 177.127 177.749 -0.622 18518
354 1 . 1 1 64 64 ILE CA C 64 66.678 66.678 65.622 1.056 18518
355 1 . 1 1 64 64 ILE CB C 64 38.444 38.444 37.414 1.030 18518
356 1 . 1 1 64 64 ILE H H 64 8.488 8.488 8.597 -0.109 18518
357 1 . 1 1 65 65 LYS N N 65 118.336 118.336 120.807 -2.471 18518
358 1 . 1 1 65 65 LYS HA H 65 3.701 3.701 3.974 -0.273 18518
359 1 . 1 1 65 65 LYS C C 65 179.291 179.291 179.176 0.115 18518
360 1 . 1 1 65 65 LYS CA C 65 60.440 60.440 59.842 0.598 18518
361 1 . 1 1 65 65 LYS CB C 65 32.371 32.371 32.214 0.157 18518
362 1 . 1 1 65 65 LYS H H 65 7.347 7.347 7.708 -0.360 18518
363 1 . 1 1 66 66 ILE N N 66 120.171 120.171 120.303 -0.132 18518
364 1 . 1 1 66 66 ILE HA H 66 3.578 3.578 3.686 -0.108 18518
365 1 . 1 1 66 66 ILE C C 66 178.873 178.873 178.200 0.673 18518
366 1 . 1 1 66 66 ILE CA C 66 65.160 65.160 65.321 -0.161 18518
367 1 . 1 1 66 66 ILE CB C 66 38.633 38.633 37.907 0.726 18518
368 1 . 1 1 66 66 ILE H H 66 7.901 7.901 8.210 -0.308 18518
369 1 . 1 1 67 67 ILE N N 67 121.185 121.185 120.582 0.603 18518
370 1 . 1 1 67 67 ILE HA H 67 3.446 3.446 3.558 -0.112 18518
371 1 . 1 1 67 67 ILE C C 67 177.150 177.150 177.770 -0.620 18518
372 1 . 1 1 67 67 ILE CA C 67 62.806 62.806 64.570 -1.764 18518
373 1 . 1 1 67 67 ILE CB C 67 34.995 34.995 37.301 -2.307 18518
374 1 . 1 1 67 67 ILE H H 67 8.290 8.290 8.030 0.260 18518
375 1 . 1 1 68 68 ARG N N 68 119.173 119.173 118.808 0.365 18518
376 1 . 1 1 68 68 ARG HA H 68 2.931 2.931 3.755 -0.824 18518
377 1 . 1 1 68 68 ARG C C 68 178.496 178.496 178.672 -0.177 18518
378 1 . 1 1 68 68 ARG CA C 68 60.636 60.636 59.623 1.013 18518
379 1 . 1 1 68 68 ARG CB C 68 30.440 30.440 29.780 0.660 18518
380 1 . 1 1 68 68 ARG H H 68 8.438 8.438 8.344 0.094 18518
381 1 . 1 1 69 69 ARG N N 69 116.511 116.511 120.081 -3.570 18518
382 1 . 1 1 69 69 ARG HA H 69 4.134 4.134 3.994 0.140 18518
383 1 . 1 1 69 69 ARG C C 69 180.262 180.262 178.776 1.486 18518
384 1 . 1 1 69 69 ARG CA C 69 58.707 58.707 59.301 -0.594 18518
385 1 . 1 1 69 69 ARG CB C 69 29.953 29.953 30.159 -0.206 18518
386 1 . 1 1 69 69 ARG H H 69 7.497 7.497 8.305 -0.808 18518
387 1 . 1 1 70 70 ARG N N 70 123.297 123.297 118.680 4.617 18518
388 1 . 1 1 70 70 ARG HA H 70 4.016 4.016 4.127 -0.111 18518
389 1 . 1 1 70 70 ARG C C 70 178.700 178.700 178.311 0.389 18518
390 1 . 1 1 70 70 ARG CA C 70 59.460 59.460 58.552 0.908 18518
391 1 . 1 1 70 70 ARG CB C 70 30.312 30.312 29.770 0.542 18518
392 1 . 1 1 70 70 ARG H H 70 8.075 8.075 7.900 0.175 18518
393 1 . 1 1 71 71 LEU N N 71 116.829 116.829 119.148 -2.319 18518
