data_18852
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18852
_Entry.PDB_ID 2M1A
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 18852
_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 4.239 4.239 4.266 -0.027 18852
2 1 1 . 1 1 2 2 ALA C C 2 179.180 179.180 179.554 -0.374 18852
3 1 1 . 1 1 2 2 ALA CA C 2 54.532 54.532 54.075 0.457 18852
4 1 1 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.342 -0.945 18852
5 1 1 . 1 1 3 3 MET N N 3 117.814 117.814 117.647 0.167 18852
6 1 1 . 1 1 3 3 MET HA H 3 4.354 4.354 4.239 0.115 18852
7 1 1 . 1 1 3 3 MET C C 3 177.926 177.926 177.814 0.112 18852
8 1 1 . 1 1 3 3 MET CA C 3 57.876 57.876 57.383 0.493 18852
9 1 1 . 1 1 3 3 MET CB C 3 31.673 31.673 32.329 -0.656 18852
10 1 1 . 1 1 3 3 MET H H 3 8.613 8.613 8.145 0.468 18852
11 1 1 . 1 1 4 4 ALA N N 4 122.603 122.603 121.188 1.415 18852
12 1 1 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.080 0.148 18852
13 1 1 . 1 1 4 4 ALA C C 4 179.940 179.940 179.236 0.704 18852
14 1 1 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.392 -0.702 18852
15 1 1 . 1 1 4 4 ALA CB C 4 18.025 18.025 17.997 0.028 18852
16 1 1 . 1 1 4 4 ALA H H 4 8.324 8.324 8.390 -0.066 18852
17 1 1 . 1 1 5 5 THR N N 5 112.671 112.671 111.063 1.608 18852
18 1 1 . 1 1 5 5 THR HA H 5 4.121 4.121 4.072 0.049 18852
19 1 1 . 1 1 5 5 THR C C 5 176.085 176.085 176.497 -0.412 18852
20 1 1 . 1 1 5 5 THR CA C 5 65.053 65.053 65.342 -0.289 18852
21 1 1 . 1 1 5 5 THR CB C 5 68.989 68.989 68.631 0.358 18852
22 1 1 . 1 1 5 5 THR H H 5 7.966 7.966 7.678 0.288 18852
23 1 1 . 1 1 6 6 ARG N N 6 122.300 122.300 121.898 0.402 18852
24 1 1 . 1 1 6 6 ARG HA H 6 4.057 4.057 4.059 -0.002 18852
25 1 1 . 1 1 6 6 ARG C C 6 178.983 178.983 178.582 0.401 18852
26 1 1 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.099 0.864 18852
27 1 1 . 1 1 6 6 ARG CB C 6 29.853 29.853 29.767 0.086 18852
28 1 1 . 1 1 6 6 ARG H H 6 8.244 8.244 7.368 0.876 18852
29 1 1 . 1 1 7 7 GLN N N 7 118.940 118.940 118.137 0.803 18852
30 1 1 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.128 -0.070 18852
31 1 1 . 1 1 7 7 GLN C C 7 177.997 177.997 178.036 -0.039 18852
32 1 1 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.121 0.614 18852
33 1 1 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.362 -0.174 18852
34 1 1 . 1 1 7 7 GLN H H 7 8.424 8.424 7.852 0.572 18852
35 1 1 . 1 1 8 8 ALA N N 8 122.920 122.920 122.942 -0.022 18852
36 1 1 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.006 0.211 18852
37 1 1 . 1 1 8 8 ALA C C 8 180.837 180.837 179.531 1.306 18852
38 1 1 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.858 0.461 18852
39 1 1 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.235 -0.540 18852
40 1 1 . 1 1 8 8 ALA H H 8 8.306 8.306 7.666 0.640 18852
41 1 1 . 1 1 9 9 ARG N N 9 118.721 118.721 117.849 0.872 18852
42 1 1 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.038 0.012 18852
43 1 1 . 1 1 9 9 ARG C C 9 178.843 178.843 178.874 -0.031 18852
44 1 1 . 1 1 9 9 ARG CA C 9 59.721 59.721 58.913 0.808 18852
45 1 1 . 1 1 9 9 ARG CB C 9 30.168 30.168 30.058 0.110 18852
46 1 1 . 1 1 9 9 ARG H H 9 8.263 8.263 7.974 0.289 18852
47 1 1 . 1 1 10 10 ARG N N 10 120.338 120.338 117.970 2.368 18852
48 1 1 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.239 -0.165 18852
49 1 1 . 1 1 10 10 ARG C C 10 179.024 179.024 178.298 0.726 18852
50 1 1 . 1 1 10 10 ARG CA C 10 59.542 59.542 59.047 0.495 18852
51 1 1 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.983 -0.079 18852
52 1 1 . 1 1 10 10 ARG H H 10 8.251 8.251 7.716 0.535 18852
53 1 1 . 1 1 11 11 ASN N N 11 118.863 118.863 119.281 -0.418 18852
54 1 1 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.360 0.183 18852
55 1 1 . 1 1 11 11 ASN C C 11 177.279 177.279 177.023 0.256 18852
56 1 1 . 1 1 11 11 ASN CA C 11 55.979 55.979 56.879 -0.900 18852
57 1 1 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.372 -0.389 18852
58 1 1 . 1 1 11 11 ASN H H 11 8.551 8.551 7.822 0.729 18852
59 1 1 . 1 1 12 12 ARG N N 12 120.917 120.917 119.131 1.786 18852
60 1 1 . 1 1 12 12 ARG HA H 12 4.079 4.079 3.998 0.081 18852
61 1 1 . 1 1 12 12 ARG C C 12 178.488 178.488 178.758 -0.270 18852
62 1 1 . 1 1 12 12 ARG CA C 12 59.787 59.787 58.837 0.950 18852
63 1 1 . 1 1 12 12 ARG CB C 12 29.937 29.937 29.769 0.168 18852
64 1 1 . 1 1 12 12 ARG H H 12 8.253 8.253 8.062 0.191 18852
65 1 1 . 1 1 13 13 ARG N N 13 119.263 119.263 119.121 0.142 18852
66 1 1 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.288 -0.099 18852
67 1 1 . 1 1 13 13 ARG C C 13 178.479 178.479 178.887 -0.408 18852
68 1 1 . 1 1 13 13 ARG CA C 13 59.572 59.572 59.221 0.351 18852
69 1 1 . 1 1 13 13 ARG CB C 13 30.067 30.067 30.203 -0.136 18852
70 1 1 . 1 1 13 13 ARG H H 13 8.167 8.167 7.560 0.607 18852
71 1 1 . 1 1 14 14 ARG N N 14 119.756 119.756 120.345 -0.589 18852
72 1 1 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.124 0.017 18852
73 1 1 . 1 1 14 14 ARG C C 14 178.817 178.817 178.102 0.715 18852
74 1 1 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.119 0.576 18852
75 1 1 . 1 1 14 14 ARG CB C 14 29.812 29.812 30.174 -0.362 18852
76 1 1 . 1 1 14 14 ARG H H 14 8.285 8.285 8.215 0.070 18852
77 1 1 . 1 1 15 15 ARG N N 15 119.026 119.026 119.985 -0.959 18852
78 1 1 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.089 0.069 18852
79 1 1 . 1 1 15 15 ARG C C 15 178.909 178.909 178.630 0.279 18852
80 1 1 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.465 -0.231 18852
81 1 1 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.798 -0.026 18852
82 1 1 . 1 1 15 15 ARG H H 15 8.278 8.278 8.223 0.055 18852
83 1 1 . 1 1 16 16 TRP N N 16 121.055 121.055 118.009 3.046 18852
84 1 1 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.489 -0.100 18852
85 1 1 . 1 1 16 16 TRP C C 16 178.621 178.621 178.257 0.364 18852
86 1 1 . 1 1 16 16 TRP CA C 16 61.013 61.013 58.503 2.510 18852
87 1 1 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.448 -0.652 18852
88 1 1 . 1 1 16 16 TRP H H 16 8.464 8.464 7.441 1.022 18852
89 1 1 . 1 1 17 17 ARG N N 17 119.474 119.474 120.349 -0.875 18852
90 1 1 . 1 1 17 17 ARG HA H 17 3.910 3.910 3.998 -0.088 18852
91 1 1 . 1 1 17 17 ARG C C 17 179.120 179.120 178.393 0.727 18852
92 1 1 . 1 1 17 17 ARG CA C 17 59.627 59.627 59.140 0.487 18852
93 1 1 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.861 0.045 18852
94 1 1 . 1 1 17 17 ARG H H 17 8.537 8.537 7.650 0.887 18852
95 1 1 . 1 1 18 18 GLU N N 18 119.223 119.223 117.606 1.617 18852
96 1 1 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.102 -0.041 18852
97 1 1 . 1 1 18 18 GLU C C 18 179.163 179.163 178.989 0.174 18852
98 1 1 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.892 0.246 18852
99 1 1 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.055 0.080 18852
100 1 1 . 1 1 18 18 GLU H H 18 8.346 8.346 8.129 0.217 18852
101 1 1 . 1 1 19 19 ARG N N 19 119.942 119.942 119.049 0.893 18852
102 1 1 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.148 -0.102 18852
103 1 1 . 1 1 19 19 ARG C C 19 178.634 178.634 179.141 -0.507 18852
104 1 1 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.234 0.782 18852
105 1 1 . 1 1 19 19 ARG CB C 19 29.371 29.371 29.850 -0.479 18852
106 1 1 . 1 1 19 19 ARG H H 19 8.104 8.104 7.560 0.544 18852
107 1 1 . 1 1 20 20 GLN N N 20 118.373 118.373 119.122 -0.749 18852
108 1 1 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.175 -0.283 18852
109 1 1 . 1 1 20 20 GLN C C 20 178.465 178.465 177.558 0.907 18852
110 1 1 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.635 -0.465 18852
111 1 1 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.548 -0.435 18852
112 1 1 . 1 1 20 20 GLN H H 20 8.044 8.044 7.923 0.121 18852
113 1 1 . 1 1 21 21 ARG N N 21 119.374 119.374 119.690 -0.316 18852
114 1 1 . 1 1 21 21 ARG HA H 21 4.034 4.034 4.029 0.005 18852
115 1 1 . 1 1 21 21 ARG C C 21 178.423 178.423 178.297 0.126 18852
116 1 1 . 1 1 21 21 ARG CA C 21 58.765 58.765 59.082 -0.317 18852
117 1 1 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.981 -0.305 18852
118 1 1 . 1 1 21 21 ARG H H 21 8.079 8.079 7.592 0.487 18852
119 1 1 . 1 1 22 22 ALA N N 22 121.393 121.393 120.446 0.947 18852
120 1 1 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.144 0.002 18852
121 1 1 . 1 1 22 22 ALA C C 22 179.577 179.577 178.319 1.258 18852
122 1 1 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.911 -0.644 18852
123 1 1 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.485 -0.654 18852
124 1 1 . 1 1 22 22 ALA H H 22 8.026 8.026 7.604 0.422 18852
125 1 1 . 1 1 23 23 ALA N N 23 119.867 119.867 120.612 -0.745 18852
126 1 1 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.254 -0.096 18852
127 1 1 . 1 1 23 23 ALA C C 23 178.616 178.616 179.527 -0.911 18852
128 1 1 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.826 -0.112 18852
129 1 1 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.818 -0.773 18852
130 1 1 . 1 1 23 23 ALA H H 23 7.938 7.938 7.628 0.310 18852
131 1 1 . 1 1 24 24 ALA N N 24 119.652 119.652 121.548 -1.896 18852
132 1 1 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.125 0.166 18852
133 1 1 . 1 1 24 24 ALA C C 24 177.528 177.528 177.635 -0.107 18852
134 1 1 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.611 -0.905 18852
135 1 1 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.262 -0.671 18852
136 1 1 . 1 1 24 24 ALA H H 24 7.693 7.693 8.412 -0.719 18852
137 1 1 . 1 1 25 25 ALA N N 25 121.574 121.574 120.317 1.257 18852
138 1 1 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.599 -0.270 18852
139 1 1 . 1 1 25 25 ALA C C 25 176.649 176.649 175.918 0.731 18852
140 1 1 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.745 1.821 18852
141 1 1 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.643 -2.013 18852
142 1 1 . 1 1 25 25 ALA H H 25 7.679 7.679 7.742 -0.062 18852
143 1 2 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.164 0.075 18852
144 1 2 . 1 1 2 2 ALA C C 2 179.180 179.180 179.989 -0.809 18852
145 1 2 . 1 1 2 2 ALA CA C 2 54.532 54.532 54.320 0.212 18852
146 1 2 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.009 -0.612 18852
147 1 2 . 1 1 3 3 MET N N 3 117.814 117.814 114.728 3.086 18852
148 1 2 . 1 1 3 3 MET HA H 3 4.354 4.354 4.282 0.072 18852
149 1 2 . 1 1 3 3 MET C C 3 177.926 177.926 177.249 0.677 18852
150 1 2 . 1 1 3 3 MET CA C 3 57.876 57.876 57.835 0.041 18852
151 1 2 . 1 1 3 3 MET CB C 3 31.673 31.673 31.963 -0.290 18852
152 1 2 . 1 1 3 3 MET H H 3 8.613 8.613 8.005 0.608 18852
153 1 2 . 1 1 4 4 ALA N N 4 122.603 122.603 122.788 -0.185 18852
154 1 2 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.121 0.107 18852
155 1 2 . 1 1 4 4 ALA C C 4 179.940 179.940 179.465 0.475 18852
156 1 2 . 1 1 4 4 ALA CA C 4 54.689 54.689 54.609 0.080 18852
157 1 2 . 1 1 4 4 ALA CB C 4 18.025 18.025 18.630 -0.605 18852
158 1 2 . 1 1 4 4 ALA H H 4 8.324 8.324 7.448 0.876 18852
159 1 2 . 1 1 5 5 THR N N 5 112.671 112.671 111.758 0.913 18852
160 1 2 . 1 1 5 5 THR HA H 5 4.121 4.121 4.005 0.116 18852
161 1 2 . 1 1 5 5 THR C C 5 176.085 176.085 176.431 -0.346 18852
162 1 2 . 1 1 5 5 THR CA C 5 65.053 65.053 65.170 -0.117 18852
163 1 2 . 1 1 5 5 THR CB C 5 68.989 68.989 68.525 0.464 18852
164 1 2 . 1 1 5 5 THR H H 5 7.966 7.966 7.737 0.229 18852
165 1 2 . 1 1 6 6 ARG N N 6 122.300 122.300 122.202 0.098 18852
166 1 2 . 1 1 6 6 ARG HA H 6 4.057 4.057 3.899 0.158 18852
167 1 2 . 1 1 6 6 ARG C C 6 178.983 178.983 178.439 0.544 18852
168 1 2 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.921 0.042 18852
169 1 2 . 1 1 6 6 ARG CB C 6 29.853 29.853 29.964 -0.111 18852
170 1 2 . 1 1 6 6 ARG H H 6 8.244 8.244 7.590 0.654 18852
171 1 2 . 1 1 7 7 GLN N N 7 118.940 118.940 118.207 0.733 18852
172 1 2 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.143 -0.085 18852
173 1 2 . 1 1 7 7 GLN C C 7 177.997 177.997 177.534 0.463 18852
174 1 2 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.317 0.418 18852
175 1 2 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.610 -0.422 18852
176 1 2 . 1 1 7 7 GLN H H 7 8.424 8.424 7.835 0.589 18852
177 1 2 . 1 1 8 8 ALA N N 8 122.920 122.920 123.652 -0.732 18852
178 1 2 . 1 1 8 8 ALA HA H 8 4.217 4.217 3.967 0.250 18852
179 1 2 . 1 1 8 8 ALA C C 8 180.837 180.837 179.837 1.000 18852
180 1 2 . 1 1 8 8 ALA CA C 8 55.319 55.319 55.275 0.044 18852
181 1 2 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.072 -0.377 18852
182 1 2 . 1 1 8 8 ALA H H 8 8.306 8.306 7.574 0.732 18852
183 1 2 . 1 1 9 9 ARG N N 9 118.721 118.721 117.546 1.175 18852
184 1 2 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.094 -0.044 18852
185 1 2 . 1 1 9 9 ARG C C 9 178.843 178.843 178.789 0.054 18852
186 1 2 . 1 1 9 9 ARG CA C 9 59.721 59.721 58.403 1.318 18852
187 1 2 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.858 0.310 18852
188 1 2 . 1 1 9 9 ARG H H 9 8.263 8.263 8.102 0.161 18852
189 1 2 . 1 1 10 10 ARG N N 10 120.338 120.338 119.530 0.808 18852
190 1 2 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.151 -0.077 18852
191 1 2 . 1 1 10 10 ARG C C 10 179.024 179.024 178.397 0.627 18852
192 1 2 . 1 1 10 10 ARG CA C 10 59.542 59.542 59.107 0.435 18852
193 1 2 . 1 1 10 10 ARG CB C 10 29.904 29.904 30.027 -0.123 18852
194 1 2 . 1 1 10 10 ARG H H 10 8.251 8.251 7.544 0.707 18852
195 1 2 . 1 1 11 11 ASN N N 11 118.863 118.863 118.698 0.165 18852
196 1 2 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.601 -0.058 18852
197 1 2 . 1 1 11 11 ASN C C 11 177.279 177.279 177.369 -0.090 18852
198 1 2 . 1 1 11 11 ASN CA C 11 55.979 55.979 55.701 0.278 18852
199 1 2 . 1 1 11 11 ASN CB C 11 37.983 37.983 37.896 0.087 18852
200 1 2 . 1 1 11 11 ASN H H 11 8.551 8.551 8.287 0.264 18852
201 1 2 . 1 1 12 12 ARG N N 12 120.917 120.917 120.817 0.100 18852
202 1 2 . 1 1 12 12 ARG HA H 12 4.079 4.079 4.012 0.067 18852
203 1 2 . 1 1 12 12 ARG C C 12 178.488 178.488 178.748 -0.260 18852
204 1 2 . 1 1 12 12 ARG CA C 12 59.787 59.787 59.554 0.233 18852
205 1 2 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.006 -0.069 18852
206 1 2 . 1 1 12 12 ARG H H 12 8.253 8.253 8.096 0.157 18852
207 1 2 . 1 1 13 13 ARG N N 13 119.263 119.263 117.632 1.631 18852
208 1 2 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.241 -0.052 18852
209 1 2 . 1 1 13 13 ARG C C 13 178.479 178.479 178.628 -0.149 18852
210 1 2 . 1 1 13 13 ARG CA C 13 59.572 59.572 58.593 0.979 18852
211 1 2 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.748 0.319 18852
212 1 2 . 1 1 13 13 ARG H H 13 8.167 8.167 7.701 0.466 18852
213 1 2 . 1 1 14 14 ARG N N 14 119.756 119.756 121.060 -1.304 18852
214 1 2 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.105 0.036 18852
215 1 2 . 1 1 14 14 ARG C C 14 178.817 178.817 178.567 0.250 18852
216 1 2 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.259 0.436 18852
217 1 2 . 1 1 14 14 ARG CB C 14 29.812 29.812 30.139 -0.327 18852
218 1 2 . 1 1 14 14 ARG H H 14 8.285 8.285 7.729 0.556 18852
219 1 2 . 1 1 15 15 ARG N N 15 119.026 119.026 118.519 0.507 18852
220 1 2 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.007 0.151 18852
221 1 2 . 1 1 15 15 ARG C C 15 178.909 178.909 178.993 -0.084 18852
222 1 2 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.259 -0.026 18852
223 1 2 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.846 -0.074 18852
224 1 2 . 1 1 15 15 ARG H H 15 8.278 8.278 8.464 -0.186 18852
225 1 2 . 1 1 16 16 TRP N N 16 121.055 121.055 119.976 1.079 18852
226 1 2 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.472 -0.083 18852
227 1 2 . 1 1 16 16 TRP C C 16 178.621 178.621 177.635 0.986 18852
228 1 2 . 1 1 16 16 TRP CA C 16 61.013 61.013 59.892 1.121 18852
229 1 2 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.373 -0.577 18852
230 1 2 . 1 1 16 16 TRP H H 16 8.464 8.464 7.671 0.793 18852
231 1 2 . 1 1 17 17 ARG N N 17 119.474 119.474 119.634 -0.160 18852
232 1 2 . 1 1 17 17 ARG HA H 17 3.910 3.910 3.825 0.085 18852
233 1 2 . 1 1 17 17 ARG C C 17 179.120 179.120 178.367 0.753 18852
234 1 2 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.818 0.809 18852
235 1 2 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.893 0.014 18852
236 1 2 . 1 1 17 17 ARG H H 17 8.537 8.537 7.868 0.669 18852
237 1 2 . 1 1 18 18 GLU N N 18 119.223 119.223 118.023 1.200 18852
238 1 2 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.012 0.049 18852
239 1 2 . 1 1 18 18 GLU C C 18 179.163 179.163 178.757 0.406 18852
240 1 2 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.981 0.157 18852
241 1 2 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.449 -0.314 18852
242 1 2 . 1 1 18 18 GLU H H 18 8.346 8.346 7.870 0.476 18852
243 1 2 . 1 1 19 19 ARG N N 19 119.942 119.942 118.247 1.695 18852
244 1 2 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.142 -0.096 18852
245 1 2 . 1 1 19 19 ARG C C 19 178.634 178.634 178.766 -0.132 18852
246 1 2 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.507 0.509 18852
247 1 2 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.367 -0.996 18852
248 1 2 . 1 1 19 19 ARG H H 19 8.104 8.104 7.766 0.338 18852
249 1 2 . 1 1 20 20 GLN N N 20 118.373 118.373 119.799 -1.426 18852
250 1 2 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.024 -0.132 18852
251 1 2 . 1 1 20 20 GLN C C 20 178.465 178.465 177.828 0.637 18852
252 1 2 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.638 -0.468 18852
253 1 2 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.236 -0.123 18852
254 1 2 . 1 1 20 20 GLN H H 20 8.044 8.044 7.714 0.330 18852
255 1 2 . 1 1 21 21 ARG N N 21 119.374 119.374 120.094 -0.720 18852
256 1 2 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.966 0.068 18852
257 1 2 . 1 1 21 21 ARG C C 21 178.423 178.423 178.278 0.145 18852
258 1 2 . 1 1 21 21 ARG CA C 21 58.765 58.765 58.642 0.123 18852
259 1 2 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.544 0.132 18852
260 1 2 . 1 1 21 21 ARG H H 21 8.079 8.079 7.683 0.396 18852
261 1 2 . 1 1 22 22 ALA N N 22 121.393 121.393 120.208 1.185 18852
262 1 2 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.190 -0.044 18852
263 1 2 . 1 1 22 22 ALA C C 22 179.577 179.577 178.363 1.214 18852
264 1 2 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.877 -0.610 18852
265 1 2 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.533 -0.702 18852
266 1 2 . 1 1 22 22 ALA H H 22 8.026 8.026 7.522 0.504 18852
267 1 2 . 1 1 23 23 ALA N N 23 119.867 119.867 120.755 -0.888 18852
268 1 2 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.225 -0.067 18852
269 1 2 . 1 1 23 23 ALA C C 23 178.616 178.616 179.466 -0.850 18852
270 1 2 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.877 -0.163 18852
271 1 2 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.792 -0.747 18852
272 1 2 . 1 1 23 23 ALA H H 23 7.938 7.938 7.614 0.324 18852
273 1 2 . 1 1 24 24 ALA N N 24 119.652 119.652 121.372 -1.720 18852
274 1 2 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.113 0.178 18852
275 1 2 . 1 1 24 24 ALA C C 24 177.528 177.528 177.657 -0.129 18852
276 1 2 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.515 -0.809 18852
277 1 2 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.249 -0.658 18852
278 1 2 . 1 1 24 24 ALA H H 24 7.693 7.693 8.386 -0.693 18852
279 1 2 . 1 1 25 25 ALA N N 25 121.574 121.574 120.792 0.782 18852
280 1 2 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.539 -0.210 18852
281 1 2 . 1 1 25 25 ALA C C 25 176.649 176.649 176.180 0.469 18852
282 1 2 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.708 1.858 18852
283 1 2 . 1 1 25 25 ALA CB C 25 18.630 18.630 19.990 -1.360 18852
284 1 2 . 1 1 25 25 ALA H H 25 7.679 7.679 7.662 0.017 18852
285 1 3 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.138 0.101 18852
286 1 3 . 1 1 2 2 ALA C C 2 179.180 179.180 179.723 -0.543 18852
287 1 3 . 1 1 2 2 ALA CA C 2 54.532 54.532 55.052 -0.520 18852
288 1 3 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.168 -0.771 18852
289 1 3 . 1 1 3 3 MET N N 3 117.814 117.814 118.227 -0.413 18852
290 1 3 . 1 1 3 3 MET HA H 3 4.354 4.354 4.268 0.086 18852
291 1 3 . 1 1 3 3 MET C C 3 177.926 177.926 177.519 0.407 18852
292 1 3 . 1 1 3 3 MET CA C 3 57.876 57.876 56.681 1.195 18852
293 1 3 . 1 1 3 3 MET CB C 3 31.673 31.673 32.088 -0.415 18852
294 1 3 . 1 1 3 3 MET H H 3 8.613 8.613 8.207 0.406 18852
295 1 3 . 1 1 4 4 ALA N N 4 122.603 122.603 121.468 1.135 18852
296 1 3 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.217 0.011 18852
297 1 3 . 1 1 4 4 ALA C C 4 179.940 179.940 179.553 0.387 18852
298 1 3 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.295 -0.606 18852
299 1 3 . 1 1 4 4 ALA CB C 4 18.025 18.025 18.093 -0.068 18852
300 1 3 . 1 1 4 4 ALA H H 4 8.324 8.324 8.035 0.289 18852
301 1 3 . 1 1 5 5 THR N N 5 112.671 112.671 113.492 -0.821 18852
302 1 3 . 1 1 5 5 THR HA H 5 4.121 4.121 3.998 0.123 18852
303 1 3 . 1 1 5 5 THR C C 5 176.085 176.085 176.475 -0.390 18852
304 1 3 . 1 1 5 5 THR CA C 5 65.053 65.053 65.607 -0.554 18852
305 1 3 . 1 1 5 5 THR CB C 5 68.989 68.989 68.970 0.019 18852
306 1 3 . 1 1 5 5 THR H H 5 7.966 7.966 8.474 -0.508 18852
307 1 3 . 1 1 6 6 ARG N N 6 122.300 122.300 119.434 2.866 18852
308 1 3 . 1 1 6 6 ARG HA H 6 4.057 4.057 4.253 -0.196 18852
309 1 3 . 1 1 6 6 ARG C C 6 178.983 178.983 178.617 0.366 18852
310 1 3 . 1 1 6 6 ARG CA C 6 59.963 59.963 58.486 1.477 18852
311 1 3 . 1 1 6 6 ARG CB C 6 29.853 29.853 30.101 -0.248 18852
312 1 3 . 1 1 6 6 ARG H H 6 8.244 8.244 7.490 0.754 18852
313 1 3 . 1 1 7 7 GLN N N 7 118.940 118.940 119.793 -0.853 18852
314 1 3 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.083 -0.025 18852
315 1 3 . 1 1 7 7 GLN C C 7 177.997 177.997 177.943 0.054 18852
316 1 3 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.461 0.274 18852
317 1 3 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.289 -0.101 18852
318 1 3 . 1 1 7 7 GLN H H 7 8.424 8.424 7.929 0.495 18852
319 1 3 . 1 1 8 8 ALA N N 8 122.920 122.920 122.216 0.704 18852
320 1 3 . 1 1 8 8 ALA HA H 8 4.217 4.217 3.994 0.223 18852
321 1 3 . 1 1 8 8 ALA C C 8 180.837 180.837 179.711 1.126 18852
322 1 3 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.889 0.430 18852
323 1 3 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.290 -0.595 18852
324 1 3 . 1 1 8 8 ALA H H 8 8.306 8.306 8.401 -0.095 18852
325 1 3 . 1 1 9 9 ARG N N 9 118.721 118.721 117.579 1.142 18852
326 1 3 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.175 -0.125 18852
327 1 3 . 1 1 9 9 ARG C C 9 178.843 178.843 178.735 0.108 18852
328 1 3 . 1 1 9 9 ARG CA C 9 59.721 59.721 58.260 1.461 18852
329 1 3 . 1 1 9 9 ARG CB C 9 30.168 30.168 30.125 0.043 18852
330 1 3 . 1 1 9 9 ARG H H 9 8.263 8.263 8.045 0.218 18852
331 1 3 . 1 1 10 10 ARG N N 10 120.338 120.338 119.463 0.875 18852
332 1 3 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.199 -0.125 18852
333 1 3 . 1 1 10 10 ARG C C 10 179.024 179.024 178.643 0.381 18852
334 1 3 . 1 1 10 10 ARG CA C 10 59.542 59.542 59.286 0.256 18852
335 1 3 . 1 1 10 10 ARG CB C 10 29.904 29.904 30.052 -0.148 18852
336 1 3 . 1 1 10 10 ARG H H 10 8.251 8.251 8.074 0.177 18852