394 1 . 1 1 71 71 LEU HA H 71 4.065 4.065 4.203 -0.138 18518
395 1 . 1 1 71 71 LEU C C 71 174.956 174.956 176.194 -1.238 18518
396 1 . 1 1 71 71 LEU CA C 71 55.126 55.126 55.434 -0.308 18518
397 1 . 1 1 71 71 LEU CB C 71 43.246 43.246 42.275 0.971 18518
398 1 . 1 1 71 71 LEU H H 71 7.719 7.719 7.920 -0.201 18518
399 1 . 1 1 72 72 GLN N N 72 114.991 114.991 114.525 0.466 18518
400 1 . 1 1 72 72 GLN HA H 72 3.836 3.836 3.884 -0.048 18518
401 1 . 1 1 72 72 GLN C C 72 175.683 175.683 175.262 0.421 18518
402 1 . 1 1 72 72 GLN CA C 72 56.325 56.325 56.163 0.162 18518
403 1 . 1 1 72 72 GLN CB C 72 26.004 26.004 25.830 0.174 18518
404 1 . 1 1 72 72 GLN H H 72 7.744 7.744 7.611 0.133 18518
405 1 . 1 1 73 73 LEU N N 73 115.045 115.045 118.697 -3.652 18518
406 1 . 1 1 73 73 LEU HA H 73 4.236 4.236 4.101 0.135 18518
407 1 . 1 1 73 73 LEU C C 73 178.762 178.762 177.134 1.628 18518
408 1 . 1 1 73 73 LEU CA C 73 54.386 54.386 55.051 -0.666 18518
409 1 . 1 1 73 73 LEU CB C 73 42.091 42.091 41.930 0.161 18518
410 1 . 1 1 73 73 LEU H H 73 7.500 7.500 7.633 -0.133 18518
411 1 . 1 1 74 74 ASN N N 74 121.700 121.700 121.625 0.075 18518
412 1 . 1 1 74 74 ASN HA H 74 4.690 4.690 4.564 0.126 18518
413 1 . 1 1 74 74 ASN C C 74 176.617 176.617 175.804 0.813 18518
414 1 . 1 1 74 74 ASN CA C 74 52.685 52.685 53.664 -0.979 18518
415 1 . 1 1 74 74 ASN CB C 74 39.598 39.598 39.617 -0.019 18518
416 1 . 1 1 74 74 ASN H H 74 9.045 9.045 8.457 0.588 18518
417 1 . 1 1 75 75 ALA N N 75 123.952 123.952 122.578 1.374 18518
418 1 . 1 1 75 75 ALA HA H 75 3.964 3.964 4.319 -0.355 18518
419 1 . 1 1 75 75 ALA C C 75 178.131 178.131 177.502 0.629 18518
420 1 . 1 1 75 75 ALA CA C 75 54.868 54.868 53.579 1.289 18518
421 1 . 1 1 75 75 ALA CB C 75 18.718 18.718 19.325 -0.607 18518
422 1 . 1 1 75 75 ALA H H 75 8.784 8.784 8.495 0.289 18518
423 1 . 1 1 76 76 ASN N N 76 112.295 112.295 115.829 -3.534 18518
424 1 . 1 1 76 76 ASN HA H 76 4.580 4.580 4.649 -0.069 18518
425 1 . 1 1 76 76 ASN C C 76 175.448 175.448 175.157 0.291 18518
426 1 . 1 1 76 76 ASN CA C 76 53.214 53.214 53.506 -0.292 18518
427 1 . 1 1 76 76 ASN CB C 76 38.320 38.320 38.760 -0.440 18518
428 1 . 1 1 76 76 ASN H H 76 8.391 8.391 8.400 -0.009 18518
429 1 . 1 1 77 77 GLN N N 77 120.577 120.577 118.611 1.966 18518
430 1 . 1 1 77 77 GLN HA H 77 4.273 4.273 4.604 -0.331 18518
431 1 . 1 1 77 77 GLN C C 77 175.045 175.045 173.889 1.156 18518
432 1 . 1 1 77 77 GLN CA C 77 55.805 55.805 54.932 0.874 18518
433 1 . 1 1 77 77 GLN CB C 77 30.157 30.157 30.893 -0.736 18518
434 1 . 1 1 77 77 GLN H H 77 7.552 7.552 7.512 0.040 18518
435 1 . 1 1 78 78 ALA N N 78 130.670 130.670 124.169 6.501 18518
436 1 . 1 1 78 78 ALA HA H 78 4.171 4.171 4.591 -0.420 18518
437 1 . 1 1 78 78 ALA C C 78 176.512 176.512 175.566 0.946 18518
438 1 . 1 1 78 78 ALA CA C 78 52.842 52.842 51.340 1.502 18518
439 1 . 1 1 78 78 ALA CB C 78 20.060 20.060 21.234 -1.174 18518
440 1 . 1 1 78 78 ALA H H 78 8.799 8.799 8.594 0.205 18518
441 1 . 1 1 79 79 PHE N N 79 119.325 119.325 116.625 2.700 18518
442 1 . 1 1 79 79 PHE HA H 79 4.434 4.434 5.015 -0.581 18518
443 1 . 1 1 79 79 PHE C C 79 171.726 171.726 172.785 -1.059 18518
444 1 . 1 1 79 79 PHE CA C 79 59.145 59.145 55.864 3.281 18518
445 1 . 1 1 79 79 PHE CB C 79 42.171 42.171 41.556 0.615 18518
446 1 . 1 1 79 79 PHE H H 79 7.664 7.664 8.104 -0.440 18518
447 1 . 1 1 80 80 PHE N N 80 126.314 126.314 117.923 8.391 18518
448 1 . 1 1 80 80 PHE HA H 80 4.392 4.392 4.461 -0.069 18518
449 1 . 1 1 80 80 PHE C C 80 177.169 177.169 173.305 3.864 18518
450 1 . 1 1 80 80 PHE CA C 80 56.653 56.653 56.344 0.309 18518
451 1 . 1 1 80 80 PHE CB C 80 41.933 41.933 42.955 -1.022 18518
452 1 . 1 1 80 80 PHE H H 80 8.508 8.508 8.929 -0.421 18518
453 1 . 1 1 81 81 LEU N N 81 121.426 121.426 122.674 -1.248 18518
454 1 . 1 1 81 81 LEU HA H 81 4.851 4.851 5.098 -0.247 18518
455 1 . 1 1 81 81 LEU C C 81 174.488 174.488 175.006 -0.518 18518
456 1 . 1 1 81 81 LEU CA C 81 53.197 53.197 53.985 -0.788 18518
457 1 . 1 1 81 81 LEU CB C 81 45.100 45.100 44.178 0.922 18518
458 1 . 1 1 81 81 LEU H H 81 8.229 8.229 8.481 -0.252 18518
459 1 . 1 1 82 82 LEU N N 82 125.155 125.155 127.307 -2.152 18518
460 1 . 1 1 82 82 LEU HA H 82 4.833 4.833 4.570 0.263 18518
461 1 . 1 1 82 82 LEU C C 82 177.166 177.166 175.487 1.679 18518
462 1 . 1 1 82 82 LEU CA C 82 54.197 54.197 53.781 0.416 18518
463 1 . 1 1 82 82 LEU CB C 82 43.442 43.442 43.890 -0.448 18518
464 1 . 1 1 82 82 LEU H H 82 9.400 9.400 9.157 0.243 18518
465 1 . 1 1 83 83 VAL N N 83 123.886 123.886 121.975 1.911 18518
466 1 . 1 1 83 83 VAL HA H 83 4.379 4.379 4.399 -0.020 18518
467 1 . 1 1 83 83 VAL C C 83 175.810 175.810 176.622 -0.812 18518
468 1 . 1 1 83 83 VAL CA C 83 61.677 61.677 61.885 -0.208 18518
469 1 . 1 1 83 83 VAL CB C 83 33.758 33.758 32.204 1.554 18518
470 1 . 1 1 83 83 VAL H H 83 8.721 8.721 8.479 0.242 18518
471 1 . 1 1 84 84 ASN N N 84 126.474 126.474 126.961 -0.487 18518
472 1 . 1 1 84 84 ASN HA H 84 4.396 4.396 4.482 -0.086 18518
473 1 . 1 1 84 84 ASN C C 84 175.164 175.164 175.120 0.044 18518
474 1 . 1 1 84 84 ASN CA C 84 54.738 54.738 54.927 -0.189 18518
475 1 . 1 1 84 84 ASN CB C 84 37.950 37.950 37.837 0.113 18518