337 1 3 . 1 1 11 11 ASN N N 11 118.863 118.863 118.181 0.682 18852
338 1 3 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.626 -0.083 18852
339 1 3 . 1 1 11 11 ASN C C 11 177.279 177.279 177.152 0.127 18852
340 1 3 . 1 1 11 11 ASN CA C 11 55.979 55.979 55.385 0.595 18852
341 1 3 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.273 -0.290 18852
342 1 3 . 1 1 11 11 ASN H H 11 8.551 8.551 8.297 0.254 18852
343 1 3 . 1 1 12 12 ARG N N 12 120.917 120.917 120.913 0.004 18852
344 1 3 . 1 1 12 12 ARG HA H 12 4.079 4.079 4.004 0.075 18852
345 1 3 . 1 1 12 12 ARG C C 12 178.488 178.488 177.876 0.612 18852
346 1 3 . 1 1 12 12 ARG CA C 12 59.787 59.787 58.925 0.862 18852
347 1 3 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.439 -0.502 18852
348 1 3 . 1 1 12 12 ARG H H 12 8.253 8.253 8.139 0.115 18852
349 1 3 . 1 1 13 13 ARG N N 13 119.263 119.263 117.302 1.961 18852
350 1 3 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.327 -0.138 18852
351 1 3 . 1 1 13 13 ARG C C 13 178.479 178.479 178.476 0.003 18852
352 1 3 . 1 1 13 13 ARG CA C 13 59.572 59.572 58.649 0.923 18852
353 1 3 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.738 0.329 18852
354 1 3 . 1 1 13 13 ARG H H 13 8.167 8.167 7.561 0.606 18852
355 1 3 . 1 1 14 14 ARG N N 14 119.756 119.756 120.294 -0.538 18852
356 1 3 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.029 0.112 18852
357 1 3 . 1 1 14 14 ARG C C 14 178.817 178.817 178.523 0.294 18852
358 1 3 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.460 0.235 18852
359 1 3 . 1 1 14 14 ARG CB C 14 29.812 29.812 29.873 -0.061 18852
360 1 3 . 1 1 14 14 ARG H H 14 8.285 8.285 7.785 0.500 18852
361 1 3 . 1 1 15 15 ARG N N 15 119.026 119.026 119.022 0.004 18852
362 1 3 . 1 1 15 15 ARG HA H 15 4.158 4.158 3.941 0.217 18852
363 1 3 . 1 1 15 15 ARG C C 15 178.909 178.909 178.629 0.280 18852
364 1 3 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.130 0.103 18852
365 1 3 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.250 0.522 18852
366 1 3 . 1 1 15 15 ARG H H 15 8.278 8.278 7.537 0.741 18852
367 1 3 . 1 1 16 16 TRP N N 16 121.055 121.055 119.816 1.239 18852
368 1 3 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.374 0.015 18852
369 1 3 . 1 1 16 16 TRP C C 16 178.621 178.621 178.807 -0.186 18852
370 1 3 . 1 1 16 16 TRP CA C 16 61.013 61.013 58.933 2.080 18852
371 1 3 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.022 -0.226 18852
372 1 3 . 1 1 16 16 TRP H H 16 8.464 8.464 7.376 1.088 18852
373 1 3 . 1 1 17 17 ARG N N 17 119.474 119.474 118.985 0.489 18852
374 1 3 . 1 1 17 17 ARG HA H 17 3.910 3.910 4.024 -0.114 18852
375 1 3 . 1 1 17 17 ARG C C 17 179.120 179.120 178.784 0.336 18852
376 1 3 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.915 0.712 18852
377 1 3 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.729 0.178 18852
378 1 3 . 1 1 17 17 ARG H H 17 8.537 8.537 7.664 0.873 18852
379 1 3 . 1 1 18 18 GLU N N 18 119.223 119.223 118.457 0.766 18852
380 1 3 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.088 -0.027 18852
381 1 3 . 1 1 18 18 GLU C C 18 179.163 179.163 179.002 0.161 18852
382 1 3 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.955 0.183 18852
383 1 3 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.536 -0.401 18852
384 1 3 . 1 1 18 18 GLU H H 18 8.346 8.346 8.434 -0.088 18852
385 1 3 . 1 1 19 19 ARG N N 19 119.942 119.942 119.088 0.854 18852
386 1 3 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.105 -0.059 18852
387 1 3 . 1 1 19 19 ARG C C 19 178.634 178.634 179.147 -0.513 18852
388 1 3 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.775 0.241 18852
389 1 3 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.332 -0.961 18852
390 1 3 . 1 1 19 19 ARG H H 19 8.104 8.104 7.852 0.252 18852
391 1 3 . 1 1 20 20 GLN N N 20 118.373 118.373 118.745 -0.372 18852
392 1 3 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.206 -0.314 18852
393 1 3 . 1 1 20 20 GLN C C 20 178.465 178.465 177.378 1.087 18852
394 1 3 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.314 -0.144 18852
395 1 3 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.578 -0.465 18852
396 1 3 . 1 1 20 20 GLN H H 20 8.044 8.044 7.786 0.258 18852
397 1 3 . 1 1 21 21 ARG N N 21 119.374 119.374 119.713 -0.339 18852
398 1 3 . 1 1 21 21 ARG HA H 21 4.034 4.034 4.041 -0.007 18852
399 1 3 . 1 1 21 21 ARG C C 21 178.423 178.423 178.178 0.245 18852
400 1 3 . 1 1 21 21 ARG CA C 21 58.765 58.765 59.129 -0.364 18852
401 1 3 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.999 -0.323 18852
402 1 3 . 1 1 21 21 ARG H H 21 8.079 8.079 7.629 0.450 18852
403 1 3 . 1 1 22 22 ALA N N 22 121.393 121.393 120.256 1.137 18852
404 1 3 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.157 -0.011 18852
405 1 3 . 1 1 22 22 ALA C C 22 179.577 179.577 178.281 1.296 18852
406 1 3 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.790 -0.523 18852
407 1 3 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.504 -0.673 18852
408 1 3 . 1 1 22 22 ALA H H 22 8.026 8.026 7.519 0.507 18852
409 1 3 . 1 1 23 23 ALA N N 23 119.867 119.867 120.743 -0.876 18852
410 1 3 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.254 -0.096 18852
411 1 3 . 1 1 23 23 ALA C C 23 178.616 178.616 179.482 -0.866 18852
412 1 3 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.868 -0.154 18852
413 1 3 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.844 -0.799 18852
414 1 3 . 1 1 23 23 ALA H H 23 7.938 7.938 7.629 0.309 18852
415 1 3 . 1 1 24 24 ALA N N 24 119.652 119.652 121.320 -1.668 18852
416 1 3 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.148 0.143 18852
417 1 3 . 1 1 24 24 ALA C C 24 177.528 177.528 177.628 -0.100 18852
418 1 3 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.516 -0.810 18852
419 1 3 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.291 -0.700 18852
420 1 3 . 1 1 24 24 ALA H H 24 7.693 7.693 8.444 -0.751 18852
421 1 3 . 1 1 25 25 ALA N N 25 121.574 121.574 120.762 0.812 18852
422 1 3 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.563 -0.234 18852
423 1 3 . 1 1 25 25 ALA C C 25 176.649 176.649 175.877 0.772 18852
424 1 3 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.895 1.671 18852
425 1 3 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.258 -1.627 18852
426 1 3 . 1 1 25 25 ALA H H 25 7.679 7.679 7.719 -0.040 18852
427 1 4 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.211 0.028 18852
428 1 4 . 1 1 2 2 ALA C C 2 179.180 179.180 179.366 -0.186 18852
429 1 4 . 1 1 2 2 ALA CA C 2 54.532 54.532 54.013 0.519 18852
430 1 4 . 1 1 2 2 ALA CB C 2 18.397 18.397 18.937 -0.540 18852
431 1 4 . 1 1 3 3 MET N N 3 117.814 117.814 118.344 -0.530 18852
432 1 4 . 1 1 3 3 MET HA H 3 4.354 4.354 4.229 0.125 18852
433 1 4 . 1 1 3 3 MET C C 3 177.926 177.926 177.790 0.136 18852
434 1 4 . 1 1 3 3 MET CA C 3 57.876 57.876 57.770 0.106 18852
435 1 4 . 1 1 3 3 MET CB C 3 31.673 31.673 31.933 -0.260 18852
436 1 4 . 1 1 3 3 MET H H 3 8.613 8.613 8.156 0.457 18852
437 1 4 . 1 1 4 4 ALA N N 4 122.603 122.603 120.092 2.511 18852
438 1 4 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.002 0.226 18852
439 1 4 . 1 1 4 4 ALA C C 4 179.940 179.940 179.481 0.459 18852
440 1 4 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.070 -0.381 18852
441 1 4 . 1 1 4 4 ALA CB C 4 18.025 18.025 18.223 -0.198 18852
442 1 4 . 1 1 4 4 ALA H H 4 8.324 8.324 7.761 0.563 18852
443 1 4 . 1 1 5 5 THR N N 5 112.671 112.671 113.840 -1.169 18852
444 1 4 . 1 1 5 5 THR HA H 5 4.121 4.121 3.904 0.217 18852
445 1 4 . 1 1 5 5 THR C C 5 176.085 176.085 176.381 -0.296 18852
446 1 4 . 1 1 5 5 THR CA C 5 65.053 65.053 66.204 -1.151 18852
447 1 4 . 1 1 5 5 THR CB C 5 68.989 68.989 68.501 0.488 18852
448 1 4 . 1 1 5 5 THR H H 5 7.966 7.966 7.749 0.217 18852
449 1 4 . 1 1 6 6 ARG N N 6 122.300 122.300 120.908 1.392 18852
450 1 4 . 1 1 6 6 ARG HA H 6 4.057 4.057 3.996 0.061 18852
451 1 4 . 1 1 6 6 ARG C C 6 178.983 178.983 178.997 -0.014 18852
452 1 4 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.221 0.742 18852
453 1 4 . 1 1 6 6 ARG CB C 6 29.853 29.853 29.810 0.043 18852
454 1 4 . 1 1 6 6 ARG H H 6 8.244 8.244 7.603 0.641 18852
455 1 4 . 1 1 7 7 GLN N N 7 118.940 118.940 118.664 0.276 18852
456 1 4 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.167 -0.109 18852
457 1 4 . 1 1 7 7 GLN C C 7 177.997 177.997 177.956 0.041 18852
458 1 4 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.235 0.500 18852
459 1 4 . 1 1 7 7 GLN CB C 7 28.188 28.188 27.855 0.334 18852
460 1 4 . 1 1 7 7 GLN H H 7 8.424 8.424 8.232 0.192 18852
461 1 4 . 1 1 8 8 ALA N N 8 122.920 122.920 122.854 0.066 18852
462 1 4 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.003 0.214 18852
463 1 4 . 1 1 8 8 ALA C C 8 180.837 180.837 179.197 1.640 18852
464 1 4 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.762 0.557 18852
465 1 4 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.255 -0.560 18852
466 1 4 . 1 1 8 8 ALA H H 8 8.306 8.306 7.837 0.469 18852
467 1 4 . 1 1 9 9 ARG N N 9 118.721 118.721 118.229 0.492 18852
468 1 4 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.037 0.013 18852
469 1 4 . 1 1 9 9 ARG C C 9 178.843 178.843 178.601 0.242 18852
470 1 4 . 1 1 9 9 ARG CA C 9 59.721 59.721 58.587 1.134 18852
471 1 4 . 1 1 9 9 ARG CB C 9 30.168 30.168 30.104 0.064 18852
472 1 4 . 1 1 9 9 ARG H H 9 8.263 8.263 7.631 0.632 18852
473 1 4 . 1 1 10 10 ARG N N 10 120.338 120.338 118.928 1.410 18852
474 1 4 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.213 -0.139 18852
475 1 4 . 1 1 10 10 ARG C C 10 179.024 179.024 178.583 0.441 18852
476 1 4 . 1 1 10 10 ARG CA C 10 59.542 59.542 58.474 1.068 18852
477 1 4 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.866 0.038 18852
478 1 4 . 1 1 10 10 ARG H H 10 8.251 8.251 8.075 0.176 18852
479 1 4 . 1 1 11 11 ASN N N 11 118.863 118.863 118.958 -0.095 18852
480 1 4 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.378 0.165 18852
481 1 4 . 1 1 11 11 ASN C C 11 177.279 177.279 177.528 -0.249 18852
482 1 4 . 1 1 11 11 ASN CA C 11 55.979 55.979 56.548 -0.569 18852
483 1 4 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.419 -0.436 18852
484 1 4 . 1 1 11 11 ASN H H 11 8.551 8.551 7.722 0.829 18852
485 1 4 . 1 1 12 12 ARG N N 12 120.917 120.917 120.198 0.719 18852
486 1 4 . 1 1 12 12 ARG HA H 12 4.079 4.079 4.054 0.025 18852
487 1 4 . 1 1 12 12 ARG C C 12 178.488 178.488 178.642 -0.154 18852
488 1 4 . 1 1 12 12 ARG CA C 12 59.787 59.787 58.834 0.953 18852
489 1 4 . 1 1 12 12 ARG CB C 12 29.937 29.937 29.939 -0.002 18852
490 1 4 . 1 1 12 12 ARG H H 12 8.253 8.253 7.950 0.303 18852
491 1 4 . 1 1 13 13 ARG N N 13 119.263 119.263 119.086 0.177 18852
492 1 4 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.303 -0.114 18852
493 1 4 . 1 1 13 13 ARG C C 13 178.479 178.479 179.078 -0.599 18852
494 1 4 . 1 1 13 13 ARG CA C 13 59.572 59.572 59.376 0.196 18852
495 1 4 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.973 0.094 18852
496 1 4 . 1 1 13 13 ARG H H 13 8.167 8.167 7.764 0.403 18852
497 1 4 . 1 1 14 14 ARG N N 14 119.756 119.756 119.712 0.044 18852
498 1 4 . 1 1 14 14 ARG HA H 14 4.141 4.141 3.996 0.145 18852
499 1 4 . 1 1 14 14 ARG C C 14 178.817 178.817 178.737 0.080 18852
500 1 4 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.770 -0.075 18852
501 1 4 . 1 1 14 14 ARG CB C 14 29.812 29.812 30.053 -0.241 18852
502 1 4 . 1 1 14 14 ARG H H 14 8.285 8.285 7.919 0.366 18852
503 1 4 . 1 1 15 15 ARG N N 15 119.026 119.026 118.641 0.385 18852
504 1 4 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.132 0.026 18852
505 1 4 . 1 1 15 15 ARG C C 15 178.909 178.909 178.782 0.127 18852
506 1 4 . 1 1 15 15 ARG CA C 15 59.233 59.233 58.821 0.413 18852
507 1 4 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.541 0.231 18852
508 1 4 . 1 1 15 15 ARG H H 15 8.278 8.278 7.958 0.320 18852
509 1 4 . 1 1 16 16 TRP N N 16 121.055 121.055 122.379 -1.324 18852
510 1 4 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.507 -0.118 18852
511 1 4 . 1 1 16 16 TRP C C 16 178.621 178.621 178.094 0.527 18852
512 1 4 . 1 1 16 16 TRP CA C 16 61.013 61.013 59.748 1.265 18852
513 1 4 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.318 -0.522 18852
514 1 4 . 1 1 16 16 TRP H H 16 8.464 8.464 8.043 0.421 18852
515 1 4 . 1 1 17 17 ARG N N 17 119.474 119.474 119.683 -0.209 18852
516 1 4 . 1 1 17 17 ARG HA H 17 3.910 3.910 4.009 -0.099 18852
517 1 4 . 1 1 17 17 ARG C C 17 179.120 179.120 178.499 0.621 18852
518 1 4 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.652 0.975 18852
519 1 4 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.753 0.154 18852
520 1 4 . 1 1 17 17 ARG H H 17 8.537 8.537 7.760 0.777 18852
521 1 4 . 1 1 18 18 GLU N N 18 119.223 119.223 118.293 0.930 18852
522 1 4 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.050 0.011 18852
523 1 4 . 1 1 18 18 GLU C C 18 179.163 179.163 178.998 0.165 18852
524 1 4 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.832 0.306 18852
525 1 4 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.278 -0.143 18852
526 1 4 . 1 1 18 18 GLU H H 18 8.346 8.346 7.747 0.599 18852
527 1 4 . 1 1 19 19 ARG N N 19 119.942 119.942 119.134 0.808 18852
528 1 4 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.233 -0.187 18852
529 1 4 . 1 1 19 19 ARG C C 19 178.634 178.634 178.883 -0.249 18852
530 1 4 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.217 0.799 18852
531 1 4 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.354 -0.983 18852
532 1 4 . 1 1 19 19 ARG H H 19 8.104 8.104 7.813 0.291 18852
533 1 4 . 1 1 20 20 GLN N N 20 118.373 118.373 120.050 -1.677 18852
534 1 4 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.001 -0.109 18852
535 1 4 . 1 1 20 20 GLN C C 20 178.465 178.465 177.930 0.535 18852
536 1 4 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.526 -0.356 18852
537 1 4 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.338 -0.225 18852
538 1 4 . 1 1 20 20 GLN H H 20 8.044 8.044 7.729 0.315 18852
539 1 4 . 1 1 21 21 ARG N N 21 119.374 119.374 119.490 -0.116 18852
540 1 4 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.984 0.050 18852
541 1 4 . 1 1 21 21 ARG C C 21 178.423 178.423 178.295 0.128 18852
542 1 4 . 1 1 21 21 ARG CA C 21 58.765 58.765 58.899 -0.134 18852
543 1 4 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.916 -0.240 18852
544 1 4 . 1 1 21 21 ARG H H 21 8.079 8.079 8.317 -0.238 18852
545 1 4 . 1 1 22 22 ALA N N 22 121.393 121.393 120.359 1.034 18852
546 1 4 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.077 0.069 18852
547 1 4 . 1 1 22 22 ALA C C 22 179.577 179.577 178.387 1.190 18852
548 1 4 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.968 -0.701 18852
549 1 4 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.435 -0.604 18852
550 1 4 . 1 1 22 22 ALA H H 22 8.026 8.026 7.499 0.527 18852
551 1 4 . 1 1 23 23 ALA N N 23 119.867 119.867 120.456 -0.589 18852
552 1 4 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.235 -0.077 18852
553 1 4 . 1 1 23 23 ALA C C 23 178.616 178.616 179.507 -0.891 18852
554 1 4 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.745 -0.031 18852
555 1 4 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.790 -0.745 18852
556 1 4 . 1 1 23 23 ALA H H 23 7.938 7.938 7.556 0.382 18852
557 1 4 . 1 1 24 24 ALA N N 24 119.652 119.652 121.168 -1.516 18852
558 1 4 . 1 1 24 24 ALA HA H 24 4.291 4.291 3.982 0.309 18852
559 1 4 . 1 1 24 24 ALA C C 24 177.528 177.528 177.242 0.286 18852
560 1 4 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.819 -1.113 18852
561 1 4 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.170 -0.579 18852
562 1 4 . 1 1 24 24 ALA H H 24 7.693 7.693 8.313 -0.620 18852
563 1 4 . 1 1 25 25 ALA N N 25 121.574 121.574 120.325 1.249 18852
564 1 4 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.554 -0.225 18852
565 1 4 . 1 1 25 25 ALA C C 25 176.649 176.649 175.796 0.853 18852
566 1 4 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.892 1.674 18852
567 1 4 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.573 -1.942 18852
568 1 4 . 1 1 25 25 ALA H H 25 7.679 7.679 7.679 0.000 18852
569 1 5 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.126 0.113 18852
570 1 5 . 1 1 2 2 ALA C C 2 179.180 179.180 179.653 -0.473 18852
571 1 5 . 1 1 2 2 ALA CA C 2 54.532 54.532 54.281 0.252 18852
572 1 5 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.474 -1.077 18852
573 1 5 . 1 1 3 3 MET N N 3 117.814 117.814 118.741 -0.927 18852
574 1 5 . 1 1 3 3 MET HA H 3 4.354 4.354 4.162 0.192 18852
575 1 5 . 1 1 3 3 MET C C 3 177.926 177.926 177.599 0.327 18852
576 1 5 . 1 1 3 3 MET CA C 3 57.876 57.876 58.273 -0.397 18852
577 1 5 . 1 1 3 3 MET CB C 3 31.673 31.673 32.349 -0.676 18852
578 1 5 . 1 1 3 3 MET H H 3 8.613 8.613 8.264 0.349 18852
579 1 5 . 1 1 4 4 ALA N N 4 122.603 122.603 119.114 3.489 18852
580 1 5 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.142 0.086 18852
581 1 5 . 1 1 4 4 ALA C C 4 179.940 179.940 179.410 0.530 18852
582 1 5 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.031 -0.342 18852
583 1 5 . 1 1 4 4 ALA CB C 4 18.025 18.025 18.056 -0.031 18852
584 1 5 . 1 1 4 4 ALA H H 4 8.324 8.324 8.344 -0.020 18852
585 1 5 . 1 1 5 5 THR N N 5 112.671 112.671 115.519 -2.848 18852
586 1 5 . 1 1 5 5 THR HA H 5 4.121 4.121 3.926 0.195 18852
587 1 5 . 1 1 5 5 THR C C 5 176.085 176.085 176.579 -0.494 18852
588 1 5 . 1 1 5 5 THR CA C 5 65.053 65.053 67.111 -2.058 18852
589 1 5 . 1 1 5 5 THR CB C 5 68.989 68.989 68.550 0.439 18852
590 1 5 . 1 1 5 5 THR H H 5 7.966 7.966 7.653 0.313 18852
591 1 5 . 1 1 6 6 ARG N N 6 122.300 122.300 121.365 0.935 18852
592 1 5 . 1 1 6 6 ARG HA H 6 4.057 4.057 4.014 0.043 18852
593 1 5 . 1 1 6 6 ARG C C 6 178.983 178.983 178.780 0.203 18852
594 1 5 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.184 0.779 18852
595 1 5 . 1 1 6 6 ARG CB C 6 29.853 29.853 30.240 -0.387 18852
596 1 5 . 1 1 6 6 ARG H H 6 8.244 8.244 7.611 0.633 18852
597 1 5 . 1 1 7 7 GLN N N 7 118.940 118.940 118.856 0.084 18852
598 1 5 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.102 -0.044 18852
599 1 5 . 1 1 7 7 GLN C C 7 177.997 177.997 178.400 -0.403 18852
600 1 5 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.102 0.633 18852
601 1 5 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.152 0.036 18852
602 1 5 . 1 1 7 7 GLN H H 7 8.424 8.424 7.707 0.717 18852
603 1 5 . 1 1 8 8 ALA N N 8 122.920 122.920 123.476 -0.556 18852
604 1 5 . 1 1 8 8 ALA HA H 8 4.217 4.217 3.988 0.229 18852
605 1 5 . 1 1 8 8 ALA C C 8 180.837 180.837 179.292 1.545 18852
606 1 5 . 1 1 8 8 ALA CA C 8 55.319 55.319 55.171 0.148 18852
607 1 5 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.121 -0.426 18852
608 1 5 . 1 1 8 8 ALA H H 8 8.306 8.306 8.250 0.056 18852
609 1 5 . 1 1 9 9 ARG N N 9 118.721 118.721 117.068 1.653 18852
610 1 5 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.038 0.012 18852
611 1 5 . 1 1 9 9 ARG C C 9 178.843 178.843 178.966 -0.123 18852
612 1 5 . 1 1 9 9 ARG CA C 9 59.721 59.721 58.480 1.242 18852
613 1 5 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.827 0.341 18852
614 1 5 . 1 1 9 9 ARG H H 9 8.263 8.263 7.757 0.506 18852
615 1 5 . 1 1 10 10 ARG N N 10 120.338 120.338 118.446 1.892 18852
616 1 5 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.279 -0.205 18852
617 1 5 . 1 1 10 10 ARG C C 10 179.024 179.024 178.193 0.831 18852
618 1 5 . 1 1 10 10 ARG CA C 10 59.542 59.542 58.195 1.347 18852
619 1 5 . 1 1 10 10 ARG CB C 10 29.904 29.904 30.196 -0.292 18852
620 1 5 . 1 1 10 10 ARG H H 10 8.251 8.251 8.097 0.154 18852
621 1 5 . 1 1 11 11 ASN N N 11 118.863 118.863 119.296 -0.433 18852
622 1 5 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.508 0.035 18852
623 1 5 . 1 1 11 11 ASN C C 11 177.279 177.279 177.416 -0.137 18852
624 1 5 . 1 1 11 11 ASN CA C 11 55.979 55.979 56.352 -0.373 18852
625 1 5 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.382 -0.399 18852
626 1 5 . 1 1 11 11 ASN H H 11 8.551 8.551 7.969 0.582 18852
627 1 5 . 1 1 12 12 ARG N N 12 120.917 120.917 119.464 1.453 18852
628 1 5 . 1 1 12 12 ARG HA H 12 4.079 4.079 4.021 0.058 18852
629 1 5 . 1 1 12 12 ARG C C 12 178.488 178.488 178.490 -0.002 18852
630 1 5 . 1 1 12 12 ARG CA C 12 59.787 59.787 59.100 0.687 18852
631 1 5 . 1 1 12 12 ARG CB C 12 29.937 29.937 29.443 0.494 18852
632 1 5 . 1 1 12 12 ARG H H 12 8.253 8.253 8.113 0.140 18852
633 1 5 . 1 1 13 13 ARG N N 13 119.263 119.263 118.023 1.240 18852
634 1 5 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.278 -0.089 18852
635 1 5 . 1 1 13 13 ARG C C 13 178.479 178.479 178.673 -0.194 18852
636 1 5 . 1 1 13 13 ARG CA C 13 59.572 59.572 58.536 1.036 18852
637 1 5 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.728 0.339 18852
638 1 5 . 1 1 13 13 ARG H H 13 8.167 8.167 7.858 0.309 18852
639 1 5 . 1 1 14 14 ARG N N 14 119.756 119.756 120.929 -1.173 18852
640 1 5 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.017 0.124 18852
641 1 5 . 1 1 14 14 ARG C C 14 178.817 178.817 178.594 0.223 18852
642 1 5 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.643 0.052 18852
643 1 5 . 1 1 14 14 ARG CB C 14 29.812 29.812 29.920 -0.108 18852
644 1 5 . 1 1 14 14 ARG H H 14 8.285 8.285 7.950 0.335 18852
645 1 5 . 1 1 15 15 ARG N N 15 119.026 119.026 119.229 -0.203 18852
646 1 5 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.034 0.124 18852
647 1 5 . 1 1 15 15 ARG C C 15 178.909 178.909 178.625 0.284 18852
648 1 5 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.236 -0.003 18852
649 1 5 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.730 0.042 18852
650 1 5 . 1 1 15 15 ARG H H 15 8.278 8.278 7.984 0.294 18852
651 1 5 . 1 1 16 16 TRP N N 16 121.055 121.055 120.520 0.535 18852
652 1 5 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.334 0.055 18852
653 1 5 . 1 1 16 16 TRP C C 16 178.621 178.621 178.360 0.261 18852
654 1 5 . 1 1 16 16 TRP CA C 16 61.013 61.013 61.082 -0.069 18852
655 1 5 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.243 -0.447 18852
656 1 5 . 1 1 16 16 TRP H H 16 8.464 8.464 7.697 0.767 18852
657 1 5 . 1 1 17 17 ARG N N 17 119.474 119.474 119.233 0.241 18852
658 1 5 . 1 1 17 17 ARG HA H 17 3.910 3.910 3.650 0.260 18852
659 1 5 . 1 1 17 17 ARG C C 17 179.120 179.120 178.396 0.724 18852
660 1 5 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.948 0.679 18852
661 1 5 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.721 0.186 18852
662 1 5 . 1 1 17 17 ARG H H 17 8.537 8.537 7.891 0.646 18852
663 1 5 . 1 1 18 18 GLU N N 18 119.223 119.223 118.093 1.130 18852
664 1 5 . 1 1 18 18 GLU HA H 18 4.061 4.061 3.990 0.071 18852
665 1 5 . 1 1 18 18 GLU C C 18 179.163 179.163 178.930 0.233 18852
666 1 5 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.776 0.361 18852
667 1 5 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.159 -0.024 18852
668 1 5 . 1 1 18 18 GLU H H 18 8.346 8.346 7.859 0.487 18852
669 1 5 . 1 1 19 19 ARG N N 19 119.942 119.942 118.982 0.960 18852
670 1 5 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.191 -0.145 18852