476 1 . 1 1 84 84 ASN H H 84 9.707 9.707 9.498 0.209 18518
477 1 . 1 1 85 85 GLY N N 85 101.296 101.296 104.521 -3.225 18518
478 1 . 1 1 85 85 GLY C C 85 173.680 173.680 173.165 0.515 18518
479 1 . 1 1 85 85 GLY CA C 85 45.603 45.603 44.907 0.696 18518
480 1 . 1 1 85 85 GLY H H 85 8.644 8.644 8.340 0.304 18518
481 1 . 1 1 86 86 HIS N N 86 117.238 117.238 117.878 -0.640 18518
482 1 . 1 1 86 86 HIS HA H 86 5.017 5.017 4.775 0.242 18518
483 1 . 1 1 86 86 HIS C C 86 173.841 173.841 173.975 -0.134 18518
484 1 . 1 1 86 86 HIS CA C 86 53.796 53.796 53.936 -0.140 18518
485 1 . 1 1 86 86 HIS CB C 86 31.280 31.280 32.001 -0.721 18518
486 1 . 1 1 86 86 HIS H H 86 7.918 7.918 8.201 -0.283 18518
487 1 . 1 1 87 87 SER N N 87 118.179 118.179 120.341 -2.162 18518
488 1 . 1 1 87 87 SER HA H 87 4.699 4.699 4.511 0.188 18518
489 1 . 1 1 87 87 SER C C 87 175.904 175.904 174.532 1.372 18518
490 1 . 1 1 87 87 SER CA C 87 58.271 58.271 58.311 -0.040 18518
491 1 . 1 1 87 87 SER CB C 87 63.735 63.735 62.134 1.601 18518
492 1 . 1 1 87 87 SER H H 87 8.977 8.977 8.816 0.161 18518
493 1 . 1 1 88 88 MET N N 88 125.472 125.472 122.785 2.687 18518
494 1 . 1 1 88 88 MET HA H 88 4.830 4.830 4.664 0.166 18518
495 1 . 1 1 88 88 MET C C 88 176.419 176.419 175.257 1.162 18518
496 1 . 1 1 88 88 MET CA C 88 54.899 54.899 55.397 -0.498 18518
497 1 . 1 1 88 88 MET CB C 88 33.336 33.336 33.455 -0.119 18518
498 1 . 1 1 88 88 MET H H 88 9.184 9.184 8.090 1.094 18518
499 1 . 1 1 89 89 VAL N N 89 120.747 120.747 120.710 0.037 18518
500 1 . 1 1 89 89 VAL HA H 89 4.232 4.232 4.289 -0.057 18518
501 1 . 1 1 89 89 VAL C C 89 175.958 175.958 175.354 0.604 18518
502 1 . 1 1 89 89 VAL CA C 89 63.154 63.154 61.304 1.850 18518
503 1 . 1 1 89 89 VAL CB C 89 31.878 31.878 33.392 -1.514 18518
504 1 . 1 1 89 89 VAL H H 89 8.233 8.233 7.609 0.624 18518
505 1 . 1 1 90 90 SER N N 90 117.362 117.362 120.001 -2.639 18518
506 1 . 1 1 90 90 SER HA H 90 4.590 4.590 4.638 -0.048 18518
507 1 . 1 1 90 90 SER C C 90 175.741 175.741 175.605 0.136 18518
508 1 . 1 1 90 90 SER CA C 90 57.717 57.717 57.593 0.125 18518
509 1 . 1 1 90 90 SER CB C 90 63.223 63.223 64.346 -1.122 18518
510 1 . 1 1 90 90 SER H H 90 8.482 8.482 8.403 0.079 18518
511 1 . 1 1 91 91 VAL N N 91 120.466 120.466 120.765 -0.299 18518
512 1 . 1 1 91 91 VAL HA H 91 4.047 4.047 3.928 0.119 18518
513 1 . 1 1 91 91 VAL C C 91 176.329 176.329 176.088 0.241 18518
514 1 . 1 1 91 91 VAL CA C 91 63.492 63.492 64.384 -0.892 18518
515 1 . 1 1 91 91 VAL CB C 91 32.568 32.568 31.814 0.754 18518
516 1 . 1 1 91 91 VAL H H 91 8.188 8.188 8.616 -0.428 18518