671 1 5 . 1 1 19 19 ARG C C 19 178.634 178.634 178.771 -0.137 18852
672 1 5 . 1 1 19 19 ARG CA C 19 59.016 59.016 57.730 1.286 18852
673 1 5 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.139 -0.768 18852
674 1 5 . 1 1 19 19 ARG H H 19 8.104 8.104 8.078 0.026 18852
675 1 5 . 1 1 20 20 GLN N N 20 118.373 118.373 119.944 -1.571 18852
676 1 5 . 1 1 20 20 GLN HA H 20 3.892 3.892 3.926 -0.034 18852
677 1 5 . 1 1 20 20 GLN C C 20 178.465 178.465 177.775 0.690 18852
678 1 5 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.500 -0.330 18852
679 1 5 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.127 -0.014 18852
680 1 5 . 1 1 20 20 GLN H H 20 8.044 8.044 7.705 0.339 18852
681 1 5 . 1 1 21 21 ARG N N 21 119.374 119.374 119.558 -0.184 18852
682 1 5 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.936 0.098 18852
683 1 5 . 1 1 21 21 ARG C C 21 178.423 178.423 178.367 0.056 18852
684 1 5 . 1 1 21 21 ARG CA C 21 58.765 58.765 59.122 -0.357 18852
685 1 5 . 1 1 21 21 ARG CB C 21 29.676 29.676 30.057 -0.381 18852
686 1 5 . 1 1 21 21 ARG H H 21 8.079 8.079 7.701 0.378 18852
687 1 5 . 1 1 22 22 ALA N N 22 121.393 121.393 120.464 0.929 18852
688 1 5 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.107 0.039 18852
689 1 5 . 1 1 22 22 ALA C C 22 179.577 179.577 178.440 1.137 18852
690 1 5 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.886 -0.619 18852
691 1 5 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.415 -0.584 18852
692 1 5 . 1 1 22 22 ALA H H 22 8.026 8.026 7.497 0.529 18852
693 1 5 . 1 1 23 23 ALA N N 23 119.867 119.867 120.894 -1.027 18852
694 1 5 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.331 -0.173 18852
695 1 5 . 1 1 23 23 ALA C C 23 178.616 178.616 179.223 -0.607 18852
696 1 5 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.591 0.123 18852
697 1 5 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.510 -0.465 18852
698 1 5 . 1 1 23 23 ALA H H 23 7.938 7.938 7.491 0.447 18852
699 1 5 . 1 1 24 24 ALA N N 24 119.652 119.652 121.632 -1.980 18852
700 1 5 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.061 0.230 18852
701 1 5 . 1 1 24 24 ALA C C 24 177.528 177.528 177.443 0.085 18852
702 1 5 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.997 -1.291 18852
703 1 5 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.287 -0.696 18852
704 1 5 . 1 1 24 24 ALA H H 24 7.693 7.693 8.138 -0.445 18852
705 1 5 . 1 1 25 25 ALA N N 25 121.574 121.574 120.975 0.599 18852
706 1 5 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.569 -0.240 18852
707 1 5 . 1 1 25 25 ALA C C 25 176.649 176.649 175.838 0.811 18852
708 1 5 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.816 1.750 18852
709 1 5 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.224 -1.594 18852
710 1 5 . 1 1 25 25 ALA H H 25 7.679 7.679 7.649 0.030 18852
711 1 6 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.050 0.189 18852
712 1 6 . 1 1 2 2 ALA C C 2 179.180 179.180 179.199 -0.019 18852
713 1 6 . 1 1 2 2 ALA CA C 2 54.532 54.532 54.478 0.054 18852
714 1 6 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.124 -0.727 18852
715 1 6 . 1 1 3 3 MET N N 3 117.814 117.814 116.647 1.167 18852
716 1 6 . 1 1 3 3 MET HA H 3 4.354 4.354 4.027 0.327 18852
717 1 6 . 1 1 3 3 MET C C 3 177.926 177.926 177.800 0.126 18852
718 1 6 . 1 1 3 3 MET CA C 3 57.876 57.876 58.002 -0.126 18852
719 1 6 . 1 1 3 3 MET CB C 3 31.673 31.673 31.705 -0.032 18852
720 1 6 . 1 1 3 3 MET H H 3 8.613 8.613 8.098 0.515 18852
721 1 6 . 1 1 4 4 ALA N N 4 122.603 122.603 122.234 0.369 18852
722 1 6 . 1 1 4 4 ALA HA H 4 4.228 4.228 3.949 0.279 18852
723 1 6 . 1 1 4 4 ALA C C 4 179.940 179.940 179.399 0.541 18852
724 1 6 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.370 -0.680 18852
725 1 6 . 1 1 4 4 ALA CB C 4 18.025 18.025 17.977 0.048 18852
726 1 6 . 1 1 4 4 ALA H H 4 8.324 8.324 8.382 -0.058 18852
727 1 6 . 1 1 5 5 THR N N 5 112.671 112.671 112.204 0.467 18852
728 1 6 . 1 1 5 5 THR HA H 5 4.121 4.121 3.965 0.156 18852
729 1 6 . 1 1 5 5 THR C C 5 176.085 176.085 176.663 -0.578 18852
730 1 6 . 1 1 5 5 THR CA C 5 65.053 65.053 65.359 -0.306 18852
731 1 6 . 1 1 5 5 THR CB C 5 68.989 68.989 68.362 0.627 18852
732 1 6 . 1 1 5 5 THR H H 5 7.966 7.966 7.731 0.235 18852
733 1 6 . 1 1 6 6 ARG N N 6 122.300 122.300 122.031 0.269 18852
734 1 6 . 1 1 6 6 ARG HA H 6 4.057 4.057 3.866 0.191 18852
735 1 6 . 1 1 6 6 ARG C C 6 178.983 178.983 178.629 0.354 18852
736 1 6 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.615 0.347 18852
737 1 6 . 1 1 6 6 ARG CB C 6 29.853 29.853 30.149 -0.296 18852
738 1 6 . 1 1 6 6 ARG H H 6 8.244 8.244 7.403 0.841 18852
739 1 6 . 1 1 7 7 GLN N N 7 118.940 118.940 117.934 1.006 18852
740 1 6 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.115 -0.057 18852
741 1 6 . 1 1 7 7 GLN C C 7 177.997 177.997 177.993 0.004 18852
742 1 6 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.164 0.570 18852
743 1 6 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.472 -0.284 18852
744 1 6 . 1 1 7 7 GLN H H 7 8.424 8.424 7.711 0.713 18852
745 1 6 . 1 1 8 8 ALA N N 8 122.920 122.920 122.690 0.230 18852
746 1 6 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.036 0.181 18852
747 1 6 . 1 1 8 8 ALA C C 8 180.837 180.837 179.720 1.117 18852
748 1 6 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.747 0.572 18852
749 1 6 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.294 -0.599 18852
750 1 6 . 1 1 8 8 ALA H H 8 8.306 8.306 7.732 0.574 18852
751 1 6 . 1 1 9 9 ARG N N 9 118.721 118.721 118.557 0.164 18852
752 1 6 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.075 -0.025 18852
753 1 6 . 1 1 9 9 ARG C C 9 178.843 178.843 178.102 0.741 18852
754 1 6 . 1 1 9 9 ARG CA C 9 59.721 59.721 58.461 1.260 18852
755 1 6 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.930 0.237 18852
756 1 6 . 1 1 9 9 ARG H H 9 8.263 8.263 7.970 0.293 18852
757 1 6 . 1 1 10 10 ARG N N 10 120.338 120.338 118.604 1.734 18852
758 1 6 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.091 -0.017 18852
759 1 6 . 1 1 10 10 ARG C C 10 179.024 179.024 178.391 0.633 18852
760 1 6 . 1 1 10 10 ARG CA C 10 59.542 59.542 59.081 0.461 18852
761 1 6 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.927 -0.024 18852
762 1 6 . 1 1 10 10 ARG H H 10 8.251 8.251 7.640 0.611 18852
763 1 6 . 1 1 11 11 ASN N N 11 118.863 118.863 117.728 1.135 18852
764 1 6 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.611 -0.068 18852
765 1 6 . 1 1 11 11 ASN C C 11 177.279 177.279 177.196 0.083 18852
766 1 6 . 1 1 11 11 ASN CA C 11 55.979 55.979 55.213 0.766 18852
767 1 6 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.182 -0.199 18852
768 1 6 . 1 1 11 11 ASN H H 11 8.551 8.551 7.679 0.872 18852
769 1 6 . 1 1 12 12 ARG N N 12 120.917 120.917 121.745 -0.828 18852
770 1 6 . 1 1 12 12 ARG HA H 12 4.079 4.079 3.931 0.148 18852
771 1 6 . 1 1 12 12 ARG C C 12 178.488 178.488 178.399 0.089 18852
772 1 6 . 1 1 12 12 ARG CA C 12 59.787 59.787 59.887 -0.100 18852
773 1 6 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.315 -0.378 18852
774 1 6 . 1 1 12 12 ARG H H 12 8.253 8.253 8.341 -0.087 18852
775 1 6 . 1 1 13 13 ARG N N 13 119.263 119.263 116.656 2.607 18852
776 1 6 . 1 1 13 13 ARG HA H 13 4.189 4.189 3.747 0.442 18852
777 1 6 . 1 1 13 13 ARG C C 13 178.479 178.479 178.798 -0.319 18852
778 1 6 . 1 1 13 13 ARG CA C 13 59.572 59.572 58.403 1.169 18852
779 1 6 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.309 0.758 18852
780 1 6 . 1 1 13 13 ARG H H 13 8.167 8.167 7.504 0.663 18852
781 1 6 . 1 1 14 14 ARG N N 14 119.756 119.756 120.313 -0.557 18852
782 1 6 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.040 0.101 18852
783 1 6 . 1 1 14 14 ARG C C 14 178.817 178.817 178.385 0.432 18852
784 1 6 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.143 0.552 18852
785 1 6 . 1 1 14 14 ARG CB C 14 29.812 29.812 29.799 0.014 18852
786 1 6 . 1 1 14 14 ARG H H 14 8.285 8.285 7.534 0.751 18852
787 1 6 . 1 1 15 15 ARG N N 15 119.026 119.026 120.325 -1.299 18852
788 1 6 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.086 0.072 18852
789 1 6 . 1 1 15 15 ARG C C 15 178.909 178.909 178.444 0.465 18852
790 1 6 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.647 -0.414 18852
791 1 6 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.727 0.045 18852
792 1 6 . 1 1 15 15 ARG H H 15 8.278 8.278 7.970 0.308 18852
793 1 6 . 1 1 16 16 TRP N N 16 121.055 121.055 119.512 1.543 18852
794 1 6 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.375 0.014 18852
795 1 6 . 1 1 16 16 TRP C C 16 178.621 178.621 178.871 -0.250 18852
796 1 6 . 1 1 16 16 TRP CA C 16 61.013 61.013 60.847 0.166 18852
797 1 6 . 1 1 16 16 TRP CB C 16 28.796 28.796 28.432 0.364 18852
798 1 6 . 1 1 16 16 TRP H H 16 8.464 8.464 8.007 0.457 18852
799 1 6 . 1 1 17 17 ARG N N 17 119.474 119.474 119.225 0.249 18852
800 1 6 . 1 1 17 17 ARG HA H 17 3.910 3.910 4.031 -0.121 18852
801 1 6 . 1 1 17 17 ARG C C 17 179.120 179.120 178.647 0.473 18852
802 1 6 . 1 1 17 17 ARG CA C 17 59.627 59.627 59.167 0.460 18852
803 1 6 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.589 0.318 18852
804 1 6 . 1 1 17 17 ARG H H 17 8.537 8.537 7.809 0.728 18852
805 1 6 . 1 1 18 18 GLU N N 18 119.223 119.223 118.614 0.609 18852
806 1 6 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.027 0.034 18852
807 1 6 . 1 1 18 18 GLU C C 18 179.163 179.163 179.223 -0.060 18852
808 1 6 . 1 1 18 18 GLU CA C 18 59.138 59.138 59.263 -0.125 18852
809 1 6 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.378 -0.243 18852
810 1 6 . 1 1 18 18 GLU H H 18 8.346 8.346 7.791 0.555 18852
811 1 6 . 1 1 19 19 ARG N N 19 119.942 119.942 118.829 1.113 18852
812 1 6 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.134 -0.088 18852
813 1 6 . 1 1 19 19 ARG C C 19 178.634 178.634 179.052 -0.418 18852
814 1 6 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.319 0.697 18852
815 1 6 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.272 -0.901 18852
816 1 6 . 1 1 19 19 ARG H H 19 8.104 8.104 8.374 -0.270 18852
817 1 6 . 1 1 20 20 GLN N N 20 118.373 118.373 119.945 -1.572 18852
818 1 6 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.033 -0.141 18852
819 1 6 . 1 1 20 20 GLN C C 20 178.465 178.465 178.033 0.432 18852
820 1 6 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.809 -0.639 18852
821 1 6 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.213 -0.100 18852
822 1 6 . 1 1 20 20 GLN H H 20 8.044 8.044 8.414 -0.370 18852
823 1 6 . 1 1 21 21 ARG N N 21 119.374 119.374 119.967 -0.593 18852
824 1 6 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.981 0.053 18852
825 1 6 . 1 1 21 21 ARG C C 21 178.423 178.423 178.495 -0.072 18852
826 1 6 . 1 1 21 21 ARG CA C 21 58.765 58.765 59.113 -0.348 18852
827 1 6 . 1 1 21 21 ARG CB C 21 29.676 29.676 30.117 -0.441 18852
828 1 6 . 1 1 21 21 ARG H H 21 8.079 8.079 7.977 0.102 18852
829 1 6 . 1 1 22 22 ALA N N 22 121.393 121.393 120.354 1.039 18852
830 1 6 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.162 -0.016 18852
831 1 6 . 1 1 22 22 ALA C C 22 179.577 179.577 178.263 1.314 18852
832 1 6 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.888 -0.621 18852
833 1 6 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.508 -0.676 18852
834 1 6 . 1 1 22 22 ALA H H 22 8.026 8.026 7.824 0.202 18852
835 1 6 . 1 1 23 23 ALA N N 23 119.867 119.867 120.667 -0.800 18852
836 1 6 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.325 -0.167 18852
837 1 6 . 1 1 23 23 ALA C C 23 178.616 178.616 179.538 -0.922 18852
838 1 6 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.849 -0.135 18852
839 1 6 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.565 -0.520 18852
840 1 6 . 1 1 23 23 ALA H H 23 7.938 7.938 7.533 0.405 18852
841 1 6 . 1 1 24 24 ALA N N 24 119.652 119.652 120.703 -1.051 18852
842 1 6 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.166 0.125 18852
843 1 6 . 1 1 24 24 ALA C C 24 177.528 177.528 177.677 -0.149 18852
844 1 6 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.951 -1.245 18852
845 1 6 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.302 -0.711 18852
846 1 6 . 1 1 24 24 ALA H H 24 7.693 7.693 8.312 -0.619 18852
847 1 6 . 1 1 25 25 ALA N N 25 121.574 121.574 121.164 0.410 18852
848 1 6 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.587 -0.258 18852
849 1 6 . 1 1 25 25 ALA C C 25 176.649 176.649 176.014 0.635 18852
850 1 6 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.757 1.809 18852
851 1 6 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.177 -1.547 18852
852 1 6 . 1 1 25 25 ALA H H 25 7.679 7.679 7.713 -0.034 18852
853 1 7 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.254 -0.015 18852
854 1 7 . 1 1 2 2 ALA C C 2 179.180 179.180 178.829 0.351 18852
855 1 7 . 1 1 2 2 ALA CA C 2 54.532 54.532 54.159 0.373 18852
856 1 7 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.112 -0.715 18852
857 1 7 . 1 1 3 3 MET N N 3 117.814 117.814 117.165 0.649 18852
858 1 7 . 1 1 3 3 MET HA H 3 4.354 4.354 4.478 -0.124 18852
859 1 7 . 1 1 3 3 MET C C 3 177.926 177.926 178.316 -0.390 18852
860 1 7 . 1 1 3 3 MET CA C 3 57.876 57.876 56.020 1.856 18852
861 1 7 . 1 1 3 3 MET CB C 3 31.673 31.673 32.138 -0.465 18852
862 1 7 . 1 1 3 3 MET H H 3 8.613 8.613 8.045 0.568 18852
863 1 7 . 1 1 4 4 ALA N N 4 122.603 122.603 122.830 -0.227 18852
864 1 7 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.059 0.169 18852
865 1 7 . 1 1 4 4 ALA C C 4 179.940 179.940 179.463 0.477 18852
866 1 7 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.177 -0.488 18852
867 1 7 . 1 1 4 4 ALA CB C 4 18.025 18.025 17.839 0.186 18852
868 1 7 . 1 1 4 4 ALA H H 4 8.324 8.324 8.203 0.121 18852
869 1 7 . 1 1 5 5 THR N N 5 112.671 112.671 113.324 -0.653 18852
870 1 7 . 1 1 5 5 THR HA H 5 4.121 4.121 3.942 0.179 18852
871 1 7 . 1 1 5 5 THR C C 5 176.085 176.085 176.446 -0.361 18852
872 1 7 . 1 1 5 5 THR CA C 5 65.053 65.053 65.487 -0.434 18852
873 1 7 . 1 1 5 5 THR CB C 5 68.989 68.989 68.851 0.138 18852
874 1 7 . 1 1 5 5 THR H H 5 7.966 7.966 7.861 0.105 18852
875 1 7 . 1 1 6 6 ARG N N 6 122.300 122.300 120.311 1.989 18852
876 1 7 . 1 1 6 6 ARG HA H 6 4.057 4.057 4.037 0.020 18852
877 1 7 . 1 1 6 6 ARG C C 6 178.983 178.983 178.810 0.173 18852
878 1 7 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.390 0.573 18852
879 1 7 . 1 1 6 6 ARG CB C 6 29.853 29.853 30.151 -0.298 18852
880 1 7 . 1 1 6 6 ARG H H 6 8.244 8.244 7.996 0.248 18852
881 1 7 . 1 1 7 7 GLN N N 7 118.940 118.940 119.241 -0.301 18852
882 1 7 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.075 -0.017 18852
883 1 7 . 1 1 7 7 GLN C C 7 177.997 177.997 177.933 0.064 18852
884 1 7 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.194 0.541 18852
885 1 7 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.128 0.060 18852
886 1 7 . 1 1 7 7 GLN H H 7 8.424 8.424 7.975 0.449 18852
887 1 7 . 1 1 8 8 ALA N N 8 122.920 122.920 122.353 0.567 18852
888 1 7 . 1 1 8 8 ALA HA H 8 4.217 4.217 3.986 0.231 18852
889 1 7 . 1 1 8 8 ALA C C 8 180.837 180.837 179.334 1.503 18852
890 1 7 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.994 0.325 18852
891 1 7 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.226 -0.531 18852
892 1 7 . 1 1 8 8 ALA H H 8 8.306 8.306 8.168 0.138 18852
893 1 7 . 1 1 9 9 ARG N N 9 118.721 118.721 118.153 0.568 18852
894 1 7 . 1 1 9 9 ARG HA H 9 4.050 4.050 3.989 0.061 18852
895 1 7 . 1 1 9 9 ARG C C 9 178.843 178.843 178.868 -0.025 18852
896 1 7 . 1 1 9 9 ARG CA C 9 59.721 59.721 59.749 -0.028 18852
897 1 7 . 1 1 9 9 ARG CB C 9 30.168 30.168 30.123 0.045 18852
898 1 7 . 1 1 9 9 ARG H H 9 8.263 8.263 7.757 0.506 18852
899 1 7 . 1 1 10 10 ARG N N 10 120.338 120.338 118.456 1.882 18852
900 1 7 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.115 -0.041 18852
901 1 7 . 1 1 10 10 ARG C C 10 179.024 179.024 178.718 0.306 18852
902 1 7 . 1 1 10 10 ARG CA C 10 59.542 59.542 58.773 0.770 18852
903 1 7 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.691 0.213 18852
904 1 7 . 1 1 10 10 ARG H H 10 8.251 8.251 7.664 0.587 18852
905 1 7 . 1 1 11 11 ASN N N 11 118.863 118.863 118.773 0.090 18852
906 1 7 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.454 0.089 18852
907 1 7 . 1 1 11 11 ASN C C 11 177.279 177.279 177.781 -0.502 18852
908 1 7 . 1 1 11 11 ASN CA C 11 55.979 55.979 56.168 -0.189 18852
909 1 7 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.164 -0.181 18852
910 1 7 . 1 1 11 11 ASN H H 11 8.551 8.551 7.919 0.632 18852
911 1 7 . 1 1 12 12 ARG N N 12 120.917 120.917 119.463 1.454 18852
912 1 7 . 1 1 12 12 ARG HA H 12 4.079 4.079 4.014 0.065 18852
913 1 7 . 1 1 12 12 ARG C C 12 178.488 178.488 178.805 -0.317 18852
914 1 7 . 1 1 12 12 ARG CA C 12 59.787 59.787 59.544 0.243 18852
915 1 7 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.149 -0.212 18852
916 1 7 . 1 1 12 12 ARG H H 12 8.253 8.253 8.410 -0.157 18852
917 1 7 . 1 1 13 13 ARG N N 13 119.263 119.263 118.270 0.993 18852
918 1 7 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.236 -0.047 18852
919 1 7 . 1 1 13 13 ARG C C 13 178.479 178.479 179.222 -0.743 18852
920 1 7 . 1 1 13 13 ARG CA C 13 59.572 59.572 58.346 1.226 18852
921 1 7 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.835 0.232 18852
922 1 7 . 1 1 13 13 ARG H H 13 8.167 8.167 7.801 0.366 18852
923 1 7 . 1 1 14 14 ARG N N 14 119.756 119.756 121.289 -1.533 18852
924 1 7 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.094 0.047 18852
925 1 7 . 1 1 14 14 ARG C C 14 178.817 178.817 178.114 0.703 18852
926 1 7 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.334 0.360 18852
927 1 7 . 1 1 14 14 ARG CB C 14 29.812 29.812 30.040 -0.228 18852
928 1 7 . 1 1 14 14 ARG H H 14 8.285 8.285 7.973 0.312 18852
929 1 7 . 1 1 15 15 ARG N N 15 119.026 119.026 119.275 -0.249 18852
930 1 7 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.012 0.146 18852
931 1 7 . 1 1 15 15 ARG C C 15 178.909 178.909 178.510 0.399 18852
932 1 7 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.418 -0.185 18852
933 1 7 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.968 -0.196 18852
934 1 7 . 1 1 15 15 ARG H H 15 8.278 8.278 7.968 0.310 18852
935 1 7 . 1 1 16 16 TRP N N 16 121.055 121.055 120.881 0.174 18852
936 1 7 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.373 0.016 18852
937 1 7 . 1 1 16 16 TRP C C 16 178.621 178.621 177.950 0.671 18852
938 1 7 . 1 1 16 16 TRP CA C 16 61.013 61.013 61.028 -0.015 18852
939 1 7 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.325 -0.529 18852
940 1 7 . 1 1 16 16 TRP H H 16 8.464 8.464 7.794 0.670 18852
941 1 7 . 1 1 17 17 ARG N N 17 119.474 119.474 119.087 0.387 18852
942 1 7 . 1 1 17 17 ARG HA H 17 3.910 3.910 3.491 0.419 18852
943 1 7 . 1 1 17 17 ARG C C 17 179.120 179.120 178.711 0.409 18852
944 1 7 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.733 0.894 18852
945 1 7 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.498 0.409 18852
946 1 7 . 1 1 17 17 ARG H H 17 8.537 8.537 7.638 0.899 18852
947 1 7 . 1 1 18 18 GLU N N 18 119.223 119.223 116.950 2.273 18852
948 1 7 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.080 -0.019 18852
949 1 7 . 1 1 18 18 GLU C C 18 179.163 179.163 179.289 -0.126 18852
950 1 7 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.708 0.430 18852
951 1 7 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.293 -0.158 18852
952 1 7 . 1 1 18 18 GLU H H 18 8.346 8.346 7.891 0.455 18852
953 1 7 . 1 1 19 19 ARG N N 19 119.942 119.942 119.676 0.266 18852
954 1 7 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.103 -0.057 18852
955 1 7 . 1 1 19 19 ARG C C 19 178.634 178.634 178.441 0.193 18852
956 1 7 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.751 0.265 18852
957 1 7 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.139 -0.768 18852
958 1 7 . 1 1 19 19 ARG H H 19 8.104 8.104 7.684 0.420 18852
959 1 7 . 1 1 20 20 GLN N N 20 118.373 118.373 118.818 -0.445 18852
960 1 7 . 1 1 20 20 GLN HA H 20 3.892 3.892 3.888 0.004 18852
961 1 7 . 1 1 20 20 GLN C C 20 178.465 178.465 177.380 1.085 18852
962 1 7 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.837 -0.667 18852
963 1 7 . 1 1 20 20 GLN CB C 20 28.113 28.113 27.935 0.178 18852
964 1 7 . 1 1 20 20 GLN H H 20 8.044 8.044 7.470 0.574 18852
965 1 7 . 1 1 21 21 ARG N N 21 119.374 119.374 119.818 -0.444 18852
966 1 7 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.931 0.103 18852
967 1 7 . 1 1 21 21 ARG C C 21 178.423 178.423 178.321 0.102 18852
968 1 7 . 1 1 21 21 ARG CA C 21 58.765 58.765 58.972 -0.207 18852
969 1 7 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.953 -0.277 18852
970 1 7 . 1 1 21 21 ARG H H 21 8.079 8.079 7.463 0.616 18852
971 1 7 . 1 1 22 22 ALA N N 22 121.393 121.393 120.130 1.263 18852
972 1 7 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.156 -0.010 18852
973 1 7 . 1 1 22 22 ALA C C 22 179.577 179.577 178.227 1.350 18852
974 1 7 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.771 -0.504 18852
975 1 7 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.497 -0.666 18852
976 1 7 . 1 1 22 22 ALA H H 22 8.026 8.026 7.778 0.248 18852
977 1 7 . 1 1 23 23 ALA N N 23 119.867 119.867 120.755 -0.888 18852
978 1 7 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.314 -0.156 18852
979 1 7 . 1 1 23 23 ALA C C 23 178.616 178.616 179.020 -0.404 18852
980 1 7 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.956 -0.242 18852
981 1 7 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.566 -0.521 18852
982 1 7 . 1 1 23 23 ALA H H 23 7.938 7.938 7.496 0.442 18852
983 1 7 . 1 1 24 24 ALA N N 24 119.652 119.652 120.077 -0.425 18852
984 1 7 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.174 0.117 18852
985 1 7 . 1 1 24 24 ALA C C 24 177.528 177.528 177.691 -0.163 18852
986 1 7 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.672 -0.966 18852
987 1 7 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.296 -0.705 18852
988 1 7 . 1 1 24 24 ALA H H 24 7.693 7.693 8.204 -0.511 18852
989 1 7 . 1 1 25 25 ALA N N 25 121.574 121.574 120.731 0.843 18852
990 1 7 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.560 -0.231 18852
991 1 7 . 1 1 25 25 ALA C C 25 176.649 176.649 176.019 0.630 18852
992 1 7 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.673 1.893 18852
993 1 7 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.290 -1.660 18852
994 1 7 . 1 1 25 25 ALA H H 25 7.679 7.679 7.707 -0.028 18852
995 1 8 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.289 -0.050 18852
996 1 8 . 1 1 2 2 ALA C C 2 179.180 179.180 179.547 -0.367 18852
997 1 8 . 1 1 2 2 ALA CA C 2 54.532 54.532 53.838 0.694 18852
998 1 8 . 1 1 2 2 ALA CB C 2 18.397 18.397 18.928 -0.531 18852
999 1 8 . 1 1 3 3 MET N N 3 117.814 117.814 116.587 1.227 18852
1000 1 8 . 1 1 3 3 MET HA H 3 4.354 4.354 4.352 0.002 18852
1001 1 8 . 1 1 3 3 MET C C 3 177.926 177.926 177.371 0.555 18852
1002 1 8 . 1 1 3 3 MET CA C 3 57.876 57.876 57.898 -0.022 18852
1003 1 8 . 1 1 3 3 MET CB C 3 31.673 31.673 32.189 -0.516 18852
1004 1 8 . 1 1 3 3 MET H H 3 8.613 8.613 8.154 0.459 18852