517 1 . 1 1 92 92 SER N N 92 116.398 116.398 113.948 2.450 18518
518 1 . 1 1 92 92 SER HA H 92 4.636 4.636 4.552 0.084 18518
519 1 . 1 1 92 92 SER C C 92 174.159 174.159 174.500 -0.341 18518
520 1 . 1 1 92 92 SER CA C 92 57.805 57.805 58.545 -0.740 18518
521 1 . 1 1 92 92 SER CB C 92 63.046 63.046 63.347 -0.301 18518
522 1 . 1 1 92 92 SER H H 92 8.370 8.370 8.111 0.259 18518
523 1 . 1 1 93 93 THR N N 93 119.211 119.211 119.810 -0.599 18518
524 1 . 1 1 93 93 THR HA H 93 4.484 4.484 4.571 -0.087 18518
525 1 . 1 1 93 93 THR CA C 93 60.884 60.884 61.102 -0.218 18518
526 1 . 1 1 93 93 THR CB C 93 70.609 70.609 68.974 1.635 18518
527 1 . 1 1 93 93 THR H H 93 7.416 7.416 7.540 -0.124 18518
528 1 . 1 1 94 94 PRO HA H 94 4.440 4.440 4.627 -0.187 18518
529 1 . 1 1 94 94 PRO C C 94 178.775 178.775 177.255 1.520 18518
530 1 . 1 1 94 94 PRO CA C 94 62.943 62.943 62.395 0.548 18518
531 1 . 1 1 94 94 PRO CB C 94 32.649 32.649 32.580 0.069 18518
532 1 . 1 1 95 95 ILE N N 95 124.174 124.174 123.760 0.414 18518
533 1 . 1 1 95 95 ILE HA H 95 3.949 3.949 3.819 0.130 18518
534 1 . 1 1 95 95 ILE C C 95 176.498 176.498 177.002 -0.504 18518
535 1 . 1 1 95 95 ILE CA C 95 63.904 63.904 62.651 1.253 18518
536 1 . 1 1 95 95 ILE CB C 95 38.182 38.182 38.111 0.071 18518
537 1 . 1 1 95 95 ILE H H 95 9.305 9.305 8.299 1.006 18518
538 1 . 1 1 96 96 SER N N 96 116.920 116.920 116.239 0.681 18518
539 1 . 1 1 96 96 SER HA H 96 4.029 4.029 4.112 -0.083 18518
540 1 . 1 1 96 96 SER C C 96 176.574 176.574 176.257 0.317 18518
541 1 . 1 1 96 96 SER CA C 96 61.356 61.356 62.337 -0.981 18518
542 1 . 1 1 96 96 SER CB C 96 61.723 61.723 62.654 -0.931 18518
543 1 . 1 1 96 96 SER H H 96 8.335 8.335 8.345 -0.010 18518
544 1 . 1 1 97 97 GLU N N 97 123.255 123.255 122.067 1.188 18518
545 1 . 1 1 97 97 GLU HA H 97 4.278 4.278 4.211 0.067 18518
546 1 . 1 1 97 97 GLU C C 97 179.716 179.716 178.994 0.722 18518
547 1 . 1 1 97 97 GLU CA C 97 58.792 58.792 58.860 -0.068 18518
548 1 . 1 1 97 97 GLU CB C 97 29.562 29.562 29.222 0.340 18518
549 1 . 1 1 97 97 GLU H H 97 7.376 7.376 7.834 -0.458 18518
550 1 . 1 1 98 98 VAL N N 98 121.137 121.137 120.783 0.354 18518
551 1 . 1 1 98 98 VAL HA H 98 3.802 3.802 3.675 0.127 18518
552 1 . 1 1 98 98 VAL C C 98 177.637 177.637 178.024 -0.387 18518
553 1 . 1 1 98 98 VAL CA C 98 65.824 65.824 66.517 -0.693 18518
554 1 . 1 1 98 98 VAL CB C 98 32.154 32.154 31.138 1.016 18518
555 1 . 1 1 98 98 VAL H H 98 7.387 7.387 7.863 -0.475 18518
556 1 . 1 1 99 99 TYR N N 99 118.927 118.927 121.585 -2.658 18518