1005 1 8 . 1 1 4 4 ALA N N 4 122.603 122.603 122.002 0.601 18852
1006 1 8 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.200 0.028 18852
1007 1 8 . 1 1 4 4 ALA C C 4 179.940 179.940 179.434 0.506 18852
1008 1 8 . 1 1 4 4 ALA CA C 4 54.689 54.689 54.955 -0.266 18852
1009 1 8 . 1 1 4 4 ALA CB C 4 18.025 18.025 18.225 -0.200 18852
1010 1 8 . 1 1 4 4 ALA H H 4 8.324 8.324 8.193 0.131 18852
1011 1 8 . 1 1 5 5 THR N N 5 112.671 112.671 112.197 0.474 18852
1012 1 8 . 1 1 5 5 THR HA H 5 4.121 4.121 3.959 0.162 18852
1013 1 8 . 1 1 5 5 THR C C 5 176.085 176.085 176.554 -0.469 18852
1014 1 8 . 1 1 5 5 THR CA C 5 65.053 65.053 65.415 -0.361 18852
1015 1 8 . 1 1 5 5 THR CB C 5 68.989 68.989 68.379 0.610 18852
1016 1 8 . 1 1 5 5 THR H H 5 7.966 7.966 7.620 0.346 18852
1017 1 8 . 1 1 6 6 ARG N N 6 122.300 122.300 121.760 0.540 18852
1018 1 8 . 1 1 6 6 ARG HA H 6 4.057 4.057 3.948 0.109 18852
1019 1 8 . 1 1 6 6 ARG C C 6 178.983 178.983 178.627 0.356 18852
1020 1 8 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.225 0.738 18852
1021 1 8 . 1 1 6 6 ARG CB C 6 29.853 29.853 29.599 0.254 18852
1022 1 8 . 1 1 6 6 ARG H H 6 8.244 8.244 7.571 0.673 18852
1023 1 8 . 1 1 7 7 GLN N N 7 118.940 118.940 118.611 0.329 18852
1024 1 8 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.130 -0.072 18852
1025 1 8 . 1 1 7 7 GLN C C 7 177.997 177.997 177.681 0.316 18852
1026 1 8 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.426 0.309 18852
1027 1 8 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.529 -0.341 18852
1028 1 8 . 1 1 7 7 GLN H H 7 8.424 8.424 7.705 0.719 18852
1029 1 8 . 1 1 8 8 ALA N N 8 122.920 122.920 121.934 0.986 18852
1030 1 8 . 1 1 8 8 ALA HA H 8 4.217 4.217 3.980 0.237 18852
1031 1 8 . 1 1 8 8 ALA C C 8 180.837 180.837 179.454 1.383 18852
1032 1 8 . 1 1 8 8 ALA CA C 8 55.319 55.319 55.078 0.241 18852
1033 1 8 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.127 -0.431 18852
1034 1 8 . 1 1 8 8 ALA H H 8 8.306 8.306 7.580 0.726 18852
1035 1 8 . 1 1 9 9 ARG N N 9 118.721 118.721 117.541 1.180 18852
1036 1 8 . 1 1 9 9 ARG HA H 9 4.050 4.050 3.925 0.125 18852
1037 1 8 . 1 1 9 9 ARG C C 9 178.843 178.843 178.808 0.035 18852
1038 1 8 . 1 1 9 9 ARG CA C 9 59.721 59.721 59.585 0.136 18852
1039 1 8 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.810 0.358 18852
1040 1 8 . 1 1 9 9 ARG H H 9 8.263 8.263 7.763 0.500 18852
1041 1 8 . 1 1 10 10 ARG N N 10 120.338 120.338 119.252 1.086 18852
1042 1 8 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.017 0.057 18852
1043 1 8 . 1 1 10 10 ARG C C 10 179.024 179.024 178.743 0.281 18852
1044 1 8 . 1 1 10 10 ARG CA C 10 59.542 59.542 59.397 0.145 18852
1045 1 8 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.721 0.183 18852
1046 1 8 . 1 1 10 10 ARG H H 10 8.251 8.251 7.901 0.350 18852
1047 1 8 . 1 1 11 11 ASN N N 11 118.863 118.863 117.968 0.895 18852
1048 1 8 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.455 0.088 18852
1049 1 8 . 1 1 11 11 ASN C C 11 177.279 177.279 177.793 -0.514 18852
1050 1 8 . 1 1 11 11 ASN CA C 11 55.979 55.979 56.110 -0.131 18852
1051 1 8 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.081 -0.097 18852
1052 1 8 . 1 1 11 11 ASN H H 11 8.551 8.551 7.772 0.779 18852
1053 1 8 . 1 1 12 12 ARG N N 12 120.917 120.917 120.796 0.121 18852
1054 1 8 . 1 1 12 12 ARG HA H 12 4.079 4.079 4.022 0.057 18852
1055 1 8 . 1 1 12 12 ARG C C 12 178.488 178.488 178.818 -0.330 18852
1056 1 8 . 1 1 12 12 ARG CA C 12 59.787 59.787 59.026 0.760 18852
1057 1 8 . 1 1 12 12 ARG CB C 12 29.937 29.937 29.768 0.169 18852
1058 1 8 . 1 1 12 12 ARG H H 12 8.253 8.253 8.532 -0.279 18852
1059 1 8 . 1 1 13 13 ARG N N 13 119.263 119.263 118.091 1.172 18852
1060 1 8 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.254 -0.065 18852
1061 1 8 . 1 1 13 13 ARG C C 13 178.479 178.479 178.867 -0.388 18852
1062 1 8 . 1 1 13 13 ARG CA C 13 59.572 59.572 57.931 1.641 18852
1063 1 8 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.643 0.424 18852
1064 1 8 . 1 1 13 13 ARG H H 13 8.167 8.167 7.722 0.445 18852
1065 1 8 . 1 1 14 14 ARG N N 14 119.756 119.756 119.804 -0.048 18852
1066 1 8 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.104 0.037 18852
1067 1 8 . 1 1 14 14 ARG C C 14 178.817 178.817 178.829 -0.012 18852
1068 1 8 . 1 1 14 14 ARG CA C 14 59.695 59.695 58.812 0.883 18852
1069 1 8 . 1 1 14 14 ARG CB C 14 29.812 29.812 29.730 0.082 18852
1070 1 8 . 1 1 14 14 ARG H H 14 8.285 8.285 8.252 0.033 18852
1071 1 8 . 1 1 15 15 ARG N N 15 119.026 119.026 119.186 -0.160 18852
1072 1 8 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.111 0.047 18852
1073 1 8 . 1 1 15 15 ARG C C 15 178.909 178.909 178.500 0.409 18852
1074 1 8 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.683 -0.450 18852
1075 1 8 . 1 1 15 15 ARG CB C 15 29.772 29.772 30.189 -0.417 18852
1076 1 8 . 1 1 15 15 ARG H H 15 8.278 8.278 8.527 -0.249 18852
1077 1 8 . 1 1 16 16 TRP N N 16 121.055 121.055 120.990 0.065 18852
1078 1 8 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.394 -0.005 18852
1079 1 8 . 1 1 16 16 TRP C C 16 178.621 178.621 178.258 0.363 18852
1080 1 8 . 1 1 16 16 TRP CA C 16 61.013 61.013 60.158 0.855 18852
1081 1 8 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.097 -0.301 18852
1082 1 8 . 1 1 16 16 TRP H H 16 8.464 8.464 7.459 1.005 18852
1083 1 8 . 1 1 17 17 ARG N N 17 119.474 119.474 118.703 0.771 18852
1084 1 8 . 1 1 17 17 ARG HA H 17 3.910 3.910 3.722 0.188 18852
1085 1 8 . 1 1 17 17 ARG C C 17 179.120 179.120 178.775 0.345 18852
1086 1 8 . 1 1 17 17 ARG CA C 17 59.627 59.627 59.062 0.565 18852
1087 1 8 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.602 0.305 18852
1088 1 8 . 1 1 17 17 ARG H H 17 8.537 8.537 7.755 0.782 18852
1089 1 8 . 1 1 18 18 GLU N N 18 119.223 119.223 118.064 1.159 18852
1090 1 8 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.033 0.028 18852
1091 1 8 . 1 1 18 18 GLU C C 18 179.163 179.163 178.934 0.229 18852
1092 1 8 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.994 0.144 18852
1093 1 8 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.432 -0.297 18852
1094 1 8 . 1 1 18 18 GLU H H 18 8.346 8.346 7.748 0.598 18852
1095 1 8 . 1 1 19 19 ARG N N 19 119.942 119.942 119.180 0.762 18852
1096 1 8 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.048 -0.002 18852
1097 1 8 . 1 1 19 19 ARG C C 19 178.634 178.634 179.063 -0.429 18852
1098 1 8 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.895 0.121 18852
1099 1 8 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.228 -0.857 18852
1100 1 8 . 1 1 19 19 ARG H H 19 8.104 8.104 7.637 0.467 18852
1101 1 8 . 1 1 20 20 GLN N N 20 118.373 118.373 118.928 -0.555 18852
1102 1 8 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.024 -0.132 18852
1103 1 8 . 1 1 20 20 GLN C C 20 178.465 178.465 177.610 0.855 18852
1104 1 8 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.278 -0.108 18852
1105 1 8 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.269 -0.156 18852
1106 1 8 . 1 1 20 20 GLN H H 20 8.044 8.044 7.607 0.437 18852
1107 1 8 . 1 1 21 21 ARG N N 21 119.374 119.374 119.764 -0.390 18852
1108 1 8 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.966 0.068 18852
1109 1 8 . 1 1 21 21 ARG C C 21 178.423 178.423 178.236 0.187 18852
1110 1 8 . 1 1 21 21 ARG CA C 21 58.765 58.765 59.206 -0.441 18852
1111 1 8 . 1 1 21 21 ARG CB C 21 29.676 29.676 30.082 -0.406 18852
1112 1 8 . 1 1 21 21 ARG H H 21 8.079 8.079 7.653 0.426 18852
1113 1 8 . 1 1 22 22 ALA N N 22 121.393 121.393 120.377 1.016 18852
1114 1 8 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.096 0.050 18852
1115 1 8 . 1 1 22 22 ALA C C 22 179.577 179.577 178.273 1.304 18852
1116 1 8 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.852 -0.585 18852
1117 1 8 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.424 -0.593 18852
1118 1 8 . 1 1 22 22 ALA H H 22 8.026 8.026 7.465 0.561 18852
1119 1 8 . 1 1 23 23 ALA N N 23 119.867 119.867 120.638 -0.771 18852
1120 1 8 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.328 -0.170 18852
1121 1 8 . 1 1 23 23 ALA C C 23 178.616 178.616 178.889 -0.273 18852
1122 1 8 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.784 -0.070 18852
1123 1 8 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.503 -0.458 18852
1124 1 8 . 1 1 23 23 ALA H H 23 7.938 7.938 7.475 0.463 18852
1125 1 8 . 1 1 24 24 ALA N N 24 119.652 119.652 120.825 -1.173 18852
1126 1 8 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.120 0.171 18852
1127 1 8 . 1 1 24 24 ALA C C 24 177.528 177.528 177.680 -0.152 18852
1128 1 8 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.833 -1.127 18852
1129 1 8 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.269 -0.678 18852
1130 1 8 . 1 1 24 24 ALA H H 24 7.693 7.693 8.151 -0.458 18852
1131 1 8 . 1 1 25 25 ALA N N 25 121.574 121.574 120.284 1.290 18852
1132 1 8 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.572 -0.243 18852
1133 1 8 . 1 1 25 25 ALA C C 25 176.649 176.649 175.901 0.748 18852
1134 1 8 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.713 1.853 18852
1135 1 8 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.680 -2.050 18852
1136 1 8 . 1 1 25 25 ALA H H 25 7.679 7.679 7.692 -0.013 18852
1137 1 9 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.230 0.009 18852
1138 1 9 . 1 1 2 2 ALA C C 2 179.180 179.180 179.552 -0.372 18852
1139 1 9 . 1 1 2 2 ALA CA C 2 54.532 54.532 53.979 0.553 18852
1140 1 9 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.431 -1.034 18852
1141 1 9 . 1 1 3 3 MET N N 3 117.814 117.814 116.592 1.222 18852
1142 1 9 . 1 1 3 3 MET HA H 3 4.354 4.354 4.262 0.092 18852
1143 1 9 . 1 1 3 3 MET C C 3 177.926 177.926 177.483 0.443 18852
1144 1 9 . 1 1 3 3 MET CA C 3 57.876 57.876 57.866 0.010 18852
1145 1 9 . 1 1 3 3 MET CB C 3 31.673 31.673 32.158 -0.485 18852
1146 1 9 . 1 1 3 3 MET H H 3 8.613 8.613 8.130 0.483 18852
1147 1 9 . 1 1 4 4 ALA N N 4 122.603 122.603 121.171 1.432 18852
1148 1 9 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.220 0.008 18852
1149 1 9 . 1 1 4 4 ALA C C 4 179.940 179.940 179.256 0.684 18852
1150 1 9 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.053 -0.364 18852
1151 1 9 . 1 1 4 4 ALA CB C 4 18.025 18.025 17.904 0.121 18852
1152 1 9 . 1 1 4 4 ALA H H 4 8.324 8.324 8.362 -0.038 18852
1153 1 9 . 1 1 5 5 THR N N 5 112.671 112.671 114.827 -2.156 18852
1154 1 9 . 1 1 5 5 THR HA H 5 4.121 4.121 3.952 0.169 18852
1155 1 9 . 1 1 5 5 THR C C 5 176.085 176.085 176.480 -0.395 18852
1156 1 9 . 1 1 5 5 THR CA C 5 65.053 65.053 66.585 -1.532 18852
1157 1 9 . 1 1 5 5 THR CB C 5 68.989 68.989 68.508 0.481 18852
1158 1 9 . 1 1 5 5 THR H H 5 7.966 7.966 7.767 0.199 18852
1159 1 9 . 1 1 6 6 ARG N N 6 122.300 122.300 120.638 1.662 18852
1160 1 9 . 1 1 6 6 ARG HA H 6 4.057 4.057 4.134 -0.077 18852
1161 1 9 . 1 1 6 6 ARG C C 6 178.983 178.983 178.714 0.269 18852
1162 1 9 . 1 1 6 6 ARG CA C 6 59.963 59.963 58.913 1.050 18852
1163 1 9 . 1 1 6 6 ARG CB C 6 29.853 29.853 29.855 -0.002 18852
1164 1 9 . 1 1 6 6 ARG H H 6 8.244 8.244 7.445 0.799 18852
1165 1 9 . 1 1 7 7 GLN N N 7 118.940 118.940 119.785 -0.845 18852
1166 1 9 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.082 -0.024 18852
1167 1 9 . 1 1 7 7 GLN C C 7 177.997 177.997 178.013 -0.016 18852
1168 1 9 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.463 0.272 18852
1169 1 9 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.334 -0.146 18852
1170 1 9 . 1 1 7 7 GLN H H 7 8.424 8.424 7.731 0.693 18852
1171 1 9 . 1 1 8 8 ALA N N 8 122.920 122.920 122.240 0.680 18852
1172 1 9 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.010 0.207 18852
1173 1 9 . 1 1 8 8 ALA C C 8 180.837 180.837 179.523 1.314 18852
1174 1 9 . 1 1 8 8 ALA CA C 8 55.319 55.319 55.006 0.313 18852
1175 1 9 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.192 -0.497 18852
1176 1 9 . 1 1 8 8 ALA H H 8 8.306 8.306 8.468 -0.162 18852
1177 1 9 . 1 1 9 9 ARG N N 9 118.721 118.721 118.447 0.274 18852
1178 1 9 . 1 1 9 9 ARG HA H 9 4.050 4.050 3.970 0.080 18852
1179 1 9 . 1 1 9 9 ARG C C 9 178.843 178.843 178.742 0.101 18852
1180 1 9 . 1 1 9 9 ARG CA C 9 59.721 59.721 59.113 0.608 18852
1181 1 9 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.631 0.537 18852
1182 1 9 . 1 1 9 9 ARG H H 9 8.263 8.263 7.852 0.411 18852
1183 1 9 . 1 1 10 10 ARG N N 10 120.338 120.338 118.347 1.991 18852
1184 1 9 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.101 -0.027 18852
1185 1 9 . 1 1 10 10 ARG C C 10 179.024 179.024 178.764 0.260 18852
1186 1 9 . 1 1 10 10 ARG CA C 10 59.542 59.542 58.919 0.623 18852
1187 1 9 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.322 0.582 18852
1188 1 9 . 1 1 10 10 ARG H H 10 8.251 8.251 7.925 0.326 18852
1189 1 9 . 1 1 11 11 ASN N N 11 118.863 118.863 118.488 0.375 18852
1190 1 9 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.525 0.018 18852
1191 1 9 . 1 1 11 11 ASN C C 11 177.279 177.279 177.561 -0.282 18852
1192 1 9 . 1 1 11 11 ASN CA C 11 55.979 55.979 56.056 -0.077 18852
1193 1 9 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.085 -0.102 18852
1194 1 9 . 1 1 11 11 ASN H H 11 8.551 8.551 8.502 0.049 18852
1195 1 9 . 1 1 12 12 ARG N N 12 120.917 120.917 121.062 -0.145 18852
1196 1 9 . 1 1 12 12 ARG HA H 12 4.079 4.079 4.208 -0.129 18852
1197 1 9 . 1 1 12 12 ARG C C 12 178.488 178.488 178.142 0.346 18852
1198 1 9 . 1 1 12 12 ARG CA C 12 59.787 59.787 58.869 0.918 18852
1199 1 9 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.449 -0.512 18852
1200 1 9 . 1 1 12 12 ARG H H 12 8.253 8.253 8.119 0.134 18852
1201 1 9 . 1 1 13 13 ARG N N 13 119.263 119.263 118.374 0.889 18852
1202 1 9 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.177 0.012 18852
1203 1 9 . 1 1 13 13 ARG C C 13 178.479 178.479 178.606 -0.127 18852
1204 1 9 . 1 1 13 13 ARG CA C 13 59.572 59.572 58.983 0.589 18852
1205 1 9 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.622 0.445 18852
1206 1 9 . 1 1 13 13 ARG H H 13 8.167 8.167 7.944 0.223 18852
1207 1 9 . 1 1 14 14 ARG N N 14 119.756 119.756 120.803 -1.047 18852
1208 1 9 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.081 0.060 18852
1209 1 9 . 1 1 14 14 ARG C C 14 178.817 178.817 178.584 0.233 18852
1210 1 9 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.476 0.219 18852
1211 1 9 . 1 1 14 14 ARG CB C 14 29.812 29.812 30.121 -0.309 18852
1212 1 9 . 1 1 14 14 ARG H H 14 8.285 8.285 8.438 -0.153 18852
1213 1 9 . 1 1 15 15 ARG N N 15 119.026 119.026 118.539 0.487 18852
1214 1 9 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.042 0.116 18852
1215 1 9 . 1 1 15 15 ARG C C 15 178.909 178.909 178.693 0.216 18852
1216 1 9 . 1 1 15 15 ARG CA C 15 59.233 59.233 58.912 0.321 18852
1217 1 9 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.859 -0.087 18852
1218 1 9 . 1 1 15 15 ARG H H 15 8.278 8.278 7.502 0.776 18852
1219 1 9 . 1 1 16 16 TRP N N 16 121.055 121.055 122.042 -0.987 18852
1220 1 9 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.309 0.080 18852
1221 1 9 . 1 1 16 16 TRP C C 16 178.621 178.621 177.994 0.627 18852
1222 1 9 . 1 1 16 16 TRP CA C 16 61.013 61.013 60.913 0.100 18852
1223 1 9 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.078 -0.282 18852
1224 1 9 . 1 1 16 16 TRP H H 16 8.464 8.464 8.144 0.320 18852
1225 1 9 . 1 1 17 17 ARG N N 17 119.474 119.474 118.629 0.845 18852
1226 1 9 . 1 1 17 17 ARG HA H 17 3.910 3.910 3.711 0.199 18852
1227 1 9 . 1 1 17 17 ARG C C 17 179.120 179.120 178.574 0.546 18852
1228 1 9 . 1 1 17 17 ARG CA C 17 59.627 59.627 59.057 0.570 18852
1229 1 9 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.624 0.283 18852
1230 1 9 . 1 1 17 17 ARG H H 17 8.537 8.537 7.598 0.939 18852
1231 1 9 . 1 1 18 18 GLU N N 18 119.223 119.223 117.887 1.336 18852
1232 1 9 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.048 0.013 18852
1233 1 9 . 1 1 18 18 GLU C C 18 179.163 179.163 179.685 -0.522 18852
1234 1 9 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.728 0.410 18852
1235 1 9 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.216 -0.081 18852
1236 1 9 . 1 1 18 18 GLU H H 18 8.346 8.346 7.623 0.723 18852
1237 1 9 . 1 1 19 19 ARG N N 19 119.942 119.942 120.140 -0.198 18852
1238 1 9 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.169 -0.123 18852
1239 1 9 . 1 1 19 19 ARG C C 19 178.634 178.634 178.634 0.000 18852
1240 1 9 . 1 1 19 19 ARG CA C 19 59.016 59.016 57.810 1.206 18852
1241 1 9 . 1 1 19 19 ARG CB C 19 29.371 29.371 29.999 -0.628 18852
1242 1 9 . 1 1 19 19 ARG H H 19 8.104 8.104 8.344 -0.240 18852
1243 1 9 . 1 1 20 20 GLN N N 20 118.373 118.373 119.495 -1.122 18852
1244 1 9 . 1 1 20 20 GLN HA H 20 3.892 3.892 3.876 0.016 18852
1245 1 9 . 1 1 20 20 GLN C C 20 178.465 178.465 177.504 0.961 18852
1246 1 9 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.842 -0.672 18852
1247 1 9 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.181 -0.068 18852
1248 1 9 . 1 1 20 20 GLN H H 20 8.044 8.044 7.954 0.090 18852
1249 1 9 . 1 1 21 21 ARG N N 21 119.374 119.374 119.654 -0.280 18852
1250 1 9 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.980 0.054 18852
1251 1 9 . 1 1 21 21 ARG C C 21 178.423 178.423 178.326 0.097 18852
1252 1 9 . 1 1 21 21 ARG CA C 21 58.765 58.765 58.807 -0.042 18852
1253 1 9 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.828 -0.152 18852
1254 1 9 . 1 1 21 21 ARG H H 21 8.079 8.079 7.484 0.595 18852
1255 1 9 . 1 1 22 22 ALA N N 22 121.393 121.393 120.302 1.091 18852
1256 1 9 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.120 0.026 18852
1257 1 9 . 1 1 22 22 ALA C C 22 179.577 179.577 178.421 1.156 18852
1258 1 9 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.962 -0.695 18852
1259 1 9 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.462 -0.631 18852
1260 1 9 . 1 1 22 22 ALA H H 22 8.026 8.026 7.833 0.193 18852
1261 1 9 . 1 1 23 23 ALA N N 23 119.867 119.867 120.637 -0.770 18852
1262 1 9 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.302 -0.144 18852
1263 1 9 . 1 1 23 23 ALA C C 23 178.616 178.616 178.794 -0.178 18852
1264 1 9 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.882 -0.168 18852
1265 1 9 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.560 -0.515 18852
1266 1 9 . 1 1 23 23 ALA H H 23 7.938 7.938 7.526 0.412 18852
1267 1 9 . 1 1 24 24 ALA N N 24 119.652 119.652 120.518 -0.866 18852
1268 1 9 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.126 0.165 18852
1269 1 9 . 1 1 24 24 ALA C C 24 177.528 177.528 177.570 -0.042 18852
1270 1 9 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.677 -0.971 18852
1271 1 9 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.306 -0.715 18852
1272 1 9 . 1 1 24 24 ALA H H 24 7.693 7.693 8.143 -0.450 18852
1273 1 9 . 1 1 25 25 ALA N N 25 121.574 121.574 120.373 1.201 18852
1274 1 9 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.581 -0.252 18852
1275 1 9 . 1 1 25 25 ALA C C 25 176.649 176.649 175.599 1.050 18852
1276 1 9 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.865 1.701 18852
1277 1 9 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.574 -1.944 18852
1278 1 9 . 1 1 25 25 ALA H H 25 7.679 7.679 7.753 -0.074 18852
1279 1 10 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.287 -0.048 18852
1280 1 10 . 1 1 2 2 ALA C C 2 179.180 179.180 179.186 -0.006 18852
1281 1 10 . 1 1 2 2 ALA CA C 2 54.532 54.532 53.361 1.171 18852
1282 1 10 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.380 -0.983 18852
1283 1 10 . 1 1 3 3 MET N N 3 117.814 117.814 119.267 -1.453 18852
1284 1 10 . 1 1 3 3 MET HA H 3 4.354 4.354 3.984 0.370 18852
1285 1 10 . 1 1 3 3 MET C C 3 177.926 177.926 177.670 0.256 18852
1286 1 10 . 1 1 3 3 MET CA C 3 57.876 57.876 58.553 -0.677 18852
1287 1 10 . 1 1 3 3 MET CB C 3 31.673 31.673 32.344 -0.671 18852
1288 1 10 . 1 1 3 3 MET H H 3 8.613 8.613 8.340 0.273 18852
1289 1 10 . 1 1 4 4 ALA N N 4 122.603 122.603 119.657 2.946 18852
1290 1 10 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.021 0.207 18852
1291 1 10 . 1 1 4 4 ALA C C 4 179.940 179.940 179.350 0.590 18852
1292 1 10 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.357 -0.668 18852
1293 1 10 . 1 1 4 4 ALA CB C 4 18.025 18.025 17.905 0.120 18852
1294 1 10 . 1 1 4 4 ALA H H 4 8.324 8.324 8.353 -0.029 18852
1295 1 10 . 1 1 5 5 THR N N 5 112.671 112.671 112.319 0.352 18852
1296 1 10 . 1 1 5 5 THR HA H 5 4.121 4.121 3.888 0.233 18852
1297 1 10 . 1 1 5 5 THR C C 5 176.085 176.085 176.679 -0.594 18852
1298 1 10 . 1 1 5 5 THR CA C 5 65.053 65.053 65.511 -0.458 18852
1299 1 10 . 1 1 5 5 THR CB C 5 68.989 68.989 68.578 0.411 18852
1300 1 10 . 1 1 5 5 THR H H 5 7.966 7.966 7.623 0.343 18852
1301 1 10 . 1 1 6 6 ARG N N 6 122.300 122.300 121.760 0.540 18852
1302 1 10 . 1 1 6 6 ARG HA H 6 4.057 4.057 3.931 0.126 18852
1303 1 10 . 1 1 6 6 ARG C C 6 178.983 178.983 178.614 0.369 18852
1304 1 10 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.140 0.823 18852
1305 1 10 . 1 1 6 6 ARG CB C 6 29.853 29.853 29.907 -0.054 18852
1306 1 10 . 1 1 6 6 ARG H H 6 8.244 8.244 7.642 0.602 18852
1307 1 10 . 1 1 7 7 GLN N N 7 118.940 118.940 118.306 0.634 18852
1308 1 10 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.092 -0.034 18852
1309 1 10 . 1 1 7 7 GLN C C 7 177.997 177.997 178.076 -0.079 18852
1310 1 10 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.521 0.214 18852
1311 1 10 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.386 -0.198 18852
1312 1 10 . 1 1 7 7 GLN H H 7 8.424 8.424 7.794 0.630 18852
1313 1 10 . 1 1 8 8 ALA N N 8 122.920 122.920 122.626 0.294 18852
1314 1 10 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.071 0.146 18852
1315 1 10 . 1 1 8 8 ALA C C 8 180.837 180.837 179.827 1.010 18852
1316 1 10 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.843 0.476 18852
1317 1 10 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.297 -0.602 18852
1318 1 10 . 1 1 8 8 ALA H H 8 8.306 8.306 7.830 0.476 18852
1319 1 10 . 1 1 9 9 ARG N N 9 118.721 118.721 118.492 0.229 18852
1320 1 10 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.116 -0.066 18852
1321 1 10 . 1 1 9 9 ARG C C 9 178.843 178.843 178.160 0.683 18852
1322 1 10 . 1 1 9 9 ARG CA C 9 59.721 59.721 58.796 0.925 18852
1323 1 10 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.988 0.180 18852
1324 1 10 . 1 1 9 9 ARG H H 9 8.263 8.263 7.865 0.398 18852
1325 1 10 . 1 1 10 10 ARG N N 10 120.338 120.338 118.806 1.532 18852
1326 1 10 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.127 -0.053 18852
1327 1 10 . 1 1 10 10 ARG C C 10 179.024 179.024 178.343 0.681 18852
1328 1 10 . 1 1 10 10 ARG CA C 10 59.542 59.542 59.381 0.161 18852
1329 1 10 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.898 0.006 18852
1330 1 10 . 1 1 10 10 ARG H H 10 8.251 8.251 7.561 0.690 18852
1331 1 10 . 1 1 11 11 ASN N N 11 118.863 118.863 117.831 1.032 18852
1332 1 10 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.436 0.107 18852
1333 1 10 . 1 1 11 11 ASN C C 11 177.279 177.279 177.688 -0.409 18852
1334 1 10 . 1 1 11 11 ASN CA C 11 55.979 55.979 55.823 0.156 18852
1335 1 10 . 1 1 11 11 ASN CB C 11 37.983 37.983 37.750 0.233 18852
1336 1 10 . 1 1 11 11 ASN H H 11 8.551 8.551 8.115 0.436 18852
1337 1 10 . 1 1 12 12 ARG N N 12 120.917 120.917 121.321 -0.404 18852
1338 1 10 . 1 1 12 12 ARG HA H 12 4.079 4.079 3.964 0.115 18852
1339 1 10 . 1 1 12 12 ARG C C 12 178.488 178.488 178.547 -0.059 18852
1340 1 10 . 1 1 12 12 ARG CA C 12 59.787 59.787 59.745 0.042 18852
1341 1 10 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.038 -0.101 18852
1342 1 10 . 1 1 12 12 ARG H H 12 8.253 8.253 7.835 0.418 18852
1343 1 10 . 1 1 13 13 ARG N N 13 119.263 119.263 118.278 0.985 18852
1344 1 10 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.325 -0.136 18852
1345 1 10 . 1 1 13 13 ARG C C 13 178.479 178.479 179.107 -0.628 18852
1346 1 10 . 1 1 13 13 ARG CA C 13 59.572 59.572 59.112 0.460 18852
1347 1 10 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.525 0.542 18852
1348 1 10 . 1 1 13 13 ARG H H 13 8.167 8.167 8.248 -0.081 18852
1349 1 10 . 1 1 14 14 ARG N N 14 119.756 119.756 120.420 -0.664 18852
1350 1 10 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.000 0.141 18852
1351 1 10 . 1 1 14 14 ARG C C 14 178.817 178.817 178.439 0.378 18852
1352 1 10 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.572 0.123 18852
1353 1 10 . 1 1 14 14 ARG CB C 14 29.812 29.812 30.244 -0.432 18852
1354 1 10 . 1 1 14 14 ARG H H 14 8.285 8.285 7.882 0.403 18852
1355 1 10 . 1 1 15 15 ARG N N 15 119.026 119.026 119.584 -0.558 18852
1356 1 10 . 1 1 15 15 ARG HA H 15 4.158 4.158 3.961 0.197 18852
1357 1 10 . 1 1 15 15 ARG C C 15 178.909 178.909 178.707 0.202 18852
1358 1 10 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.279 -0.046 18852
1359 1 10 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.623 0.149 18852
1360 1 10 . 1 1 15 15 ARG H H 15 8.278 8.278 8.293 -0.015 18852
1361 1 10 . 1 1 16 16 TRP N N 16 121.055 121.055 118.201 2.854 18852
1362 1 10 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.383 0.006 18852
1363 1 10 . 1 1 16 16 TRP C C 16 178.621 178.621 178.843 -0.222 18852
1364 1 10 . 1 1 16 16 TRP CA C 16 61.013 61.013 59.614 1.399 18852
1365 1 10 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.369 -0.574 18852
1366 1 10 . 1 1 16 16 TRP H H 16 8.464 8.464 7.986 0.478 18852
1367 1 10 . 1 1 17 17 ARG N N 17 119.474 119.474 119.087 0.387 18852
1368 1 10 . 1 1 17 17 ARG HA H 17 3.910 3.910 4.247 -0.337 18852
1369 1 10 . 1 1 17 17 ARG C C 17 179.120 179.120 178.725 0.395 18852
1370 1 10 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.384 1.243 18852
1371 1 10 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.841 0.066 18852
1372 1 10 . 1 1 17 17 ARG H H 17 8.537 8.537 7.799 0.738 18852
1373 1 10 . 1 1 18 18 GLU N N 18 119.223 119.223 118.495 0.728 18852
1374 1 10 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.082 -0.021 18852
1375 1 10 . 1 1 18 18 GLU C C 18 179.163 179.163 178.889 0.274 18852
1376 1 10 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.948 0.190 18852
1377 1 10 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.442 -0.307 18852
1378 1 10 . 1 1 18 18 GLU H H 18 8.346 8.346 7.993 0.353 18852
1379 1 10 . 1 1 19 19 ARG N N 19 119.942 119.942 118.185 1.757 18852
1380 1 10 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.205 -0.159 18852
1381 1 10 . 1 1 19 19 ARG C C 19 178.634 178.634 178.933 -0.299 18852
1382 1 10 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.876 0.140 18852
1383 1 10 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.557 -1.186 18852
1384 1 10 . 1 1 19 19 ARG H H 19 8.104 8.104 7.974 0.130 18852
1385 1 10 . 1 1 20 20 GLN N N 20 118.373 118.373 119.886 -1.513 18852
1386 1 10 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.144 -0.252 18852
1387 1 10 . 1 1 20 20 GLN C C 20 178.465 178.465 177.805 0.660 18852
1388 1 10 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.822 -0.652 18852
1389 1 10 . 1 1 20 20 GLN CB C 20 28.113 28.113 27.772 0.341 18852
1390 1 10 . 1 1 20 20 GLN H H 20 8.044 8.044 7.813 0.231 18852
1391 1 10 . 1 1 21 21 ARG N N 21 119.374 119.374 119.729 -0.355 18852
1392 1 10 . 1 1 21 21 ARG HA H 21 4.034 4.034 4.034 -0.000 18852
1393 1 10 . 1 1 21 21 ARG C C 21 178.423 178.423 178.443 -0.020 18852
1394 1 10 . 1 1 21 21 ARG CA C 21 58.765 58.765 58.860 -0.095 18852
1395 1 10 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.863 -0.187 18852
1396 1 10 . 1 1 21 21 ARG H H 21 8.079 8.079 7.660 0.419 18852
1397 1 10 . 1 1 22 22 ALA N N 22 121.393 121.393 120.246 1.147 18852
1398 1 10 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.155 -0.009 18852
1399 1 10 . 1 1 22 22 ALA C C 22 179.577 179.577 178.350 1.227 18852
1400 1 10 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.929 -0.663 18852
1401 1 10 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.537 -0.706 18852
1402 1 10 . 1 1 22 22 ALA H H 22 8.026 8.026 7.882 0.144 18852
1403 1 10 . 1 1 23 23 ALA N N 23 119.867 119.867 120.627 -0.760 18852
1404 1 10 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.261 -0.103 18852
1405 1 10 . 1 1 23 23 ALA C C 23 178.616 178.616 179.509 -0.893 18852
1406 1 10 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.843 -0.129 18852
1407 1 10 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.850 -0.805 18852
1408 1 10 . 1 1 23 23 ALA H H 23 7.938 7.938 7.657 0.281 18852
1409 1 10 . 1 1 24 24 ALA N N 24 119.652 119.652 121.494 -1.842 18852
1410 1 10 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.136 0.155 18852
1411 1 10 . 1 1 24 24 ALA C C 24 177.528 177.528 177.638 -0.110 18852
1412 1 10 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.568 -0.862 18852
1413 1 10 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.267 -0.676 18852
1414 1 10 . 1 1 24 24 ALA H H 24 7.693 7.693 8.416 -0.723 18852
1415 1 10 . 1 1 25 25 ALA N N 25 121.574 121.574 120.335 1.239 18852
1416 1 10 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.604 -0.275 18852
1417 1 10 . 1 1 25 25 ALA C C 25 176.649 176.649 175.958 0.691 18852
1418 1 10 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.662 1.904 18852
1419 1 10 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.710 -2.080 18852
1420 1 10 . 1 1 25 25 ALA H H 25 7.679 7.679 7.715 -0.036 18852
1421 1 11 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.251 -0.012 18852
1422 1 11 . 1 1 2 2 ALA C C 2 179.180 179.180 179.323 -0.143 18852
1423 1 11 . 1 1 2 2 ALA CA C 2 54.532 54.532 53.710 0.822 18852
1424 1 11 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.453 -1.056 18852
1425 1 11 . 1 1 3 3 MET N N 3 117.814 117.814 118.076 -0.262 18852
1426 1 11 . 1 1 3 3 MET HA H 3 4.354 4.354 4.334 0.020 18852
1427 1 11 . 1 1 3 3 MET C C 3 177.926 177.926 178.168 -0.242 18852
1428 1 11 . 1 1 3 3 MET CA C 3 57.876 57.876 56.921 0.955 18852
1429 1 11 . 1 1 3 3 MET CB C 3 31.673 31.673 31.676 -0.003 18852
1430 1 11 . 1 1 3 3 MET H H 3 8.613 8.613 8.249 0.364 18852
1431 1 11 . 1 1 4 4 ALA N N 4 122.603 122.603 120.486 2.117 18852
1432 1 11 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.226 0.002 18852
1433 1 11 . 1 1 4 4 ALA C C 4 179.940 179.940 179.275 0.665 18852
1434 1 11 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.171 -0.482 18852
1435 1 11 . 1 1 4 4 ALA CB C 4 18.025 18.025 18.105 -0.080 18852
1436 1 11 . 1 1 4 4 ALA H H 4 8.324 8.324 8.320 0.004 18852
1437 1 11 . 1 1 5 5 THR N N 5 112.671 112.671 114.202 -1.531 18852
1438 1 11 . 1 1 5 5 THR HA H 5 4.121 4.121 4.035 0.086 18852
1439 1 11 . 1 1 5 5 THR C C 5 176.085 176.085 176.355 -0.270 18852
1440 1 11 . 1 1 5 5 THR CA C 5 65.053 65.053 66.658 -1.605 18852
1441 1 11 . 1 1 5 5 THR CB C 5 68.989 68.989 68.626 0.363 18852
1442 1 11 . 1 1 5 5 THR H H 5 7.966 7.966 7.436 0.529 18852
1443 1 11 . 1 1 6 6 ARG N N 6 122.300 122.300 121.535 0.765 18852
1444 1 11 . 1 1 6 6 ARG HA H 6 4.057 4.057 4.081 -0.024 18852
1445 1 11 . 1 1 6 6 ARG C C 6 178.983 178.983 178.752 0.231 18852
1446 1 11 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.158 0.805 18852
1447 1 11 . 1 1 6 6 ARG CB C 6 29.853 29.853 30.041 -0.188 18852
1448 1 11 . 1 1 6 6 ARG H H 6 8.244 8.244 7.403 0.841 18852
1449 1 11 . 1 1 7 7 GLN N N 7 118.940 118.940 118.988 -0.048 18852
1450 1 11 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.068 -0.010 18852
1451 1 11 . 1 1 7 7 GLN C C 7 177.997 177.997 177.811 0.186 18852
1452 1 11 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.258 0.477 18852
1453 1 11 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.229 -0.041 18852
1454 1 11 . 1 1 7 7 GLN H H 7 8.424 8.424 7.724 0.700 18852
1455 1 11 . 1 1 8 8 ALA N N 8 122.920 122.920 121.859 1.061 18852
1456 1 11 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.030 0.187 18852
1457 1 11 . 1 1 8 8 ALA C C 8 180.837 180.837 179.570 1.267 18852
1458 1 11 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.967 0.352 18852
1459 1 11 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.223 -0.528 18852
1460 1 11 . 1 1 8 8 ALA H H 8 8.306 8.306 7.725 0.581 18852
1461 1 11 . 1 1 9 9 ARG N N 9 118.721 118.721 117.761 0.960 18852
1462 1 11 . 1 1 9 9 ARG HA H 9 4.050 4.050 3.969 0.081 18852
1463 1 11 . 1 1 9 9 ARG C C 9 178.843 178.843 178.417 0.426 18852
1464 1 11 . 1 1 9 9 ARG CA C 9 59.721 59.721 59.537 0.184 18852
1465 1 11 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.790 0.378 18852
1466 1 11 . 1 1 9 9 ARG H H 9 8.263 8.263 7.855 0.408 18852
1467 1 11 . 1 1 10 10 ARG N N 10 120.338 120.338 120.026 0.312 18852
1468 1 11 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.015 0.059 18852
1469 1 11 . 1 1 10 10 ARG C C 10 179.024 179.024 178.708 0.316 18852
1470 1 11 . 1 1 10 10 ARG CA C 10 59.542 59.542 59.555 -0.013 18852
1471 1 11 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.812 0.092 18852
1472 1 11 . 1 1 10 10 ARG H H 10 8.251 8.251 7.725 0.526 18852
1473 1 11 . 1 1 11 11 ASN N N 11 118.863 118.863 117.254 1.609 18852
1474 1 11 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.458 0.085 18852
1475 1 11 . 1 1 11 11 ASN C C 11 177.279 177.279 177.786 -0.507 18852
1476 1 11 . 1 1 11 11 ASN CA C 11 55.979 55.979 56.258 -0.279 18852
1477 1 11 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.252 -0.269 18852
1478 1 11 . 1 1 11 11 ASN H H 11 8.551 8.551 7.712 0.839 18852
1479 1 11 . 1 1 12 12 ARG N N 12 120.917 120.917 121.029 -0.112 18852
1480 1 11 . 1 1 12 12 ARG HA H 12 4.079 4.079 3.960 0.119 18852
1481 1 11 . 1 1 12 12 ARG C C 12 178.488 178.488 178.875 -0.387 18852
1482 1 11 . 1 1 12 12 ARG CA C 12 59.787 59.787 59.884 -0.097 18852
1483 1 11 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.202 -0.265 18852
1484 1 11 . 1 1 12 12 ARG H H 12 8.253 8.253 8.511 -0.258 18852
1485 1 11 . 1 1 13 13 ARG N N 13 119.263 119.263 118.481 0.782 18852
1486 1 11 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.190 -0.001 18852
1487 1 11 . 1 1 13 13 ARG C C 13 178.479 178.479 178.640 -0.161 18852
1488 1 11 . 1 1 13 13 ARG CA C 13 59.572 59.572 58.685 0.886 18852
1489 1 11 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.922 0.145 18852
1490 1 11 . 1 1 13 13 ARG H H 13 8.167 8.167 8.311 -0.144 18852
1491 1 11 . 1 1 14 14 ARG N N 14 119.756 119.756 120.295 -0.539 18852
1492 1 11 . 1 1 14 14 ARG HA H 14 4.141 4.141 3.972 0.169 18852
1493 1 11 . 1 1 14 14 ARG C C 14 178.817 178.817 178.716 0.101 18852
1494 1 11 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.864 -0.169 18852
1495 1 11 . 1 1 14 14 ARG CB C 14 29.812 29.812 30.054 -0.242 18852
1496 1 11 . 1 1 14 14 ARG H H 14 8.285 8.285 7.986 0.299 18852
1497 1 11 . 1 1 15 15 ARG N N 15 119.026 119.026 118.682 0.344 18852
1498 1 11 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.120 0.038 18852
1499 1 11 . 1 1 15 15 ARG C C 15 178.909 178.909 178.670 0.239 18852
1500 1 11 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.224 0.009 18852
1501 1 11 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.558 0.214 18852
1502 1 11 . 1 1 15 15 ARG H H 15 8.278 8.278 7.773 0.505 18852
1503 1 11 . 1 1 16 16 TRP N N 16 121.055 121.055 120.068 0.987 18852
1504 1 11 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.405 -0.016 18852
1505 1 11 . 1 1 16 16 TRP C C 16 178.621 178.621 178.150 0.471 18852
1506 1 11 . 1 1 16 16 TRP CA C 16 61.013 61.013 60.646 0.367 18852
1507 1 11 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.241 -0.445 18852
1508 1 11 . 1 1 16 16 TRP H H 16 8.464 8.464 7.702 0.762 18852
1509 1 11 . 1 1 17 17 ARG N N 17 119.474 119.474 118.897 0.577 18852
1510 1 11 . 1 1 17 17 ARG HA H 17 3.910 3.910 3.859 0.051 18852
1511 1 11 . 1 1 17 17 ARG C C 17 179.120 179.120 178.514 0.606 18852
1512 1 11 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.985 0.642 18852
1513 1 11 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.786 0.121 18852
1514 1 11 . 1 1 17 17 ARG H H 17 8.537 8.537 7.674 0.863 18852
1515 1 11 . 1 1 18 18 GLU N N 18 119.223 119.223 118.148 1.075 18852
1516 1 11 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.062 -0.001 18852
1517 1 11 . 1 1 18 18 GLU C C 18 179.163 179.163 179.469 -0.306 18852
1518 1 11 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.942 0.196 18852
1519 1 11 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.505 -0.369 18852
1520 1 11 . 1 1 18 18 GLU H H 18 8.346 8.346 7.742 0.604 18852
1521 1 11 . 1 1 19 19 ARG N N 19 119.942 119.942 119.166 0.776 18852
1522 1 11 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.187 -0.141 18852
1523 1 11 . 1 1 19 19 ARG C C 19 178.634 178.634 178.311 0.323 18852
1524 1 11 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.498 0.518 18852
1525 1 11 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.346 -0.975 18852
1526 1 11 . 1 1 19 19 ARG H H 19 8.104 8.104 8.318 -0.214 18852
1527 1 11 . 1 1 20 20 GLN N N 20 118.373 118.373 119.251 -0.878 18852
1528 1 11 . 1 1 20 20 GLN HA H 20 3.892 3.892 3.930 -0.038 18852
1529 1 11 . 1 1 20 20 GLN C C 20 178.465 178.465 177.339 1.126 18852
1530 1 11 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.724 -0.554 18852
1531 1 11 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.192 -0.079 18852
1532 1 11 . 1 1 20 20 GLN H H 20 8.044 8.044 7.690 0.354 18852
1533 1 11 . 1 1 21 21 ARG N N 21 119.374 119.374 119.681 -0.307 18852
1534 1 11 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.964 0.070 18852
1535 1 11 . 1 1 21 21 ARG C C 21 178.423 178.423 178.359 0.064 18852
1536 1 11 . 1 1 21 21 ARG CA C 21 58.765 58.765 58.986 -0.221 18852
1537 1 11 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.962 -0.285 18852
1538 1 11 . 1 1 21 21 ARG H H 21 8.079 8.079 7.493 0.586 18852
1539 1 11 . 1 1 22 22 ALA N N 22 121.393 121.393 120.276 1.117 18852
1540 1 11 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.127 0.019 18852
1541 1 11 . 1 1 22 22 ALA C C 22 179.577 179.577 178.219 1.358 18852
1542 1 11 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.858 -0.592 18852
1543 1 11 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.487 -0.656 18852
1544 1 11 . 1 1 22 22 ALA H H 22 8.026 8.026 7.713 0.313 18852
1545 1 11 . 1 1 23 23 ALA N N 23 119.867 119.867 120.507 -0.640 18852
1546 1 11 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.285 -0.127 18852
1547 1 11 . 1 1 23 23 ALA C C 23 178.616 178.616 179.201 -0.585 18852
1548 1 11 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.998 -0.284 18852
1549 1 11 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.616 -0.571 18852
1550 1 11 . 1 1 23 23 ALA H H 23 7.938 7.938 7.489 0.449 18852
1551 1 11 . 1 1 24 24 ALA N N 24 119.652 119.652 120.110 -0.458 18852
1552 1 11 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.117 0.174 18852
1553 1 11 . 1 1 24 24 ALA C C 24 177.528 177.528 177.786 -0.258 18852
1554 1 11 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.904 -1.198 18852
1555 1 11 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.120 -0.529 18852
1556 1 11 . 1 1 24 24 ALA H H 24 7.693 7.693 8.236 -0.543 18852
1557 1 11 . 1 1 25 25 ALA N N 25 121.574 121.574 120.735 0.839 18852
1558 1 11 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.530 -0.201 18852
1559 1 11 . 1 1 25 25 ALA C C 25 176.649 176.649 176.009 0.640 18852
1560 1 11 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.840 1.726 18852
1561 1 11 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.047 -1.417 18852
1562 1 11 . 1 1 25 25 ALA H H 25 7.679 7.679 7.718 -0.039 18852
1563 1 12 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.312 -0.073 18852
1564 1 12 . 1 1 2 2 ALA C C 2 179.180 179.180 179.277 -0.097 18852
1565 1 12 . 1 1 2 2 ALA CA C 2 54.532 54.532 53.241 1.291 18852
1566 1 12 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.295 -0.898 18852
1567 1 12 . 1 1 3 3 MET N N 3 117.814 117.814 118.530 -0.716 18852
1568 1 12 . 1 1 3 3 MET HA H 3 4.354 4.354 4.249 0.105 18852
1569 1 12 . 1 1 3 3 MET C C 3 177.926 177.926 178.000 -0.074 18852
1570 1 12 . 1 1 3 3 MET CA C 3 57.876 57.876 57.878 -0.002 18852
1571 1 12 . 1 1 3 3 MET CB C 3 31.673 31.673 32.267 -0.594 18852
1572 1 12 . 1 1 3 3 MET H H 3 8.613 8.613 8.249 0.364 18852
1573 1 12 . 1 1 4 4 ALA N N 4 122.603 122.603 121.358 1.245 18852
1574 1 12 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.181 0.047 18852
1575 1 12 . 1 1 4 4 ALA C C 4 179.940 179.940 179.446 0.494 18852
1576 1 12 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.067 -0.378 18852
1577 1 12 . 1 1 4 4 ALA CB C 4 18.025 18.025 18.132 -0.107 18852
1578 1 12 . 1 1 4 4 ALA H H 4 8.324 8.324 8.283 0.041 18852
1579 1 12 . 1 1 5 5 THR N N 5 112.671 112.671 115.341 -2.670 18852
1580 1 12 . 1 1 5 5 THR HA H 5 4.121 4.121 3.867 0.254 18852
1581 1 12 . 1 1 5 5 THR C C 5 176.085 176.085 176.592 -0.507 18852
1582 1 12 . 1 1 5 5 THR CA C 5 65.053 65.053 66.990 -1.937 18852
1583 1 12 . 1 1 5 5 THR CB C 5 68.989 68.989 68.553 0.436 18852
1584 1 12 . 1 1 5 5 THR H H 5 7.966 7.966 7.663 0.303 18852
1585 1 12 . 1 1 6 6 ARG N N 6 122.300 122.300 121.089 1.211 18852
1586 1 12 . 1 1 6 6 ARG HA H 6 4.057 4.057 3.954 0.103 18852
1587 1 12 . 1 1 6 6 ARG C C 6 178.983 178.983 178.780 0.203 18852
1588 1 12 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.328 0.635 18852
1589 1 12 . 1 1 6 6 ARG CB C 6 29.853 29.853 30.191 -0.338 18852
1590 1 12 . 1 1 6 6 ARG H H 6 8.244 8.244 7.496 0.748 18852
1591 1 12 . 1 1 7 7 GLN N N 7 118.940 118.940 119.234 -0.294 18852
1592 1 12 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.042 0.016 18852
1593 1 12 . 1 1 7 7 GLN C C 7 177.997 177.997 177.990 0.007 18852
1594 1 12 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.548 0.187 18852
1595 1 12 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.279 -0.091 18852
1596 1 12 . 1 1 7 7 GLN H H 7 8.424 8.424 7.729 0.695 18852
1597 1 12 . 1 1 8 8 ALA N N 8 122.920 122.920 122.150 0.770 18852
1598 1 12 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.024 0.193 18852
1599 1 12 . 1 1 8 8 ALA C C 8 180.837 180.837 179.764 1.073 18852
1600 1 12 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.996 0.323 18852
1601 1 12 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.195 -0.500 18852
1602 1 12 . 1 1 8 8 ALA H H 8 8.306 8.306 8.170 0.136 18852
1603 1 12 . 1 1 9 9 ARG N N 9 118.721 118.721 117.952 0.769 18852
1604 1 12 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.075 -0.025 18852
1605 1 12 . 1 1 9 9 ARG C C 9 178.843 178.843 178.877 -0.034 18852
1606 1 12 . 1 1 9 9 ARG CA C 9 59.721 59.721 58.785 0.936 18852
1607 1 12 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.672 0.496 18852
1608 1 12 . 1 1 9 9 ARG H H 9 8.263 8.263 8.106 0.157 18852
1609 1 12 . 1 1 10 10 ARG N N 10 120.338 120.338 119.385 0.953 18852
1610 1 12 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.113 -0.039 18852
1611 1 12 . 1 1 10 10 ARG C C 10 179.024 179.024 178.880 0.144 18852
1612 1 12 . 1 1 10 10 ARG CA C 10 59.542 59.542 59.380 0.162 18852
1613 1 12 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.798 0.106 18852
1614 1 12 . 1 1 10 10 ARG H H 10 8.251 8.251 7.783 0.468 18852
1615 1 12 . 1 1 11 11 ASN N N 11 118.863 118.863 118.019 0.844 18852
1616 1 12 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.631 -0.088 18852
1617 1 12 . 1 1 11 11 ASN C C 11 177.279 177.279 177.716 -0.437 18852
1618 1 12 . 1 1 11 11 ASN CA C 11 55.979 55.979 55.497 0.482 18852
1619 1 12 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.006 -0.023 18852
1620 1 12 . 1 1 11 11 ASN H H 11 8.551 8.551 8.248 0.303 18852
1621 1 12 . 1 1 12 12 ARG N N 12 120.917 120.917 121.489 -0.572 18852
1622 1 12 . 1 1 12 12 ARG HA H 12 4.079 4.079 4.185 -0.106 18852
1623 1 12 . 1 1 12 12 ARG C C 12 178.488 178.488 178.643 -0.155 18852
1624 1 12 . 1 1 12 12 ARG CA C 12 59.787 59.787 59.568 0.219 18852
1625 1 12 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.364 -0.427 18852
1626 1 12 . 1 1 12 12 ARG H H 12 8.253 8.253 7.929 0.324 18852
1627 1 12 . 1 1 13 13 ARG N N 13 119.263 119.263 118.286 0.977 18852
1628 1 12 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.225 -0.036 18852
1629 1 12 . 1 1 13 13 ARG C C 13 178.479 178.479 178.922 -0.443 18852
1630 1 12 . 1 1 13 13 ARG CA C 13 59.572 59.572 57.803 1.769 18852
1631 1 12 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.878 0.189 18852
1632 1 12 . 1 1 13 13 ARG H H 13 8.167 8.167 8.206 -0.039 18852
1633 1 12 . 1 1 14 14 ARG N N 14 119.756 119.756 119.282 0.474 18852
1634 1 12 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.241 -0.100 18852
1635 1 12 . 1 1 14 14 ARG C C 14 178.817 178.817 178.251 0.566 18852
1636 1 12 . 1 1 14 14 ARG CA C 14 59.695 59.695 58.836 0.859 18852
1637 1 12 . 1 1 14 14 ARG CB C 14 29.812 29.812 30.100 -0.288 18852
1638 1 12 . 1 1 14 14 ARG H H 14 8.285 8.285 7.884 0.401 18852
1639 1 12 . 1 1 15 15 ARG N N 15 119.026 119.026 120.510 -1.484 18852
1640 1 12 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.079 0.079 18852
1641 1 12 . 1 1 15 15 ARG C C 15 178.909 178.909 178.165 0.744 18852
1642 1 12 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.723 -0.490 18852
1643 1 12 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.939 -0.167 18852
1644 1 12 . 1 1 15 15 ARG H H 15 8.278 8.278 7.706 0.572 18852
1645 1 12 . 1 1 16 16 TRP N N 16 121.055 121.055 118.128 2.927 18852
1646 1 12 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.440 -0.051 18852
1647 1 12 . 1 1 16 16 TRP C C 16 178.621 178.621 177.484 1.137 18852
1648 1 12 . 1 1 16 16 TRP CA C 16 61.013 61.013 59.231 1.782 18852
1649 1 12 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.479 -0.683 18852
1650 1 12 . 1 1 16 16 TRP H H 16 8.464 8.464 7.917 0.547 18852
1651 1 12 . 1 1 17 17 ARG N N 17 119.474 119.474 120.068 -0.594 18852
1652 1 12 . 1 1 17 17 ARG HA H 17 3.910 3.910 3.899 0.011 18852
1653 1 12 . 1 1 17 17 ARG C C 17 179.120 179.120 177.986 1.134 18852
1654 1 12 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.810 0.817 18852
1655 1 12 . 1 1 17 17 ARG CB C 17 29.907 29.907 30.027 -0.120 18852
1656 1 12 . 1 1 17 17 ARG H H 17 8.537 8.537 7.762 0.775 18852
1657 1 12 . 1 1 18 18 GLU N N 18 119.223 119.223 118.822 0.401 18852
1658 1 12 . 1 1 18 18 GLU HA H 18 4.061 4.061 3.930 0.131 18852