557 1 . 1 1 99 99 TYR HA H 99 3.990 3.990 4.048 -0.058 18518
558 1 . 1 1 99 99 TYR C C 99 176.081 176.081 177.033 -0.952 18518
559 1 . 1 1 99 99 TYR CA C 99 62.223 62.223 61.476 0.747 18518
560 1 . 1 1 99 99 TYR CB C 99 38.982 38.982 38.438 0.544 18518
561 1 . 1 1 99 99 TYR H H 99 9.048 9.048 8.455 0.593 18518
562 1 . 1 1 100 100 GLU N N 100 113.894 113.894 116.526 -2.632 18518
563 1 . 1 1 100 100 GLU HA H 100 3.846 3.846 3.741 0.105 18518
564 1 . 1 1 100 100 GLU C C 100 177.989 177.989 178.441 -0.452 18518
565 1 . 1 1 100 100 GLU CA C 100 59.087 59.087 58.541 0.546 18518
566 1 . 1 1 100 100 GLU CB C 100 29.382 29.382 28.965 0.417 18518
567 1 . 1 1 100 100 GLU H H 100 7.422 7.422 8.113 -0.691 18518
568 1 . 1 1 101 101 SER N N 101 108.991 108.991 114.251 -5.260 18518
569 1 . 1 1 101 101 SER HA H 101 4.524 4.524 4.400 0.124 18518
570 1 . 1 1 101 101 SER C C 101 176.628 176.628 175.522 1.106 18518
571 1 . 1 1 101 101 SER CA C 101 60.349 60.349 60.346 0.003 18518
572 1 . 1 1 101 101 SER CB C 101 64.741 64.741 63.920 0.821 18518
573 1 . 1 1 101 101 SER H H 101 7.424 7.424 7.850 -0.426 18518
574 1 . 1 1 102 102 GLU N N 102 116.533 116.533 119.211 -2.678 18518
575 1 . 1 1 102 102 GLU HA H 102 4.744 4.744 4.578 0.166 18518
576 1 . 1 1 102 102 GLU C C 102 176.774 176.774 175.793 0.981 18518
577 1 . 1 1 102 102 GLU CA C 102 55.581 55.581 55.336 0.245 18518
578 1 . 1 1 102 102 GLU CB C 102 30.697 30.697 30.761 -0.064 18518
579 1 . 1 1 102 102 GLU H H 102 8.487 8.487 7.956 0.531 18518
580 1 . 1 1 103 103 LYS N N 103 118.370 118.370 119.975 -1.605 18518
581 1 . 1 1 103 103 LYS HA H 103 4.178 4.178 3.998 0.180 18518
582 1 . 1 1 103 103 LYS C C 103 175.018 175.018 176.663 -1.645 18518
583 1 . 1 1 103 103 LYS CA C 103 57.329 57.329 56.988 0.341 18518
584 1 . 1 1 103 103 LYS CB C 103 32.186 32.186 31.881 0.305 18518
585 1 . 1 1 103 103 LYS H H 103 7.831 7.831 7.638 0.193 18518
586 1 . 1 1 104 104 ASP N N 104 123.500 123.500 124.559 -1.058 18518
587 1 . 1 1 104 104 ASP HA H 104 4.755 4.755 4.679 0.076 18518
588 1 . 1 1 104 104 ASP C C 104 177.383 177.383 177.687 -0.304 18518
589 1 . 1 1 104 104 ASP CA C 104 53.846 53.846 53.919 -0.073 18518
590 1 . 1 1 104 104 ASP CB C 104 43.411 43.411 42.812 0.599 18518
591 1 . 1 1 104 104 ASP H H 104 9.041 9.041 8.200 0.841 18518
592 1 . 1 1 105 105 GLU N N 105 125.448 125.448 120.552 4.896 18518
593 1 . 1 1 105 105 GLU HA H 105 4.180 4.180 4.132 0.048 18518
594 1 . 1 1 105 105 GLU C C 105 177.519 177.519 176.808 0.711 18518
595 1 . 1 1 105 105 GLU CA C 105 59.529 59.529 58.888 0.641 18518
596 1 . 1 1 105 105 GLU CB C 105 30.044 30.044 29.652 0.392 18518
597 1 . 1 1 105 105 GLU H H 105 8.906 8.906 8.854 0.052 18518
598 1 . 1 1 106 106 ASP N N 106 118.824 118.824 117.348 1.476 18518
599 1 . 1 1 106 106 ASP HA H 106 4.179 4.179 4.569 -0.390 18518
600 1 . 1 1 106 106 ASP C C 106 176.223 176.223 176.916 -0.693 18518
601 1 . 1 1 106 106 ASP CA C 106 54.756 54.756 54.585 0.171 18518
602 1 . 1 1 106 106 ASP CB C 106 39.999 39.999 40.957 -0.957 18518
603 1 . 1 1 106 106 ASP H H 106 10.036 10.036 8.288 1.748 18518
604 1 . 1 1 107 107 GLY N N 107 105.866 105.866 106.326 -0.460 18518
605 1 . 1 1 107 107 GLY C C 107 175.136 175.136 173.984 1.151 18518
606 1 . 1 1 107 107 GLY CA C 107 45.222 45.222 45.296 -0.074 18518
607 1 . 1 1 107 107 GLY H H 107 8.001 8.001 7.848 0.153 18518
608 1 . 1 1 108 108 PHE N N 108 123.820 123.820 120.807 3.013 18518
609 1 . 1 1 108 108 PHE HA H 108 4.662 4.662 4.875 -0.213 18518
610 1 . 1 1 108 108 PHE C C 108 174.899 174.899 174.649 0.250 18518
611 1 . 1 1 108 108 PHE CA C 108 60.238 60.238 58.066 2.172 18518
612 1 . 1 1 108 108 PHE CB C 108 40.365 40.365 40.699 -0.334 18518
613 1 . 1 1 108 108 PHE H H 108 9.912 9.912 7.924 1.988 18518
614 1 . 1 1 109 109 LEU N N 109 120.130 120.130 122.926 -2.796 18518
615 1 . 1 1 109 109 LEU HA H 109 5.030 5.030 4.853 0.177 18518
616 1 . 1 1 109 109 LEU C C 109 173.916 173.916 174.811 -0.895 18518
617 1 . 1 1 109 109 LEU CA C 109 53.424 53.424 53.832 -0.408 18518
618 1 . 1 1 109 109 LEU CB C 109 45.203 45.203 44.308 0.895 18518
619 1 . 1 1 109 109 LEU H H 109 7.997 7.997 8.648 -0.651 18518
620 1 . 1 1 110 110 TYR N N 110 126.579 126.579 126.076 0.503 18518
621 1 . 1 1 110 110 TYR HA H 110 5.003 5.003 4.730 0.273 18518
622 1 . 1 1 110 110 TYR C C 110 176.671 176.671 175.242 1.429 18518
623 1 . 1 1 110 110 TYR CA C 110 59.058 59.058 58.048 1.010 18518
624 1 . 1 1 110 110 TYR CB C 110 39.556 39.556 39.661 -0.105 18518
625 1 . 1 1 110 110 TYR H H 110 9.377 9.377 8.801 0.576 18518
626 1 . 1 1 111 111 MET N N 111 119.240 119.240 121.347 -2.107 18518
627 1 . 1 1 111 111 MET HA H 111 5.486 5.486 5.276 0.210 18518
628 1 . 1 1 111 111 MET C C 111 175.695 175.695 174.529 1.166 18518
629 1 . 1 1 111 111 MET CA C 111 54.124 54.124 54.714 -0.590 18518
630 1 . 1 1 111 111 MET CB C 111 36.960 36.960 37.425 -0.465 18518
631 1 . 1 1 111 111 MET H H 111 9.658 9.658 9.004 0.654 18518
632 1 . 1 1 112 112 VAL N N 112 119.865 119.865 118.045 1.820 18518
633 1 . 1 1 112 112 VAL HA H 112 5.963 5.963 5.490 0.473 18518
634 1 . 1 1 112 112 VAL C C 112 175.058 175.058 174.376 0.682 18518