1659 1 12 . 1 1 18 18 GLU C C 18 179.163 179.163 178.965 0.198 18852
1660 1 12 . 1 1 18 18 GLU CA C 18 59.138 59.138 59.118 0.020 18852
1661 1 12 . 1 1 18 18 GLU CB C 18 29.135 29.135 28.873 0.262 18852
1662 1 12 . 1 1 18 18 GLU H H 18 8.346 8.346 8.414 -0.068 18852
1663 1 12 . 1 1 19 19 ARG N N 19 119.942 119.942 118.967 0.975 18852
1664 1 12 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.018 0.028 18852
1665 1 12 . 1 1 19 19 ARG C C 19 178.634 178.634 178.908 -0.274 18852
1666 1 12 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.275 0.741 18852
1667 1 12 . 1 1 19 19 ARG CB C 19 29.371 29.371 29.849 -0.478 18852
1668 1 12 . 1 1 19 19 ARG H H 19 8.104 8.104 8.027 0.077 18852
1669 1 12 . 1 1 20 20 GLN N N 20 118.373 118.373 118.668 -0.295 18852
1670 1 12 . 1 1 20 20 GLN HA H 20 3.892 3.892 3.984 -0.092 18852
1671 1 12 . 1 1 20 20 GLN C C 20 178.465 178.465 177.582 0.883 18852
1672 1 12 . 1 1 20 20 GLN CA C 20 58.170 58.170 57.978 0.192 18852
1673 1 12 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.338 -0.225 18852
1674 1 12 . 1 1 20 20 GLN H H 20 8.044 8.044 7.559 0.485 18852
1675 1 12 . 1 1 21 21 ARG N N 21 119.374 119.374 119.842 -0.468 18852
1676 1 12 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.954 0.080 18852
1677 1 12 . 1 1 21 21 ARG C C 21 178.423 178.423 178.212 0.211 18852
1678 1 12 . 1 1 21 21 ARG CA C 21 58.765 58.765 59.295 -0.530 18852
1679 1 12 . 1 1 21 21 ARG CB C 21 29.676 29.676 30.082 -0.406 18852
1680 1 12 . 1 1 21 21 ARG H H 21 8.079 8.079 7.718 0.361 18852
1681 1 12 . 1 1 22 22 ALA N N 22 121.393 121.393 120.130 1.263 18852
1682 1 12 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.116 0.030 18852
1683 1 12 . 1 1 22 22 ALA C C 22 179.577 179.577 178.273 1.304 18852
1684 1 12 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.788 -0.521 18852
1685 1 12 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.447 -0.616 18852
1686 1 12 . 1 1 22 22 ALA H H 22 8.026 8.026 7.473 0.553 18852
1687 1 12 . 1 1 23 23 ALA N N 23 119.867 119.867 120.411 -0.544 18852
1688 1 12 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.226 -0.068 18852
1689 1 12 . 1 1 23 23 ALA C C 23 178.616 178.616 179.399 -0.783 18852
1690 1 12 . 1 1 23 23 ALA CA C 23 53.714 53.714 54.200 -0.486 18852
1691 1 12 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.691 -0.645 18852
1692 1 12 . 1 1 23 23 ALA H H 23 7.938 7.938 7.582 0.356 18852
1693 1 12 . 1 1 24 24 ALA N N 24 119.652 119.652 120.429 -0.777 18852
1694 1 12 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.135 0.156 18852
1695 1 12 . 1 1 24 24 ALA C C 24 177.528 177.528 177.585 -0.057 18852
1696 1 12 . 1 1 24 24 ALA CA C 24 52.706 52.706 54.119 -1.413 18852
1697 1 12 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.005 -0.414 18852
1698 1 12 . 1 1 24 24 ALA H H 24 7.693 7.693 8.433 -0.740 18852
1699 1 12 . 1 1 25 25 ALA N N 25 121.574 121.574 120.784 0.790 18852
1700 1 12 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.575 -0.246 18852
1701 1 12 . 1 1 25 25 ALA C C 25 176.649 176.649 175.628 1.021 18852
1702 1 12 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.921 1.645 18852
1703 1 12 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.204 -1.574 18852
1704 1 12 . 1 1 25 25 ALA H H 25 7.679 7.679 7.717 -0.038 18852
1705 1 13 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.231 0.008 18852
1706 1 13 . 1 1 2 2 ALA C C 2 179.180 179.180 179.237 -0.057 18852
1707 1 13 . 1 1 2 2 ALA CA C 2 54.532 54.532 54.286 0.246 18852
1708 1 13 . 1 1 2 2 ALA CB C 2 18.397 18.397 18.888 -0.491 18852
1709 1 13 . 1 1 3 3 MET N N 3 117.814 117.814 118.012 -0.198 18852
1710 1 13 . 1 1 3 3 MET HA H 3 4.354 4.354 4.408 -0.054 18852
1711 1 13 . 1 1 3 3 MET C C 3 177.926 177.926 178.398 -0.472 18852
1712 1 13 . 1 1 3 3 MET CA C 3 57.876 57.876 57.064 0.812 18852
1713 1 13 . 1 1 3 3 MET CB C 3 31.673 31.673 32.229 -0.556 18852
1714 1 13 . 1 1 3 3 MET H H 3 8.613 8.613 7.976 0.637 18852
1715 1 13 . 1 1 4 4 ALA N N 4 122.603 122.603 121.934 0.669 18852
1716 1 13 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.046 0.182 18852
1717 1 13 . 1 1 4 4 ALA C C 4 179.940 179.940 179.392 0.548 18852
1718 1 13 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.058 -0.369 18852
1719 1 13 . 1 1 4 4 ALA CB C 4 18.025 18.025 17.905 0.120 18852
1720 1 13 . 1 1 4 4 ALA H H 4 8.324 8.324 8.379 -0.055 18852
1721 1 13 . 1 1 5 5 THR N N 5 112.671 112.671 114.041 -1.370 18852
1722 1 13 . 1 1 5 5 THR HA H 5 4.121 4.121 3.955 0.166 18852
1723 1 13 . 1 1 5 5 THR C C 5 176.085 176.085 176.435 -0.350 18852
1724 1 13 . 1 1 5 5 THR CA C 5 65.053 65.053 66.674 -1.621 18852
1725 1 13 . 1 1 5 5 THR CB C 5 68.989 68.989 68.511 0.478 18852
1726 1 13 . 1 1 5 5 THR H H 5 7.966 7.966 7.772 0.194 18852
1727 1 13 . 1 1 6 6 ARG N N 6 122.300 122.300 121.352 0.948 18852
1728 1 13 . 1 1 6 6 ARG HA H 6 4.057 4.057 4.074 -0.017 18852
1729 1 13 . 1 1 6 6 ARG C C 6 178.983 178.983 178.617 0.366 18852
1730 1 13 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.183 0.780 18852
1731 1 13 . 1 1 6 6 ARG CB C 6 29.853 29.853 30.177 -0.324 18852
1732 1 13 . 1 1 6 6 ARG H H 6 8.244 8.244 8.129 0.115 18852
1733 1 13 . 1 1 7 7 GLN N N 7 118.940 118.940 119.299 -0.359 18852
1734 1 13 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.087 -0.029 18852
1735 1 13 . 1 1 7 7 GLN C C 7 177.997 177.997 177.872 0.125 18852
1736 1 13 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.184 0.551 18852
1737 1 13 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.082 0.106 18852
1738 1 13 . 1 1 7 7 GLN H H 7 8.424 8.424 7.771 0.653 18852
1739 1 13 . 1 1 8 8 ALA N N 8 122.920 122.920 122.203 0.717 18852
1740 1 13 . 1 1 8 8 ALA HA H 8 4.217 4.217 3.966 0.251 18852
1741 1 13 . 1 1 8 8 ALA C C 8 180.837 180.837 179.750 1.087 18852
1742 1 13 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.974 0.345 18852
1743 1 13 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.218 -0.523 18852
1744 1 13 . 1 1 8 8 ALA H H 8 8.306 8.306 8.001 0.305 18852
1745 1 13 . 1 1 9 9 ARG N N 9 118.721 118.721 118.145 0.576 18852
1746 1 13 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.037 0.013 18852
1747 1 13 . 1 1 9 9 ARG C C 9 178.843 178.843 179.069 -0.226 18852
1748 1 13 . 1 1 9 9 ARG CA C 9 59.721 59.721 59.584 0.137 18852
1749 1 13 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.675 0.493 18852
1750 1 13 . 1 1 9 9 ARG H H 9 8.263 8.263 7.888 0.375 18852
1751 1 13 . 1 1 10 10 ARG N N 10 120.338 120.338 119.334 1.004 18852
1752 1 13 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.059 0.015 18852
1753 1 13 . 1 1 10 10 ARG C C 10 179.024 179.024 178.748 0.276 18852
1754 1 13 . 1 1 10 10 ARG CA C 10 59.542 59.542 59.162 0.380 18852
1755 1 13 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.715 0.188 18852
1756 1 13 . 1 1 10 10 ARG H H 10 8.251 8.251 7.719 0.532 18852
1757 1 13 . 1 1 11 11 ASN N N 11 118.863 118.863 118.621 0.242 18852
1758 1 13 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.471 0.072 18852
1759 1 13 . 1 1 11 11 ASN C C 11 177.279 177.279 177.734 -0.455 18852
1760 1 13 . 1 1 11 11 ASN CA C 11 55.979 55.979 56.092 -0.113 18852
1761 1 13 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.097 -0.114 18852
1762 1 13 . 1 1 11 11 ASN H H 11 8.551 8.551 8.368 0.183 18852
1763 1 13 . 1 1 12 12 ARG N N 12 120.917 120.917 120.214 0.703 18852
1764 1 13 . 1 1 12 12 ARG HA H 12 4.079 4.079 4.068 0.011 18852
1765 1 13 . 1 1 12 12 ARG C C 12 178.488 178.488 178.428 0.060 18852
1766 1 13 . 1 1 12 12 ARG CA C 12 59.787 59.787 58.831 0.956 18852
1767 1 13 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.077 -0.140 18852
1768 1 13 . 1 1 12 12 ARG H H 12 8.253 8.253 8.315 -0.062 18852
1769 1 13 . 1 1 13 13 ARG N N 13 119.263 119.263 118.277 0.986 18852
1770 1 13 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.264 -0.075 18852
1771 1 13 . 1 1 13 13 ARG C C 13 178.479 178.479 178.917 -0.438 18852
1772 1 13 . 1 1 13 13 ARG CA C 13 59.572 59.572 58.270 1.302 18852
1773 1 13 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.725 0.342 18852
1774 1 13 . 1 1 13 13 ARG H H 13 8.167 8.167 7.541 0.626 18852
1775 1 13 . 1 1 14 14 ARG N N 14 119.756 119.756 120.375 -0.619 18852
1776 1 13 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.048 0.093 18852
1777 1 13 . 1 1 14 14 ARG C C 14 178.817 178.817 178.155 0.662 18852
1778 1 13 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.429 0.266 18852
1779 1 13 . 1 1 14 14 ARG CB C 14 29.812 29.812 30.065 -0.253 18852
1780 1 13 . 1 1 14 14 ARG H H 14 8.285 8.285 8.166 0.119 18852
1781 1 13 . 1 1 15 15 ARG N N 15 119.026 119.026 120.602 -1.576 18852
1782 1 13 . 1 1 15 15 ARG HA H 15 4.158 4.158 3.968 0.190 18852
1783 1 13 . 1 1 15 15 ARG C C 15 178.909 178.909 178.351 0.558 18852
1784 1 13 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.455 -0.222 18852
1785 1 13 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.480 0.291 18852
1786 1 13 . 1 1 15 15 ARG H H 15 8.278 8.278 7.772 0.506 18852
1787 1 13 . 1 1 16 16 TRP N N 16 121.055 121.055 118.645 2.410 18852
1788 1 13 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.395 -0.006 18852
1789 1 13 . 1 1 16 16 TRP C C 16 178.621 178.621 178.917 -0.296 18852
1790 1 13 . 1 1 16 16 TRP CA C 16 61.013 61.013 59.937 1.076 18852
1791 1 13 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.318 -0.522 18852
1792 1 13 . 1 1 16 16 TRP H H 16 8.464 8.464 7.584 0.880 18852
1793 1 13 . 1 1 17 17 ARG N N 17 119.474 119.474 118.947 0.527 18852
1794 1 13 . 1 1 17 17 ARG HA H 17 3.910 3.910 4.101 -0.191 18852
1795 1 13 . 1 1 17 17 ARG C C 17 179.120 179.120 178.867 0.253 18852
1796 1 13 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.977 0.650 18852
1797 1 13 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.823 0.084 18852
1798 1 13 . 1 1 17 17 ARG H H 17 8.537 8.537 7.572 0.965 18852
1799 1 13 . 1 1 18 18 GLU N N 18 119.223 119.223 118.590 0.633 18852
1800 1 13 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.150 -0.089 18852
1801 1 13 . 1 1 18 18 GLU C C 18 179.163 179.163 179.059 0.104 18852
1802 1 13 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.319 0.819 18852
1803 1 13 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.283 -0.148 18852
1804 1 13 . 1 1 18 18 GLU H H 18 8.346 8.346 8.325 0.021 18852
1805 1 13 . 1 1 19 19 ARG N N 19 119.942 119.942 119.615 0.327 18852
1806 1 13 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.040 0.006 18852
1807 1 13 . 1 1 19 19 ARG C C 19 178.634 178.634 178.660 -0.026 18852
1808 1 13 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.236 0.780 18852
1809 1 13 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.016 -0.645 18852
1810 1 13 . 1 1 19 19 ARG H H 19 8.104 8.104 8.008 0.096 18852
1811 1 13 . 1 1 20 20 GLN N N 20 118.373 118.373 118.084 0.289 18852
1812 1 13 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.247 -0.355 18852
1813 1 13 . 1 1 20 20 GLN C C 20 178.465 178.465 177.907 0.558 18852
1814 1 13 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.401 -0.231 18852
1815 1 13 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.632 -0.519 18852
1816 1 13 . 1 1 20 20 GLN H H 20 8.044 8.044 7.659 0.385 18852
1817 1 13 . 1 1 21 21 ARG N N 21 119.374 119.374 119.490 -0.116 18852
1818 1 13 . 1 1 21 21 ARG HA H 21 4.034 4.034 4.020 0.014 18852
1819 1 13 . 1 1 21 21 ARG C C 21 178.423 178.423 178.087 0.336 18852
1820 1 13 . 1 1 21 21 ARG CA C 21 58.765 58.765 59.199 -0.434 18852
1821 1 13 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.844 -0.168 18852
1822 1 13 . 1 1 21 21 ARG H H 21 8.079 8.079 7.684 0.395 18852
1823 1 13 . 1 1 22 22 ALA N N 22 121.393 121.393 120.115 1.278 18852
1824 1 13 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.130 0.016 18852
1825 1 13 . 1 1 22 22 ALA C C 22 179.577 179.577 178.324 1.253 18852
1826 1 13 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.870 -0.603 18852
1827 1 13 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.468 -0.637 18852
1828 1 13 . 1 1 22 22 ALA H H 22 8.026 8.026 7.621 0.405 18852
1829 1 13 . 1 1 23 23 ALA N N 23 119.867 119.867 120.528 -0.661 18852
1830 1 13 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.260 -0.102 18852
1831 1 13 . 1 1 23 23 ALA C C 23 178.616 178.616 179.534 -0.918 18852
1832 1 13 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.788 -0.074 18852
1833 1 13 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.838 -0.793 18852
1834 1 13 . 1 1 23 23 ALA H H 23 7.938 7.938 7.630 0.308 18852
1835 1 13 . 1 1 24 24 ALA N N 24 119.652 119.652 121.632 -1.980 18852
1836 1 13 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.122 0.169 18852
1837 1 13 . 1 1 24 24 ALA C C 24 177.528 177.528 177.661 -0.133 18852
1838 1 13 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.656 -0.950 18852
1839 1 13 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.256 -0.665 18852
1840 1 13 . 1 1 24 24 ALA H H 24 7.693 7.693 8.415 -0.722 18852
1841 1 13 . 1 1 25 25 ALA N N 25 121.574 121.574 120.513 1.061 18852
1842 1 13 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.590 -0.261 18852
1843 1 13 . 1 1 25 25 ALA C C 25 176.649 176.649 176.019 0.630 18852
1844 1 13 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.668 1.898 18852
1845 1 13 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.522 -1.892 18852
1846 1 13 . 1 1 25 25 ALA H H 25 7.679 7.679 7.729 -0.050 18852
1847 1 14 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.285 -0.046 18852
1848 1 14 . 1 1 2 2 ALA C C 2 179.180 179.180 179.229 -0.049 18852
1849 1 14 . 1 1 2 2 ALA CA C 2 54.532 54.532 53.580 0.952 18852
1850 1 14 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.532 -1.135 18852
1851 1 14 . 1 1 3 3 MET N N 3 117.814 117.814 117.106 0.708 18852
1852 1 14 . 1 1 3 3 MET HA H 3 4.354 4.354 4.329 0.025 18852
1853 1 14 . 1 1 3 3 MET C C 3 177.926 177.926 177.393 0.533 18852
1854 1 14 . 1 1 3 3 MET CA C 3 57.876 57.876 57.841 0.035 18852
1855 1 14 . 1 1 3 3 MET CB C 3 31.673 31.673 32.013 -0.340 18852
1856 1 14 . 1 1 3 3 MET H H 3 8.613 8.613 8.221 0.392 18852
1857 1 14 . 1 1 4 4 ALA N N 4 122.603 122.603 122.101 0.502 18852
1858 1 14 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.072 0.156 18852
1859 1 14 . 1 1 4 4 ALA C C 4 179.940 179.940 179.381 0.559 18852
1860 1 14 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.407 -0.718 18852
1861 1 14 . 1 1 4 4 ALA CB C 4 18.025 18.025 17.847 0.178 18852
1862 1 14 . 1 1 4 4 ALA H H 4 8.324 8.324 8.491 -0.167 18852
1863 1 14 . 1 1 5 5 THR N N 5 112.671 112.671 112.103 0.568 18852
1864 1 14 . 1 1 5 5 THR HA H 5 4.121 4.121 3.993 0.128 18852
1865 1 14 . 1 1 5 5 THR C C 5 176.085 176.085 176.665 -0.580 18852
1866 1 14 . 1 1 5 5 THR CA C 5 65.053 65.053 65.483 -0.430 18852
1867 1 14 . 1 1 5 5 THR CB C 5 68.989 68.989 68.418 0.571 18852
1868 1 14 . 1 1 5 5 THR H H 5 7.966 7.966 7.580 0.386 18852
1869 1 14 . 1 1 6 6 ARG N N 6 122.300 122.300 122.038 0.262 18852
1870 1 14 . 1 1 6 6 ARG HA H 6 4.057 4.057 3.919 0.138 18852
1871 1 14 . 1 1 6 6 ARG C C 6 178.983 178.983 178.920 0.063 18852
1872 1 14 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.525 0.438 18852
1873 1 14 . 1 1 6 6 ARG CB C 6 29.853 29.853 30.098 -0.245 18852
1874 1 14 . 1 1 6 6 ARG H H 6 8.244 8.244 7.505 0.739 18852
1875 1 14 . 1 1 7 7 GLN N N 7 118.940 118.940 119.117 -0.177 18852
1876 1 14 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.071 -0.013 18852
1877 1 14 . 1 1 7 7 GLN C C 7 177.997 177.997 177.703 0.294 18852
1878 1 14 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.570 0.165 18852
1879 1 14 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.603 -0.415 18852
1880 1 14 . 1 1 7 7 GLN H H 7 8.424 8.424 7.999 0.425 18852
1881 1 14 . 1 1 8 8 ALA N N 8 122.920 122.920 121.288 1.632 18852
1882 1 14 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.064 0.153 18852
1883 1 14 . 1 1 8 8 ALA C C 8 180.837 180.837 179.578 1.259 18852
1884 1 14 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.796 0.523 18852
1885 1 14 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.365 -0.670 18852
1886 1 14 . 1 1 8 8 ALA H H 8 8.306 8.306 7.685 0.621 18852
1887 1 14 . 1 1 9 9 ARG N N 9 118.721 118.721 117.568 1.153 18852
1888 1 14 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.200 -0.150 18852
1889 1 14 . 1 1 9 9 ARG C C 9 178.843 178.843 178.478 0.365 18852
1890 1 14 . 1 1 9 9 ARG CA C 9 59.721 59.721 57.813 1.908 18852
1891 1 14 . 1 1 9 9 ARG CB C 9 30.168 30.168 30.183 -0.015 18852
1892 1 14 . 1 1 9 9 ARG H H 9 8.263 8.263 7.758 0.505 18852
1893 1 14 . 1 1 10 10 ARG N N 10 120.338 120.338 119.129 1.209 18852
1894 1 14 . 1 1 10 10 ARG HA H 10 4.074 4.074 3.982 0.092 18852
1895 1 14 . 1 1 10 10 ARG C C 10 179.024 179.024 178.614 0.410 18852
1896 1 14 . 1 1 10 10 ARG CA C 10 59.542 59.542 59.743 -0.201 18852
1897 1 14 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.995 -0.091 18852
1898 1 14 . 1 1 10 10 ARG H H 10 8.251 8.251 7.711 0.540 18852
1899 1 14 . 1 1 11 11 ASN N N 11 118.863 118.863 115.047 3.816 18852
1900 1 14 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.649 -0.106 18852
1901 1 14 . 1 1 11 11 ASN C C 11 177.279 177.279 176.736 0.543 18852
1902 1 14 . 1 1 11 11 ASN CA C 11 55.979 55.979 55.152 0.827 18852
1903 1 14 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.135 -0.152 18852
1904 1 14 . 1 1 11 11 ASN H H 11 8.551 8.551 7.924 0.627 18852
1905 1 14 . 1 1 12 12 ARG N N 12 120.917 120.917 121.445 -0.528 18852
1906 1 14 . 1 1 12 12 ARG HA H 12 4.079 4.079 4.108 -0.029 18852
1907 1 14 . 1 1 12 12 ARG C C 12 178.488 178.488 177.821 0.667 18852
1908 1 14 . 1 1 12 12 ARG CA C 12 59.787 59.787 58.382 1.405 18852
1909 1 14 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.389 -0.452 18852
1910 1 14 . 1 1 12 12 ARG H H 12 8.253 8.253 7.734 0.519 18852
1911 1 14 . 1 1 13 13 ARG N N 13 119.263 119.263 117.170 2.093 18852
1912 1 14 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.366 -0.177 18852
1913 1 14 . 1 1 13 13 ARG C C 13 178.479 178.479 178.405 0.074 18852
1914 1 14 . 1 1 13 13 ARG CA C 13 59.572 59.572 58.106 1.466 18852
1915 1 14 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.703 0.364 18852
1916 1 14 . 1 1 13 13 ARG H H 13 8.167 8.167 8.345 -0.178 18852
1917 1 14 . 1 1 14 14 ARG N N 14 119.756 119.756 120.008 -0.252 18852
1918 1 14 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.252 -0.111 18852
1919 1 14 . 1 1 14 14 ARG C C 14 178.817 178.817 177.992 0.825 18852
1920 1 14 . 1 1 14 14 ARG CA C 14 59.695 59.695 57.679 2.015 18852
1921 1 14 . 1 1 14 14 ARG CB C 14 29.812 29.812 29.906 -0.094 18852
1922 1 14 . 1 1 14 14 ARG H H 14 8.285 8.285 7.705 0.580 18852
1923 1 14 . 1 1 15 15 ARG N N 15 119.026 119.026 120.362 -1.336 18852
1924 1 14 . 1 1 15 15 ARG HA H 15 4.158 4.158 3.928 0.230 18852
1925 1 14 . 1 1 15 15 ARG C C 15 178.909 178.909 178.640 0.269 18852
1926 1 14 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.621 -0.388 18852
1927 1 14 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.756 0.016 18852
1928 1 14 . 1 1 15 15 ARG H H 15 8.278 8.278 7.521 0.757 18852
1929 1 14 . 1 1 16 16 TRP N N 16 121.055 121.055 117.863 3.192 18852
1930 1 14 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.396 -0.007 18852
1931 1 14 . 1 1 16 16 TRP C C 16 178.621 178.621 178.425 0.196 18852
1932 1 14 . 1 1 16 16 TRP CA C 16 61.013 61.013 59.019 1.994 18852
1933 1 14 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.371 -0.575 18852
1934 1 14 . 1 1 16 16 TRP H H 16 8.464 8.464 7.486 0.978 18852
1935 1 14 . 1 1 17 17 ARG N N 17 119.474 119.474 119.808 -0.334 18852
1936 1 14 . 1 1 17 17 ARG HA H 17 3.910 3.910 4.062 -0.152 18852
1937 1 14 . 1 1 17 17 ARG C C 17 179.120 179.120 178.147 0.973 18852
1938 1 14 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.910 0.717 18852
1939 1 14 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.882 0.025 18852
1940 1 14 . 1 1 17 17 ARG H H 17 8.537 8.537 8.052 0.485 18852
1941 1 14 . 1 1 18 18 GLU N N 18 119.223 119.223 117.843 1.380 18852
1942 1 14 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.065 -0.004 18852
1943 1 14 . 1 1 18 18 GLU C C 18 179.163 179.163 178.878 0.285 18852
1944 1 14 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.989 0.149 18852
1945 1 14 . 1 1 18 18 GLU CB C 18 29.135 29.135 28.990 0.145 18852
1946 1 14 . 1 1 18 18 GLU H H 18 8.346 8.346 8.079 0.267 18852
1947 1 14 . 1 1 19 19 ARG N N 19 119.942 119.942 117.420 2.522 18852
1948 1 14 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.300 -0.254 18852
1949 1 14 . 1 1 19 19 ARG C C 19 178.634 178.634 178.859 -0.225 18852
1950 1 14 . 1 1 19 19 ARG CA C 19 59.016 59.016 57.253 1.763 18852
1951 1 14 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.109 -0.738 18852
1952 1 14 . 1 1 19 19 ARG H H 19 8.104 8.104 7.735 0.369 18852
1953 1 14 . 1 1 20 20 GLN N N 20 118.373 118.373 120.542 -2.169 18852
1954 1 14 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.187 -0.295 18852
1955 1 14 . 1 1 20 20 GLN C C 20 178.465 178.465 177.740 0.725 18852
1956 1 14 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.707 -0.537 18852
1957 1 14 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.538 -0.425 18852
1958 1 14 . 1 1 20 20 GLN H H 20 8.044 8.044 8.080 -0.036 18852
1959 1 14 . 1 1 21 21 ARG N N 21 119.374 119.374 120.121 -0.747 18852
1960 1 14 . 1 1 21 21 ARG HA H 21 4.034 4.034 4.023 0.011 18852
1961 1 14 . 1 1 21 21 ARG C C 21 178.423 178.423 178.289 0.134 18852
1962 1 14 . 1 1 21 21 ARG CA C 21 58.765 58.765 58.776 -0.011 18852
1963 1 14 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.605 0.071 18852
1964 1 14 . 1 1 21 21 ARG H H 21 8.079 8.079 7.819 0.260 18852
1965 1 14 . 1 1 22 22 ALA N N 22 121.393 121.393 120.263 1.130 18852
1966 1 14 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.183 -0.037 18852
1967 1 14 . 1 1 22 22 ALA C C 22 179.577 179.577 178.469 1.108 18852
1968 1 14 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.922 -0.655 18852
1969 1 14 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.503 -0.672 18852
1970 1 14 . 1 1 22 22 ALA H H 22 8.026 8.026 7.560 0.466 18852
1971 1 14 . 1 1 23 23 ALA N N 23 119.867 119.867 120.724 -0.857 18852
1972 1 14 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.265 -0.107 18852
1973 1 14 . 1 1 23 23 ALA C C 23 178.616 178.616 179.472 -0.856 18852
1974 1 14 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.857 -0.143 18852
1975 1 14 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.882 -0.837 18852
1976 1 14 . 1 1 23 23 ALA H H 23 7.938 7.938 7.678 0.260 18852
1977 1 14 . 1 1 24 24 ALA N N 24 119.652 119.652 121.427 -1.775 18852
1978 1 14 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.149 0.142 18852
1979 1 14 . 1 1 24 24 ALA C C 24 177.528 177.528 177.654 -0.126 18852
1980 1 14 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.513 -0.807 18852
1981 1 14 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.289 -0.698 18852
1982 1 14 . 1 1 24 24 ALA H H 24 7.693 7.693 8.440 -0.747 18852
1983 1 14 . 1 1 25 25 ALA N N 25 121.574 121.574 120.512 1.062 18852