635 1 . 1 1 112 112 VAL CA C 112 58.911 58.911 59.769 -0.858 18518
636 1 . 1 1 112 112 VAL CB C 112 36.051 36.051 35.289 0.762 18518
637 1 . 1 1 112 112 VAL H H 112 8.794 8.794 9.043 -0.249 18518
638 1 . 1 1 113 113 TYR N N 113 119.664 119.664 120.443 -0.779 18518
639 1 . 1 1 113 113 TYR HA H 113 6.118 6.118 5.698 0.420 18518
640 1 . 1 1 113 113 TYR C C 113 173.375 173.375 173.492 -0.117 18518
641 1 . 1 1 113 113 TYR CA C 113 54.153 54.153 55.157 -1.004 18518
642 1 . 1 1 113 113 TYR CB C 113 43.312 43.312 41.853 1.459 18518
643 1 . 1 1 113 113 TYR H H 113 8.315 8.315 8.523 -0.208 18518
644 1 . 1 1 114 114 ALA N N 114 119.763 119.763 122.907 -3.144 18518
645 1 . 1 1 114 114 ALA HA H 114 4.800 4.800 4.971 -0.171 18518
646 1 . 1 1 114 114 ALA C C 114 176.216 176.216 175.158 1.058 18518
647 1 . 1 1 114 114 ALA CA C 114 51.132 51.132 51.881 -0.749 18518
648 1 . 1 1 114 114 ALA CB C 114 24.596 24.596 22.345 2.251 18518
649 1 . 1 1 114 114 ALA H H 114 8.465 8.465 8.894 -0.429 18518
650 1 . 1 1 115 115 SER N N 115 114.763 114.763 115.961 -1.198 18518
651 1 . 1 1 115 115 SER HA H 115 4.496 4.496 4.897 -0.401 18518
652 1 . 1 1 115 115 SER C C 115 172.671 172.671 173.703 -1.032 18518
653 1 . 1 1 115 115 SER CA C 115 58.651 58.651 57.599 1.052 18518
654 1 . 1 1 115 115 SER CB C 115 63.526 63.526 61.931 1.595 18518
655 1 . 1 1 115 115 SER H H 115 9.915 9.915 8.998 0.917 18518
656 1 . 1 1 116 116 GLN N N 116 116.611 116.611 123.746 -7.135 18518
657 1 . 1 1 116 116 GLN HA H 116 4.484 4.484 4.496 -0.012 18518
658 1 . 1 1 116 116 GLN C C 116 172.733 172.733 173.696 -0.963 18518
659 1 . 1 1 116 116 GLN CA C 116 53.926 53.926 55.825 -1.899 18518
660 1 . 1 1 116 116 GLN CB C 116 32.358 32.358 30.938 1.420 18518
661 1 . 1 1 116 116 GLN H H 116 7.219 7.219 8.000 -0.781 18518
662 1 . 1 1 117 117 GLU N N 117 117.623 117.623 121.060 -3.437 18518
663 1 . 1 1 117 117 GLU HA H 117 3.287 3.287 2.876 0.411 18518
664 1 . 1 1 117 117 GLU C C 117 175.168 175.168 175.522 -0.354 18518
665 1 . 1 1 117 117 GLU CA C 117 56.882 56.882 56.947 -0.065 18518
666 1 . 1 1 117 117 GLU CB C 117 30.522 30.522 29.667 0.855 18518
667 1 . 1 1 117 117 GLU H H 117 7.882 7.882 8.501 -0.619 18518
668 1 . 1 1 118 118 THR N N 118 109.820 109.820 110.287 -0.467 18518
669 1 . 1 1 118 118 THR HA H 118 4.066 4.066 4.307 -0.241 18518
670 1 . 1 1 118 118 THR C C 118 172.355 172.355 173.778 -1.423 18518
671 1 . 1 1 118 118 THR CA C 118 60.029 60.029 60.621 -0.592 18518
672 1 . 1 1 118 118 THR CB C 118 70.480 70.480 69.648 0.832 18518
673 1 . 1 1 118 118 THR H H 118 6.992 6.992 7.324 -0.332 18518
stop_
save_