1984 1 14 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.592 -0.263 18852
1985 1 14 . 1 1 25 25 ALA C C 25 176.649 176.649 175.704 0.945 18852
1986 1 14 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.911 1.655 18852
1987 1 14 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.578 -1.948 18852
1988 1 14 . 1 1 25 25 ALA H H 25 7.679 7.679 7.803 -0.124 18852
1989 1 15 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.186 0.053 18852
1990 1 15 . 1 1 2 2 ALA C C 2 179.180 179.180 179.618 -0.438 18852
1991 1 15 . 1 1 2 2 ALA CA C 2 54.532 54.532 54.181 0.351 18852
1992 1 15 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.343 -0.946 18852
1993 1 15 . 1 1 3 3 MET N N 3 117.814 117.814 117.384 0.430 18852
1994 1 15 . 1 1 3 3 MET HA H 3 4.354 4.354 4.305 0.049 18852
1995 1 15 . 1 1 3 3 MET C C 3 177.926 177.926 178.017 -0.091 18852
1996 1 15 . 1 1 3 3 MET CA C 3 57.876 57.876 57.749 0.127 18852
1997 1 15 . 1 1 3 3 MET CB C 3 31.673 31.673 32.323 -0.650 18852
1998 1 15 . 1 1 3 3 MET H H 3 8.613 8.613 8.291 0.322 18852
1999 1 15 . 1 1 4 4 ALA N N 4 122.603 122.603 122.167 0.436 18852
2000 1 15 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.206 0.022 18852
2001 1 15 . 1 1 4 4 ALA C C 4 179.940 179.940 179.171 0.769 18852
2002 1 15 . 1 1 4 4 ALA CA C 4 54.689 54.689 54.892 -0.203 18852
2003 1 15 . 1 1 4 4 ALA CB C 4 18.025 18.025 18.398 -0.373 18852
2004 1 15 . 1 1 4 4 ALA H H 4 8.324 8.324 8.209 0.115 18852
2005 1 15 . 1 1 5 5 THR N N 5 112.671 112.671 112.034 0.637 18852
2006 1 15 . 1 1 5 5 THR HA H 5 4.121 4.121 4.086 0.035 18852
2007 1 15 . 1 1 5 5 THR C C 5 176.085 176.085 176.535 -0.450 18852
2008 1 15 . 1 1 5 5 THR CA C 5 65.053 65.053 64.904 0.149 18852
2009 1 15 . 1 1 5 5 THR CB C 5 68.989 68.989 68.695 0.294 18852
2010 1 15 . 1 1 5 5 THR H H 5 7.966 7.966 7.993 -0.027 18852
2011 1 15 . 1 1 6 6 ARG N N 6 122.300 122.300 121.984 0.316 18852
2012 1 15 . 1 1 6 6 ARG HA H 6 4.057 4.057 4.091 -0.034 18852
2013 1 15 . 1 1 6 6 ARG C C 6 178.983 178.983 178.942 0.041 18852
2014 1 15 . 1 1 6 6 ARG CA C 6 59.963 59.963 58.698 1.265 18852
2015 1 15 . 1 1 6 6 ARG CB C 6 29.853 29.853 29.714 0.139 18852
2016 1 15 . 1 1 6 6 ARG H H 6 8.244 8.244 7.568 0.676 18852
2017 1 15 . 1 1 7 7 GLN N N 7 118.940 118.940 119.322 -0.382 18852
2018 1 15 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.106 -0.048 18852
2019 1 15 . 1 1 7 7 GLN C C 7 177.997 177.997 177.836 0.161 18852
2020 1 15 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.551 0.184 18852
2021 1 15 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.756 -0.569 18852
2022 1 15 . 1 1 7 7 GLN H H 7 8.424 8.424 7.764 0.660 18852
2023 1 15 . 1 1 8 8 ALA N N 8 122.920 122.920 121.707 1.213 18852
2024 1 15 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.012 0.205 18852
2025 1 15 . 1 1 8 8 ALA C C 8 180.837 180.837 179.589 1.248 18852
2026 1 15 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.857 0.462 18852
2027 1 15 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.292 -0.597 18852
2028 1 15 . 1 1 8 8 ALA H H 8 8.306 8.306 7.729 0.577 18852
2029 1 15 . 1 1 9 9 ARG N N 9 118.721 118.721 118.911 -0.190 18852
2030 1 15 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.052 -0.002 18852
2031 1 15 . 1 1 9 9 ARG C C 9 178.843 178.843 178.581 0.262 18852
2032 1 15 . 1 1 9 9 ARG CA C 9 59.721 59.721 59.057 0.664 18852
2033 1 15 . 1 1 9 9 ARG CB C 9 30.168 30.168 30.143 0.025 18852
2034 1 15 . 1 1 9 9 ARG H H 9 8.263 8.263 7.709 0.554 18852
2035 1 15 . 1 1 10 10 ARG N N 10 120.338 120.338 118.651 1.687 18852
2036 1 15 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.011 0.063 18852
2037 1 15 . 1 1 10 10 ARG C C 10 179.024 179.024 178.706 0.318 18852
2038 1 15 . 1 1 10 10 ARG CA C 10 59.542 59.542 58.922 0.620 18852
2039 1 15 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.344 0.560 18852
2040 1 15 . 1 1 10 10 ARG H H 10 8.251 8.251 7.824 0.427 18852
2041 1 15 . 1 1 11 11 ASN N N 11 118.863 118.863 118.953 -0.090 18852
2042 1 15 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.440 0.103 18852
2043 1 15 . 1 1 11 11 ASN C C 11 177.279 177.279 177.387 -0.108 18852
2044 1 15 . 1 1 11 11 ASN CA C 11 55.979 55.979 56.337 -0.358 18852
2045 1 15 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.089 -0.105 18852
2046 1 15 . 1 1 11 11 ASN H H 11 8.551 8.551 8.710 -0.159 18852
2047 1 15 . 1 1 12 12 ARG N N 12 120.917 120.917 120.264 0.653 18852
2048 1 15 . 1 1 12 12 ARG HA H 12 4.079 4.079 3.987 0.092 18852
2049 1 15 . 1 1 12 12 ARG C C 12 178.488 178.488 178.765 -0.277 18852
2050 1 15 . 1 1 12 12 ARG CA C 12 59.787 59.787 59.701 0.086 18852
2051 1 15 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.175 -0.238 18852
2052 1 15 . 1 1 12 12 ARG H H 12 8.253 8.253 7.792 0.461 18852
2053 1 15 . 1 1 13 13 ARG N N 13 119.263 119.263 118.569 0.694 18852
2054 1 15 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.101 0.088 18852
2055 1 15 . 1 1 13 13 ARG C C 13 178.479 178.479 178.930 -0.451 18852
2056 1 15 . 1 1 13 13 ARG CA C 13 59.572 59.572 59.227 0.345 18852
2057 1 15 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.874 0.193 18852
2058 1 15 . 1 1 13 13 ARG H H 13 8.167 8.167 7.823 0.344 18852
2059 1 15 . 1 1 14 14 ARG N N 14 119.756 119.756 120.073 -0.317 18852
2060 1 15 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.042 0.099 18852
2061 1 15 . 1 1 14 14 ARG C C 14 178.817 178.817 179.041 -0.224 18852
2062 1 15 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.590 0.105 18852
2063 1 15 . 1 1 14 14 ARG CB C 14 29.812 29.812 30.132 -0.320 18852
2064 1 15 . 1 1 14 14 ARG H H 14 8.285 8.285 7.703 0.582 18852
2065 1 15 . 1 1 15 15 ARG N N 15 119.026 119.026 118.936 0.090 18852
2066 1 15 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.201 -0.043 18852
2067 1 15 . 1 1 15 15 ARG C C 15 178.909 178.909 178.753 0.156 18852
2068 1 15 . 1 1 15 15 ARG CA C 15 59.233 59.233 58.913 0.320 18852
2069 1 15 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.692 0.080 18852
2070 1 15 . 1 1 15 15 ARG H H 15 8.278 8.278 8.243 0.035 18852
2071 1 15 . 1 1 16 16 TRP N N 16 121.055 121.055 121.590 -0.535 18852
2072 1 15 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.350 0.039 18852
2073 1 15 . 1 1 16 16 TRP C C 16 178.621 178.621 178.225 0.396 18852
2074 1 15 . 1 1 16 16 TRP CA C 16 61.013 61.013 60.852 0.161 18852
2075 1 15 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.181 -0.385 18852
2076 1 15 . 1 1 16 16 TRP H H 16 8.464 8.464 7.870 0.594 18852
2077 1 15 . 1 1 17 17 ARG N N 17 119.474 119.474 118.327 1.147 18852
2078 1 15 . 1 1 17 17 ARG HA H 17 3.910 3.910 3.767 0.143 18852
2079 1 15 . 1 1 17 17 ARG C C 17 179.120 179.120 178.694 0.426 18852
2080 1 15 . 1 1 17 17 ARG CA C 17 59.627 59.627 59.117 0.510 18852
2081 1 15 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.577 0.330 18852
2082 1 15 . 1 1 17 17 ARG H H 17 8.537 8.537 7.741 0.796 18852
2083 1 15 . 1 1 18 18 GLU N N 18 119.223 119.223 118.599 0.624 18852
2084 1 15 . 1 1 18 18 GLU HA H 18 4.061 4.061 3.978 0.083 18852
2085 1 15 . 1 1 18 18 GLU C C 18 179.163 179.163 179.132 0.031 18852
2086 1 15 . 1 1 18 18 GLU CA C 18 59.138 59.138 59.165 -0.027 18852
2087 1 15 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.299 -0.164 18852
2088 1 15 . 1 1 18 18 GLU H H 18 8.346 8.346 7.680 0.666 18852
2089 1 15 . 1 1 19 19 ARG N N 19 119.942 119.942 118.072 1.870 18852
2090 1 15 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.014 0.031 18852
2091 1 15 . 1 1 19 19 ARG C C 19 178.634 178.634 178.387 0.247 18852
2092 1 15 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.872 0.144 18852
2093 1 15 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.322 -0.951 18852
2094 1 15 . 1 1 19 19 ARG H H 19 8.104 8.104 8.016 0.088 18852
2095 1 15 . 1 1 20 20 GLN N N 20 118.373 118.373 117.520 0.853 18852
2096 1 15 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.108 -0.216 18852
2097 1 15 . 1 1 20 20 GLN C C 20 178.465 178.465 177.850 0.615 18852
2098 1 15 . 1 1 20 20 GLN CA C 20 58.170 58.170 57.857 0.313 18852
2099 1 15 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.625 -0.512 18852
2100 1 15 . 1 1 20 20 GLN H H 20 8.044 8.044 7.623 0.421 18852
2101 1 15 . 1 1 21 21 ARG N N 21 119.374 119.374 120.888 -1.514 18852
2102 1 15 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.952 0.082 18852
2103 1 15 . 1 1 21 21 ARG C C 21 178.423 178.423 178.541 -0.118 18852
2104 1 15 . 1 1 21 21 ARG CA C 21 58.765 58.765 58.723 0.042 18852
2105 1 15 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.512 0.164 18852
2106 1 15 . 1 1 21 21 ARG H H 21 8.079 8.079 7.806 0.273 18852
2107 1 15 . 1 1 22 22 ALA N N 22 121.393 121.393 119.934 1.459 18852
2108 1 15 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.199 -0.053 18852
2109 1 15 . 1 1 22 22 ALA C C 22 179.577 179.577 178.360 1.217 18852
2110 1 15 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.784 -0.517 18852
2111 1 15 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.451 -0.621 18852
2112 1 15 . 1 1 22 22 ALA H H 22 8.026 8.026 7.584 0.442 18852
2113 1 15 . 1 1 23 23 ALA N N 23 119.867 119.867 120.861 -0.994 18852
2114 1 15 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.331 -0.173 18852
2115 1 15 . 1 1 23 23 ALA C C 23 178.616 178.616 178.808 -0.192 18852
2116 1 15 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.850 -0.136 18852
2117 1 15 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.562 -0.517 18852
2118 1 15 . 1 1 23 23 ALA H H 23 7.938 7.938 7.571 0.367 18852
2119 1 15 . 1 1 24 24 ALA N N 24 119.652 119.652 120.405 -0.753 18852
2120 1 15 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.164 0.127 18852
2121 1 15 . 1 1 24 24 ALA C C 24 177.528 177.528 177.604 -0.076 18852
2122 1 15 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.550 -0.844 18852
2123 1 15 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.376 -0.785 18852
2124 1 15 . 1 1 24 24 ALA H H 24 7.693 7.693 8.152 -0.459 18852
2125 1 15 . 1 1 25 25 ALA N N 25 121.574 121.574 120.613 0.961 18852
2126 1 15 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.563 -0.234 18852
2127 1 15 . 1 1 25 25 ALA C C 25 176.649 176.649 176.001 0.648 18852
2128 1 15 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.686 1.880 18852
2129 1 15 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.236 -1.606 18852
2130 1 15 . 1 1 25 25 ALA H H 25 7.679 7.679 7.671 0.008 18852
2131 1 16 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.101 0.138 18852
2132 1 16 . 1 1 2 2 ALA C C 2 179.180 179.180 179.449 -0.269 18852
2133 1 16 . 1 1 2 2 ALA CA C 2 54.532 54.532 54.676 -0.144 18852
2134 1 16 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.390 -0.994 18852
2135 1 16 . 1 1 3 3 MET N N 3 117.814 117.814 118.274 -0.460 18852
2136 1 16 . 1 1 3 3 MET HA H 3 4.354 4.354 4.417 -0.063 18852
2137 1 16 . 1 1 3 3 MET C C 3 177.926 177.926 177.931 -0.005 18852
2138 1 16 . 1 1 3 3 MET CA C 3 57.876 57.876 56.626 1.250 18852
2139 1 16 . 1 1 3 3 MET CB C 3 31.673 31.673 32.096 -0.423 18852
2140 1 16 . 1 1 3 3 MET H H 3 8.613 8.613 8.050 0.563 18852
2141 1 16 . 1 1 4 4 ALA N N 4 122.603 122.603 121.019 1.584 18852
2142 1 16 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.024 0.204 18852
2143 1 16 . 1 1 4 4 ALA C C 4 179.940 179.940 179.345 0.595 18852
2144 1 16 . 1 1 4 4 ALA CA C 4 54.689 54.689 54.994 -0.305 18852
2145 1 16 . 1 1 4 4 ALA CB C 4 18.025 18.025 17.964 0.061 18852
2146 1 16 . 1 1 4 4 ALA H H 4 8.324 8.324 8.306 0.018 18852
2147 1 16 . 1 1 5 5 THR N N 5 112.671 112.671 114.212 -1.541 18852
2148 1 16 . 1 1 5 5 THR HA H 5 4.121 4.121 3.937 0.184 18852
2149 1 16 . 1 1 5 5 THR C C 5 176.085 176.085 177.018 -0.933 18852
2150 1 16 . 1 1 5 5 THR CA C 5 65.053 65.053 66.355 -1.302 18852
2151 1 16 . 1 1 5 5 THR CB C 5 68.989 68.989 68.552 0.437 18852
2152 1 16 . 1 1 5 5 THR H H 5 7.966 7.966 7.829 0.137 18852
2153 1 16 . 1 1 6 6 ARG N N 6 122.300 122.300 122.354 -0.054 18852
2154 1 16 . 1 1 6 6 ARG HA H 6 4.057 4.057 3.941 0.116 18852
2155 1 16 . 1 1 6 6 ARG C C 6 178.983 178.983 178.099 0.884 18852
2156 1 16 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.525 0.438 18852
2157 1 16 . 1 1 6 6 ARG CB C 6 29.853 29.853 29.997 -0.143 18852
2158 1 16 . 1 1 6 6 ARG H H 6 8.244 8.244 7.851 0.393 18852
2159 1 16 . 1 1 7 7 GLN N N 7 118.940 118.940 118.275 0.665 18852
2160 1 16 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.059 -0.001 18852
2161 1 16 . 1 1 7 7 GLN C C 7 177.997 177.997 177.906 0.091 18852
2162 1 16 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.370 0.365 18852
2163 1 16 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.168 0.020 18852
2164 1 16 . 1 1 7 7 GLN H H 7 8.424 8.424 7.845 0.579 18852
2165 1 16 . 1 1 8 8 ALA N N 8 122.920 122.920 121.225 1.695 18852
2166 1 16 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.103 0.114 18852
2167 1 16 . 1 1 8 8 ALA C C 8 180.837 180.837 179.945 0.892 18852
2168 1 16 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.889 0.430 18852
2169 1 16 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.406 -0.711 18852
2170 1 16 . 1 1 8 8 ALA H H 8 8.306 8.306 7.682 0.624 18852
2171 1 16 . 1 1 9 9 ARG N N 9 118.721 118.721 117.821 0.900 18852
2172 1 16 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.160 -0.110 18852
2173 1 16 . 1 1 9 9 ARG C C 9 178.843 178.843 178.733 0.110 18852
2174 1 16 . 1 1 9 9 ARG CA C 9 59.721 59.721 58.565 1.156 18852
2175 1 16 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.900 0.268 18852
2176 1 16 . 1 1 9 9 ARG H H 9 8.263 8.263 7.797 0.466 18852
2177 1 16 . 1 1 10 10 ARG N N 10 120.338 120.338 120.287 0.051 18852
2178 1 16 . 1 1 10 10 ARG HA H 10 4.074 4.074 3.910 0.164 18852
2179 1 16 . 1 1 10 10 ARG C C 10 179.024 179.024 178.555 0.469 18852
2180 1 16 . 1 1 10 10 ARG CA C 10 59.542 59.542 60.047 -0.505 18852
2181 1 16 . 1 1 10 10 ARG CB C 10 29.904 29.904 30.012 -0.108 18852
2182 1 16 . 1 1 10 10 ARG H H 10 8.251 8.251 7.829 0.422 18852
2183 1 16 . 1 1 11 11 ASN N N 11 118.863 118.863 116.734 2.129 18852
2184 1 16 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.506 0.037 18852
2185 1 16 . 1 1 11 11 ASN C C 11 177.279 177.279 177.564 -0.285 18852
2186 1 16 . 1 1 11 11 ASN CA C 11 55.979 55.979 55.737 0.242 18852
2187 1 16 . 1 1 11 11 ASN CB C 11 37.983 37.983 37.662 0.321 18852
2188 1 16 . 1 1 11 11 ASN H H 11 8.551 8.551 7.898 0.653 18852
2189 1 16 . 1 1 12 12 ARG N N 12 120.917 120.917 121.129 -0.212 18852
2190 1 16 . 1 1 12 12 ARG HA H 12 4.079 4.079 3.971 0.108 18852
2191 1 16 . 1 1 12 12 ARG C C 12 178.488 178.488 178.904 -0.416 18852
2192 1 16 . 1 1 12 12 ARG CA C 12 59.787 59.787 59.776 0.011 18852
2193 1 16 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.128 -0.191 18852
2194 1 16 . 1 1 12 12 ARG H H 12 8.253 8.253 7.736 0.517 18852
2195 1 16 . 1 1 13 13 ARG N N 13 119.263 119.263 118.066 1.197 18852
2196 1 16 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.237 -0.048 18852
2197 1 16 . 1 1 13 13 ARG C C 13 178.479 178.479 178.675 -0.196 18852
2198 1 16 . 1 1 13 13 ARG CA C 13 59.572 59.572 59.159 0.413 18852
2199 1 16 . 1 1 13 13 ARG CB C 13 30.067 30.067 30.109 -0.042 18852
2200 1 16 . 1 1 13 13 ARG H H 13 8.167 8.167 8.292 -0.125 18852
2201 1 16 . 1 1 14 14 ARG N N 14 119.756 119.756 120.257 -0.501 18852
2202 1 16 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.118 0.023 18852
2203 1 16 . 1 1 14 14 ARG C C 14 178.817 178.817 178.182 0.635 18852
2204 1 16 . 1 1 14 14 ARG CA C 14 59.695 59.695 58.985 0.710 18852
2205 1 16 . 1 1 14 14 ARG CB C 14 29.812 29.812 29.854 -0.042 18852
2206 1 16 . 1 1 14 14 ARG H H 14 8.285 8.285 7.525 0.760 18852
2207 1 16 . 1 1 15 15 ARG N N 15 119.026 119.026 119.963 -0.937 18852
2208 1 16 . 1 1 15 15 ARG HA H 15 4.158 4.158 3.981 0.177 18852
2209 1 16 . 1 1 15 15 ARG C C 15 178.909 178.909 178.453 0.456 18852
2210 1 16 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.705 -0.472 18852
2211 1 16 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.870 -0.098 18852
2212 1 16 . 1 1 15 15 ARG H H 15 8.278 8.278 7.997 0.281 18852
2213 1 16 . 1 1 16 16 TRP N N 16 121.055 121.055 119.827 1.228 18852
2214 1 16 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.368 0.021 18852
2215 1 16 . 1 1 16 16 TRP C C 16 178.621 178.621 178.015 0.606 18852
2216 1 16 . 1 1 16 16 TRP CA C 16 61.013 61.013 60.398 0.615 18852
2217 1 16 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.113 -0.317 18852
2218 1 16 . 1 1 16 16 TRP H H 16 8.464 8.464 7.807 0.657 18852
2219 1 16 . 1 1 17 17 ARG N N 17 119.474 119.474 118.594 0.880 18852
2220 1 16 . 1 1 17 17 ARG HA H 17 3.910 3.910 3.877 0.033 18852
2221 1 16 . 1 1 17 17 ARG C C 17 179.120 179.120 178.836 0.284 18852
2222 1 16 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.392 1.235 18852
2223 1 16 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.921 -0.014 18852
2224 1 16 . 1 1 17 17 ARG H H 17 8.537 8.537 7.327 1.210 18852
2225 1 16 . 1 1 18 18 GLU N N 18 119.223 119.223 119.446 -0.223 18852
2226 1 16 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.053 0.008 18852
2227 1 16 . 1 1 18 18 GLU C C 18 179.163 179.163 179.362 -0.199 18852
2228 1 16 . 1 1 18 18 GLU CA C 18 59.138 59.138 59.181 -0.043 18852
2229 1 16 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.183 -0.048 18852
2230 1 16 . 1 1 18 18 GLU H H 18 8.346 8.346 8.494 -0.148 18852
2231 1 16 . 1 1 19 19 ARG N N 19 119.942 119.942 118.724 1.218 18852
2232 1 16 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.233 -0.187 18852
2233 1 16 . 1 1 19 19 ARG C C 19 178.634 178.634 178.615 0.019 18852
2234 1 16 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.236 0.780 18852
2235 1 16 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.229 -0.858 18852
2236 1 16 . 1 1 19 19 ARG H H 19 8.104 8.104 8.637 -0.533 18852
2237 1 16 . 1 1 20 20 GLN N N 20 118.373 118.373 119.611 -1.238 18852
2238 1 16 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.044 -0.152 18852
2239 1 16 . 1 1 20 20 GLN C C 20 178.465 178.465 177.572 0.893 18852
2240 1 16 . 1 1 20 20 GLN CA C 20 58.170 58.170 59.021 -0.851 18852
2241 1 16 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.102 0.011 18852
2242 1 16 . 1 1 20 20 GLN H H 20 8.044 8.044 7.947 0.097 18852
2243 1 16 . 1 1 21 21 ARG N N 21 119.374 119.374 119.452 -0.078 18852
2244 1 16 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.973 0.061 18852
2245 1 16 . 1 1 21 21 ARG C C 21 178.423 178.423 178.372 0.051 18852
2246 1 16 . 1 1 21 21 ARG CA C 21 58.765 58.765 58.874 -0.109 18852
2247 1 16 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.713 -0.037 18852
2248 1 16 . 1 1 21 21 ARG H H 21 8.079 8.079 7.623 0.456 18852
2249 1 16 . 1 1 22 22 ALA N N 22 121.393 121.393 120.562 0.831 18852
2250 1 16 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.051 0.095 18852
2251 1 16 . 1 1 22 22 ALA C C 22 179.577 179.577 178.391 1.186 18852
2252 1 16 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.988 -0.721 18852
2253 1 16 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.439 -0.608 18852
2254 1 16 . 1 1 22 22 ALA H H 22 8.026 8.026 7.765 0.261 18852
2255 1 16 . 1 1 23 23 ALA N N 23 119.867 119.867 120.482 -0.615 18852
2256 1 16 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.098 0.060 18852
2257 1 16 . 1 1 23 23 ALA C C 23 178.616 178.616 179.518 -0.902 18852
2258 1 16 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.992 -0.278 18852
2259 1 16 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.849 -0.805 18852
2260 1 16 . 1 1 23 23 ALA H H 23 7.938 7.938 7.441 0.497 18852
2261 1 16 . 1 1 24 24 ALA N N 24 119.652 119.652 121.147 -1.495 18852
2262 1 16 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.059 0.232 18852
2263 1 16 . 1 1 24 24 ALA C C 24 177.528 177.528 177.898 -0.370 18852
2264 1 16 . 1 1 24 24 ALA CA C 24 52.706 52.706 54.246 -1.540 18852
2265 1 16 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.020 -0.429 18852
2266 1 16 . 1 1 24 24 ALA H H 24 7.693 7.693 8.339 -0.646 18852
2267 1 16 . 1 1 25 25 ALA N N 25 121.574 121.574 120.726 0.848 18852
2268 1 16 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.532 -0.203 18852
2269 1 16 . 1 1 25 25 ALA C C 25 176.649 176.649 175.728 0.921 18852
2270 1 16 . 1 1 25 25 ALA CA C 25 52.566 52.566 51.160 1.406 18852
2271 1 16 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.086 -1.456 18852
2272 1 16 . 1 1 25 25 ALA H H 25 7.679 7.679 7.876 -0.197 18852
2273 1 17 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.106 0.133 18852
2274 1 17 . 1 1 2 2 ALA C C 2 179.180 179.180 179.672 -0.492 18852
2275 1 17 . 1 1 2 2 ALA CA C 2 54.532 54.532 54.571 -0.039 18852
2276 1 17 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.106 -0.709 18852
2277 1 17 . 1 1 3 3 MET N N 3 117.814 117.814 118.134 -0.320 18852
2278 1 17 . 1 1 3 3 MET HA H 3 4.354 4.354 4.338 0.016 18852
2279 1 17 . 1 1 3 3 MET C C 3 177.926 177.926 178.190 -0.264 18852
2280 1 17 . 1 1 3 3 MET CA C 3 57.876 57.876 57.567 0.309 18852
2281 1 17 . 1 1 3 3 MET CB C 3 31.673 31.673 31.850 -0.177 18852
2282 1 17 . 1 1 3 3 MET H H 3 8.613 8.613 8.240 0.373 18852
2283 1 17 . 1 1 4 4 ALA N N 4 122.603 122.603 121.061 1.542 18852
2284 1 17 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.123 0.105 18852
2285 1 17 . 1 1 4 4 ALA C C 4 179.940 179.940 179.986 -0.046 18852
2286 1 17 . 1 1 4 4 ALA CA C 4 54.689 54.689 54.971 -0.282 18852
2287 1 17 . 1 1 4 4 ALA CB C 4 18.025 18.025 18.286 -0.261 18852
2288 1 17 . 1 1 4 4 ALA H H 4 8.324 8.324 8.361 -0.037 18852
2289 1 17 . 1 1 5 5 THR N N 5 112.671 112.671 114.652 -1.981 18852
2290 1 17 . 1 1 5 5 THR HA H 5 4.121 4.121 4.106 0.015 18852
2291 1 17 . 1 1 5 5 THR C C 5 176.085 176.085 176.228 -0.143 18852
2292 1 17 . 1 1 5 5 THR CA C 5 65.053 65.053 66.358 -1.305 18852
2293 1 17 . 1 1 5 5 THR CB C 5 68.989 68.989 68.721 0.268 18852
2294 1 17 . 1 1 5 5 THR H H 5 7.966 7.966 7.935 0.031 18852
2295 1 17 . 1 1 6 6 ARG N N 6 122.300 122.300 122.501 -0.201 18852
2296 1 17 . 1 1 6 6 ARG HA H 6 4.057 4.057 3.900 0.157 18852
2297 1 17 . 1 1 6 6 ARG C C 6 178.983 178.983 178.194 0.789 18852
2298 1 17 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.843 0.120 18852
2299 1 17 . 1 1 6 6 ARG CB C 6 29.853 29.853 30.181 -0.328 18852
2300 1 17 . 1 1 6 6 ARG H H 6 8.244 8.244 7.646 0.598 18852
2301 1 17 . 1 1 7 7 GLN N N 7 118.940 118.940 117.735 1.205 18852
2302 1 17 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.064 -0.006 18852
2303 1 17 . 1 1 7 7 GLN C C 7 177.997 177.997 177.951 0.046 18852
2304 1 17 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.562 0.173 18852
2305 1 17 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.333 -0.145 18852
2306 1 17 . 1 1 7 7 GLN H H 7 8.424 8.424 7.711 0.713 18852
2307 1 17 . 1 1 8 8 ALA N N 8 122.920 122.920 122.742 0.178 18852
2308 1 17 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.026 0.191 18852
2309 1 17 . 1 1 8 8 ALA C C 8 180.837 180.837 179.744 1.093 18852
2310 1 17 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.916 0.404 18852
2311 1 17 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.114 -0.419 18852
2312 1 17 . 1 1 8 8 ALA H H 8 8.306 8.306 7.457 0.849 18852
2313 1 17 . 1 1 9 9 ARG N N 9 118.721 118.721 119.015 -0.294 18852
2314 1 17 . 1 1 9 9 ARG HA H 9 4.050 4.050 3.957 0.093 18852
2315 1 17 . 1 1 9 9 ARG C C 9 178.843 178.843 178.590 0.253 18852
2316 1 17 . 1 1 9 9 ARG CA C 9 59.721 59.721 59.032 0.689 18852
2317 1 17 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.558 0.610 18852
2318 1 17 . 1 1 9 9 ARG H H 9 8.263 8.263 7.872 0.391 18852
2319 1 17 . 1 1 10 10 ARG N N 10 120.338 120.338 118.907 1.431 18852
2320 1 17 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.018 0.056 18852
2321 1 17 . 1 1 10 10 ARG C C 10 179.024 179.024 178.707 0.317 18852
2322 1 17 . 1 1 10 10 ARG CA C 10 59.542 59.542 59.370 0.173 18852
2323 1 17 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.916 -0.012 18852
2324 1 17 . 1 1 10 10 ARG H H 10 8.251 8.251 7.682 0.569 18852
2325 1 17 . 1 1 11 11 ASN N N 11 118.863 118.863 117.888 0.975 18852
2326 1 17 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.468 0.075 18852
2327 1 17 . 1 1 11 11 ASN C C 11 177.279 177.279 177.823 -0.544 18852
2328 1 17 . 1 1 11 11 ASN CA C 11 55.979 55.979 56.079 -0.100 18852
2329 1 17 . 1 1 11 11 ASN CB C 11 37.983 37.983 37.911 0.072 18852
2330 1 17 . 1 1 11 11 ASN H H 11 8.551 8.551 7.971 0.580 18852
2331 1 17 . 1 1 12 12 ARG N N 12 120.917 120.917 121.326 -0.409 18852
2332 1 17 . 1 1 12 12 ARG HA H 12 4.079 4.079 3.996 0.083 18852
2333 1 17 . 1 1 12 12 ARG C C 12 178.488 178.488 178.636 -0.148 18852
2334 1 17 . 1 1 12 12 ARG CA C 12 59.787 59.787 59.246 0.541 18852
2335 1 17 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.090 -0.153 18852
2336 1 17 . 1 1 12 12 ARG H H 12 8.253 8.253 8.503 -0.250 18852
2337 1 17 . 1 1 13 13 ARG N N 13 119.263 119.263 117.610 1.653 18852
2338 1 17 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.245 -0.056 18852
2339 1 17 . 1 1 13 13 ARG C C 13 178.479 178.479 178.716 -0.237 18852
2340 1 17 . 1 1 13 13 ARG CA C 13 59.572 59.572 58.709 0.862 18852
2341 1 17 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.765 0.302 18852
2342 1 17 . 1 1 13 13 ARG H H 13 8.167 8.167 7.651 0.516 18852
2343 1 17 . 1 1 14 14 ARG N N 14 119.756 119.756 121.045 -1.289 18852
2344 1 17 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.068 0.073 18852
2345 1 17 . 1 1 14 14 ARG C C 14 178.817 178.817 178.785 0.032 18852
2346 1 17 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.461 0.234 18852
2347 1 17 . 1 1 14 14 ARG CB C 14 29.812 29.812 30.141 -0.329 18852
2348 1 17 . 1 1 14 14 ARG H H 14 8.285 8.285 8.481 -0.196 18852
2349 1 17 . 1 1 15 15 ARG N N 15 119.026 119.026 117.987 1.039 18852
2350 1 17 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.136 0.022 18852
2351 1 17 . 1 1 15 15 ARG C C 15 178.909 178.909 178.619 0.290 18852
2352 1 17 . 1 1 15 15 ARG CA C 15 59.233 59.233 58.686 0.547 18852
2353 1 17 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.464 0.308 18852
2354 1 17 . 1 1 15 15 ARG H H 15 8.278 8.278 8.590 -0.312 18852
2355 1 17 . 1 1 16 16 TRP N N 16 121.055 121.055 121.556 -0.501 18852
2356 1 17 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.394 -0.005 18852
2357 1 17 . 1 1 16 16 TRP C C 16 178.621 178.621 177.897 0.724 18852
2358 1 17 . 1 1 16 16 TRP CA C 16 61.013 61.013 60.816 0.196 18852
2359 1 17 . 1 1 16 16 TRP CB C 16 28.796 28.796 28.857 -0.061 18852
2360 1 17 . 1 1 16 16 TRP H H 16 8.464 8.464 7.673 0.791 18852
2361 1 17 . 1 1 17 17 ARG N N 17 119.474 119.474 119.001 0.473 18852
2362 1 17 . 1 1 17 17 ARG HA H 17 3.910 3.910 3.726 0.184 18852
2363 1 17 . 1 1 17 17 ARG C C 17 179.120 179.120 178.574 0.546 18852
2364 1 17 . 1 1 17 17 ARG CA C 17 59.627 59.627 59.244 0.383 18852
2365 1 17 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.552 0.354 18852
2366 1 17 . 1 1 17 17 ARG H H 17 8.537 8.537 7.795 0.742 18852
2367 1 17 . 1 1 18 18 GLU N N 18 119.223 119.223 118.119 1.104 18852
2368 1 17 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.009 0.052 18852
2369 1 17 . 1 1 18 18 GLU C C 18 179.163 179.163 179.055 0.108 18852
2370 1 17 . 1 1 18 18 GLU CA C 18 59.138 59.138 59.009 0.129 18852
2371 1 17 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.424 -0.289 18852
2372 1 17 . 1 1 18 18 GLU H H 18 8.346 8.346 7.713 0.633 18852
2373 1 17 . 1 1 19 19 ARG N N 19 119.942 119.942 119.794 0.148 18852
2374 1 17 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.106 -0.060 18852
2375 1 17 . 1 1 19 19 ARG C C 19 178.634 178.634 179.213 -0.579 18852
2376 1 17 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.425 0.591 18852
2377 1 17 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.124 -0.753 18852
2378 1 17 . 1 1 19 19 ARG H H 19 8.104 8.104 8.203 -0.099 18852
2379 1 17 . 1 1 20 20 GLN N N 20 118.373 118.373 119.409 -1.036 18852
2380 1 17 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.106 -0.214 18852
2381 1 17 . 1 1 20 20 GLN C C 20 178.465 178.465 177.936 0.529 18852
2382 1 17 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.215 -0.046 18852
2383 1 17 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.038 0.075 18852
2384 1 17 . 1 1 20 20 GLN H H 20 8.044 8.044 8.361 -0.317 18852
2385 1 17 . 1 1 21 21 ARG N N 21 119.374 119.374 119.853 -0.479 18852
2386 1 17 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.975 0.059 18852
2387 1 17 . 1 1 21 21 ARG C C 21 178.423 178.423 178.212 0.211 18852
2388 1 17 . 1 1 21 21 ARG CA C 21 58.765 58.765 58.892 -0.127 18852
2389 1 17 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.856 -0.180 18852
2390 1 17 . 1 1 21 21 ARG H H 21 8.079 8.079 7.899 0.180 18852
2391 1 17 . 1 1 22 22 ALA N N 22 121.393 121.393 120.305 1.088 18852
2392 1 17 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.105 0.041 18852
2393 1 17 . 1 1 22 22 ALA C C 22 179.577 179.577 178.396 1.181 18852
2394 1 17 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.941 -0.674 18852
2395 1 17 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.440 -0.609 18852
2396 1 17 . 1 1 22 22 ALA H H 22 8.026 8.026 7.501 0.525 18852
2397 1 17 . 1 1 23 23 ALA N N 23 119.867 119.867 120.348 -0.481 18852
2398 1 17 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.241 -0.083 18852
2399 1 17 . 1 1 23 23 ALA C C 23 178.616 178.616 179.363 -0.747 18852
2400 1 17 . 1 1 23 23 ALA CA C 23 53.714 53.714 54.150 -0.436 18852
2401 1 17 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.725 -0.680 18852
2402 1 17 . 1 1 23 23 ALA H H 23 7.938 7.938 7.559 0.379 18852
2403 1 17 . 1 1 24 24 ALA N N 24 119.652 119.652 120.216 -0.564 18852
2404 1 17 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.105 0.186 18852
2405 1 17 . 1 1 24 24 ALA C C 24 177.528 177.528 177.694 -0.166 18852
2406 1 17 . 1 1 24 24 ALA CA C 24 52.706 52.706 54.081 -1.375 18852
2407 1 17 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.029 -0.438 18852
2408 1 17 . 1 1 24 24 ALA H H 24 7.693 7.693 8.379 -0.686 18852
2409 1 17 . 1 1 25 25 ALA N N 25 121.574 121.574 120.850 0.724 18852
2410 1 17 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.572 -0.243 18852
2411 1 17 . 1 1 25 25 ALA C C 25 176.649 176.649 175.607 1.042 18852
2412 1 17 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.944 1.622 18852
2413 1 17 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.215 -1.585 18852
2414 1 17 . 1 1 25 25 ALA H H 25 7.679 7.679 7.792 -0.113 18852
2415 1 18 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.288 -0.049 18852
2416 1 18 . 1 1 2 2 ALA C C 2 179.180 179.180 179.823 -0.643 18852
2417 1 18 . 1 1 2 2 ALA CA C 2 54.532 54.532 54.612 -0.080 18852
2418 1 18 . 1 1 2 2 ALA CB C 2 18.397 18.397 18.982 -0.585 18852
2419 1 18 . 1 1 3 3 MET N N 3 117.814 117.814 117.435 0.379 18852
2420 1 18 . 1 1 3 3 MET HA H 3 4.354 4.354 4.172 0.182 18852
2421 1 18 . 1 1 3 3 MET C C 3 177.926 177.926 178.519 -0.593 18852
2422 1 18 . 1 1 3 3 MET CA C 3 57.876 57.876 57.125 0.751 18852
2423 1 18 . 1 1 3 3 MET CB C 3 31.673 31.673 31.322 0.351 18852
2424 1 18 . 1 1 3 3 MET H H 3 8.613 8.613 8.389 0.224 18852
2425 1 18 . 1 1 4 4 ALA N N 4 122.603 122.603 121.901 0.702 18852
2426 1 18 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.290 -0.062 18852
2427 1 18 . 1 1 4 4 ALA C C 4 179.940 179.940 179.276 0.664 18852
2428 1 18 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.396 -0.707 18852
2429 1 18 . 1 1 4 4 ALA CB C 4 18.025 18.025 18.425 -0.400 18852
2430 1 18 . 1 1 4 4 ALA H H 4 8.324 8.324 8.124 0.200 18852
2431 1 18 . 1 1 5 5 THR N N 5 112.671 112.671 113.224 -0.553 18852
2432 1 18 . 1 1 5 5 THR HA H 5 4.121 4.121 3.874 0.247 18852
2433 1 18 . 1 1 5 5 THR C C 5 176.085 176.085 176.741 -0.656 18852
2434 1 18 . 1 1 5 5 THR CA C 5 65.053 65.053 65.926 -0.873 18852
2435 1 18 . 1 1 5 5 THR CB C 5 68.989 68.989 68.395 0.594 18852
2436 1 18 . 1 1 5 5 THR H H 5 7.966 7.966 8.228 -0.262 18852
2437 1 18 . 1 1 6 6 ARG N N 6 122.300 122.300 121.338 0.962 18852
2438 1 18 . 1 1 6 6 ARG HA H 6 4.057 4.057 3.900 0.157 18852
2439 1 18 . 1 1 6 6 ARG C C 6 178.983 178.983 178.884 0.099 18852
2440 1 18 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.365 0.598 18852
2441 1 18 . 1 1 6 6 ARG CB C 6 29.853 29.853 30.160 -0.307 18852
2442 1 18 . 1 1 6 6 ARG H H 6 8.244 8.244 8.033 0.211 18852
2443 1 18 . 1 1 7 7 GLN N N 7 118.940 118.940 118.810 0.130 18852
2444 1 18 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.094 -0.036 18852
2445 1 18 . 1 1 7 7 GLN C C 7 177.997 177.997 177.634 0.363 18852
2446 1 18 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.396 0.339 18852
2447 1 18 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.398 -0.209 18852
2448 1 18 . 1 1 7 7 GLN H H 7 8.424 8.424 7.667 0.757 18852
2449 1 18 . 1 1 8 8 ALA N N 8 122.920 122.920 121.584 1.336 18852
2450 1 18 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.114 0.103 18852
2451 1 18 . 1 1 8 8 ALA C C 8 180.837 180.837 179.247 1.590 18852
2452 1 18 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.358 0.961 18852
2453 1 18 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.333 -0.638 18852
2454 1 18 . 1 1 8 8 ALA H H 8 8.306 8.306 7.901 0.405 18852
2455 1 18 . 1 1 9 9 ARG N N 9 118.721 118.721 118.377 0.344 18852
2456 1 18 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.003 0.047 18852
2457 1 18 . 1 1 9 9 ARG C C 9 178.843 178.843 178.073 0.770 18852
2458 1 18 . 1 1 9 9 ARG CA C 9 59.721 59.721 59.060 0.661 18852
2459 1 18 . 1 1 9 9 ARG CB C 9 30.168 30.168 30.110 0.057 18852
2460 1 18 . 1 1 9 9 ARG H H 9 8.263 8.263 7.944 0.319 18852
2461 1 18 . 1 1 10 10 ARG N N 10 120.338 120.338 116.485 3.853 18852
2462 1 18 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.294 -0.220 18852
2463 1 18 . 1 1 10 10 ARG C C 10 179.024 179.024 178.594 0.430 18852
2464 1 18 . 1 1 10 10 ARG CA C 10 59.542 59.542 58.303 1.239 18852
2465 1 18 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.723 0.181 18852
2466 1 18 . 1 1 10 10 ARG H H 10 8.251 8.251 7.605 0.646 18852
2467 1 18 . 1 1 11 11 ASN N N 11 118.863 118.863 120.442 -1.579 18852
2468 1 18 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.498 0.045 18852
2469 1 18 . 1 1 11 11 ASN C C 11 177.279 177.279 176.874 0.405 18852
2470 1 18 . 1 1 11 11 ASN CA C 11 55.979 55.979 55.638 0.341 18852
2471 1 18 . 1 1 11 11 ASN CB C 11 37.983 37.983 37.646 0.337 18852
2472 1 18 . 1 1 11 11 ASN H H 11 8.551 8.551 7.851 0.700 18852
2473 1 18 . 1 1 12 12 ARG N N 12 120.917 120.917 120.472 0.445 18852
2474 1 18 . 1 1 12 12 ARG HA H 12 4.079 4.079 3.978 0.101 18852
2475 1 18 . 1 1 12 12 ARG C C 12 178.488 178.488 178.462 0.026 18852
2476 1 18 . 1 1 12 12 ARG CA C 12 59.787 59.787 59.299 0.488 18852
2477 1 18 . 1 1 12 12 ARG CB C 12 29.937 29.937 29.603 0.334 18852
2478 1 18 . 1 1 12 12 ARG H H 12 8.253 8.253 8.123 0.130 18852
2479 1 18 . 1 1 13 13 ARG N N 13 119.263 119.263 118.299 0.964 18852
2480 1 18 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.204 -0.015 18852
2481 1 18 . 1 1 13 13 ARG C C 13 178.479 178.479 178.599 -0.120 18852
2482 1 18 . 1 1 13 13 ARG CA C 13 59.572 59.572 58.171 1.401 18852
2483 1 18 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.693 0.374 18852
2484 1 18 . 1 1 13 13 ARG H H 13 8.167 8.167 7.835 0.332 18852
2485 1 18 . 1 1 14 14 ARG N N 14 119.756 119.756 119.523 0.233 18852
2486 1 18 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.253 -0.112 18852
2487 1 18 . 1 1 14 14 ARG C C 14 178.817 178.817 179.223 -0.406 18852
2488 1 18 . 1 1 14 14 ARG CA C 14 59.695 59.695 57.936 1.759 18852
2489 1 18 . 1 1 14 14 ARG CB C 14 29.812 29.812 29.831 -0.019 18852
2490 1 18 . 1 1 14 14 ARG H H 14 8.285 8.285 7.821 0.464 18852
2491 1 18 . 1 1 15 15 ARG N N 15 119.026 119.026 121.227 -2.201 18852
2492 1 18 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.313 -0.155 18852
2493 1 18 . 1 1 15 15 ARG C C 15 178.909 178.909 178.453 0.456 18852
2494 1 18 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.566 -0.333 18852
2495 1 18 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.925 -0.153 18852
2496 1 18 . 1 1 15 15 ARG H H 15 8.278 8.278 8.643 -0.365 18852
2497 1 18 . 1 1 16 16 TRP N N 16 121.055 121.055 120.217 0.838 18852
2498 1 18 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.317 0.072 18852
2499 1 18 . 1 1 16 16 TRP C C 16 178.621 178.621 177.886 0.735 18852
2500 1 18 . 1 1 16 16 TRP CA C 16 61.013 61.013 59.439 1.574 18852
2501 1 18 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.724 -0.928 18852
2502 1 18 . 1 1 16 16 TRP H H 16 8.464 8.464 7.872 0.592 18852
2503 1 18 . 1 1 17 17 ARG N N 17 119.474 119.474 119.096 0.378 18852
2504 1 18 . 1 1 17 17 ARG HA H 17 3.910 3.910 4.031 -0.121 18852
2505 1 18 . 1 1 17 17 ARG C C 17 179.120 179.120 178.604 0.516 18852
2506 1 18 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.803 0.824 18852
2507 1 18 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.844 0.063 18852
2508 1 18 . 1 1 17 17 ARG H H 17 8.537 8.537 7.812 0.725 18852
2509 1 18 . 1 1 18 18 GLU N N 18 119.223 119.223 118.669 0.554 18852
2510 1 18 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.069 -0.008 18852
2511 1 18 . 1 1 18 18 GLU C C 18 179.163 179.163 179.044 0.119 18852
2512 1 18 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.868 0.270 18852
2513 1 18 . 1 1 18 18 GLU CB C 18 29.135 29.135 28.953 0.182 18852
2514 1 18 . 1 1 18 18 GLU H H 18 8.346 8.346 7.879 0.467 18852
2515 1 18 . 1 1 19 19 ARG N N 19 119.942 119.942 119.458 0.484 18852
2516 1 18 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.087 -0.041 18852
2517 1 18 . 1 1 19 19 ARG C C 19 178.634 178.634 178.247 0.387 18852
2518 1 18 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.391 0.625 18852
2519 1 18 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.168 -0.797 18852
2520 1 18 . 1 1 19 19 ARG H H 19 8.104 8.104 8.477 -0.373 18852
2521 1 18 . 1 1 20 20 GLN N N 20 118.373 118.373 119.006 -0.633 18852
2522 1 18 . 1 1 20 20 GLN HA H 20 3.892 3.892 3.872 0.020 18852
2523 1 18 . 1 1 20 20 GLN C C 20 178.465 178.465 177.300 1.165 18852
2524 1 18 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.595 -0.425 18852
2525 1 18 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.243 -0.130 18852
2526 1 18 . 1 1 20 20 GLN H H 20 8.044 8.044 7.649 0.395 18852
2527 1 18 . 1 1 21 21 ARG N N 21 119.374 119.374 119.612 -0.238 18852
2528 1 18 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.958 0.076 18852
2529 1 18 . 1 1 21 21 ARG C C 21 178.423 178.423 178.284 0.139 18852
2530 1 18 . 1 1 21 21 ARG CA C 21 58.765 58.765 58.989 -0.224 18852
2531 1 18 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.932 -0.256 18852
2532 1 18 . 1 1 21 21 ARG H H 21 8.079 8.079 7.470 0.609 18852
2533 1 18 . 1 1 22 22 ALA N N 22 121.393 121.393 120.416 0.977 18852
2534 1 18 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.067 0.079 18852
2535 1 18 . 1 1 22 22 ALA C C 22 179.577 179.577 178.233 1.344 18852
2536 1 18 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.898 -0.631 18852
2537 1 18 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.396 -0.566 18852
2538 1 18 . 1 1 22 22 ALA H H 22 8.026 8.026 7.494 0.532 18852
2539 1 18 . 1 1 23 23 ALA N N 23 119.867 119.867 120.490 -0.623 18852
2540 1 18 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.310 -0.152 18852
2541 1 18 . 1 1 23 23 ALA C C 23 178.616 178.616 179.017 -0.401 18852
2542 1 18 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.725 -0.011 18852
2543 1 18 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.526 -0.481 18852
2544 1 18 . 1 1 23 23 ALA H H 23 7.938 7.938 7.430 0.508 18852
2545 1 18 . 1 1 24 24 ALA N N 24 119.652 119.652 120.683 -1.031 18852
2546 1 18 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.109 0.182 18852
2547 1 18 . 1 1 24 24 ALA C C 24 177.528 177.528 177.692 -0.164 18852
2548 1 18 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.845 -1.139 18852
2549 1 18 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.239 -0.648 18852
2550 1 18 . 1 1 24 24 ALA H H 24 7.693 7.693 8.135 -0.442 18852
2551 1 18 . 1 1 25 25 ALA N N 25 121.574 121.574 120.533 1.041 18852
2552 1 18 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.547 -0.218 18852
2553 1 18 . 1 1 25 25 ALA C C 25 176.649 176.649 175.858 0.791 18852
2554 1 18 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.807 1.759 18852
2555 1 18 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.270 -1.641 18852
2556 1 18 . 1 1 25 25 ALA H H 25 7.679 7.679 7.695 -0.016 18852
2557 1 19 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.267 -0.028 18852
2558 1 19 . 1 1 2 2 ALA C C 2 179.180 179.180 179.245 -0.065 18852
2559 1 19 . 1 1 2 2 ALA CA C 2 54.532 54.532 53.732 0.800 18852
2560 1 19 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.575 -1.178 18852
2561 1 19 . 1 1 3 3 MET N N 3 117.814 117.814 116.715 1.099 18852
2562 1 19 . 1 1 3 3 MET HA H 3 4.354 4.354 4.389 -0.035 18852
2563 1 19 . 1 1 3 3 MET C C 3 177.926 177.926 177.923 0.003 18852
2564 1 19 . 1 1 3 3 MET CA C 3 57.876 57.876 57.711 0.165 18852
2565 1 19 . 1 1 3 3 MET CB C 3 31.673 31.673 32.273 -0.600 18852
2566 1 19 . 1 1 3 3 MET H H 3 8.613 8.613 8.031 0.582 18852
2567 1 19 . 1 1 4 4 ALA N N 4 122.603 122.603 123.007 -0.404 18852
2568 1 19 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.163 0.065 18852
2569 1 19 . 1 1 4 4 ALA C C 4 179.940 179.940 178.940 1.000 18852
2570 1 19 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.130 -0.441 18852
2571 1 19 . 1 1 4 4 ALA CB C 4 18.025 18.025 17.759 0.266 18852
2572 1 19 . 1 1 4 4 ALA H H 4 8.324 8.324 8.409 -0.085 18852
2573 1 19 . 1 1 5 5 THR N N 5 112.671 112.671 114.455 -1.784 18852
2574 1 19 . 1 1 5 5 THR HA H 5 4.121 4.121 3.919 0.202 18852
2575 1 19 . 1 1 5 5 THR C C 5 176.085 176.085 176.472 -0.387 18852
2576 1 19 . 1 1 5 5 THR CA C 5 65.053 65.053 66.846 -1.793 18852
2577 1 19 . 1 1 5 5 THR CB C 5 68.989 68.989 68.397 0.592 18852
2578 1 19 . 1 1 5 5 THR H H 5 7.966 7.966 7.518 0.448 18852
2579 1 19 . 1 1 6 6 ARG N N 6 122.300 122.300 120.833 1.467 18852
2580 1 19 . 1 1 6 6 ARG HA H 6 4.057 4.057 4.047 0.010 18852
2581 1 19 . 1 1 6 6 ARG C C 6 178.983 178.983 178.822 0.161 18852
2582 1 19 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.099 0.864 18852
2583 1 19 . 1 1 6 6 ARG CB C 6 29.853 29.853 29.720 0.133 18852
2584 1 19 . 1 1 6 6 ARG H H 6 8.244 8.244 7.776 0.468 18852
2585 1 19 . 1 1 7 7 GLN N N 7 118.940 118.940 119.206 -0.266 18852
2586 1 19 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.162 -0.104 18852
2587 1 19 . 1 1 7 7 GLN C C 7 177.997 177.997 177.796 0.201 18852
2588 1 19 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.279 0.457 18852
2589 1 19 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.415 -0.227 18852
2590 1 19 . 1 1 7 7 GLN H H 7 8.424 8.424 8.028 0.396 18852
2591 1 19 . 1 1 8 8 ALA N N 8 122.920 122.920 121.122 1.798 18852
2592 1 19 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.215 0.002 18852
2593 1 19 . 1 1 8 8 ALA C C 8 180.837 180.837 179.691 1.146 18852
2594 1 19 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.859 0.460 18852
2595 1 19 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.395 -0.700 18852
2596 1 19 . 1 1 8 8 ALA H H 8 8.306 8.306 8.185 0.121 18852
2597 1 19 . 1 1 9 9 ARG N N 9 118.721 118.721 116.096 2.625 18852
2598 1 19 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.239 -0.189 18852
2599 1 19 . 1 1 9 9 ARG C C 9 178.843 178.843 178.424 0.419 18852
2600 1 19 . 1 1 9 9 ARG CA C 9 59.721 59.721 57.491 2.230 18852
2601 1 19 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.974 0.194 18852
2602 1 19 . 1 1 9 9 ARG H H 9 8.263 8.263 7.606 0.657 18852
2603 1 19 . 1 1 10 10 ARG N N 10 120.338 120.338 121.401 -1.063 18852
2604 1 19 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.062 0.012 18852
2605 1 19 . 1 1 10 10 ARG C C 10 179.024 179.024 178.028 0.996 18852
2606 1 19 . 1 1 10 10 ARG CA C 10 59.542 59.542 60.096 -0.554 18852
2607 1 19 . 1 1 10 10 ARG CB C 10 29.904 29.904 30.036 -0.132 18852
2608 1 19 . 1 1 10 10 ARG H H 10 8.251 8.251 8.195 0.056 18852
2609 1 19 . 1 1 11 11 ASN N N 11 118.863 118.863 116.829 2.034 18852
2610 1 19 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.394 0.149 18852
2611 1 19 . 1 1 11 11 ASN C C 11 177.279 177.279 177.801 -0.522 18852
2612 1 19 . 1 1 11 11 ASN CA C 11 55.979 55.979 56.117 -0.138 18852
2613 1 19 . 1 1 11 11 ASN CB C 11 37.983 37.983 37.691 0.292 18852
2614 1 19 . 1 1 11 11 ASN H H 11 8.551 8.551 8.168 0.383 18852
2615 1 19 . 1 1 12 12 ARG N N 12 120.917 120.917 120.826 0.091 18852
2616 1 19 . 1 1 12 12 ARG HA H 12 4.079 4.079 4.138 -0.059 18852
2617 1 19 . 1 1 12 12 ARG C C 12 178.488 178.488 178.280 0.208 18852
2618 1 19 . 1 1 12 12 ARG CA C 12 59.787 59.787 58.665 1.122 18852
2619 1 19 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.350 -0.413 18852
2620 1 19 . 1 1 12 12 ARG H H 12 8.253 8.253 7.671 0.582 18852
2621 1 19 . 1 1 13 13 ARG N N 13 119.263 119.263 119.654 -0.391 18852
2622 1 19 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.179 0.010 18852
2623 1 19 . 1 1 13 13 ARG C C 13 178.479 178.479 178.887 -0.408 18852
2624 1 19 . 1 1 13 13 ARG CA C 13 59.572 59.572 59.888 -0.316 18852
2625 1 19 . 1 1 13 13 ARG CB C 13 30.067 30.067 30.316 -0.249 18852
2626 1 19 . 1 1 13 13 ARG H H 13 8.167 8.167 8.138 0.029 18852
2627 1 19 . 1 1 14 14 ARG N N 14 119.756 119.756 118.735 1.021 18852
2628 1 19 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.019 0.122 18852
2629 1 19 . 1 1 14 14 ARG C C 14 178.817 178.817 178.606 0.211 18852
2630 1 19 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.252 0.443 18852
2631 1 19 . 1 1 14 14 ARG CB C 14 29.812 29.812 29.438 0.374 18852
2632 1 19 . 1 1 14 14 ARG H H 14 8.285 8.285 8.718 -0.433 18852
2633 1 19 . 1 1 15 15 ARG N N 15 119.026 119.026 119.646 -0.620 18852
2634 1 19 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.072 0.086 18852
2635 1 19 . 1 1 15 15 ARG C C 15 178.909 178.909 178.532 0.377 18852
2636 1 19 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.368 -0.135 18852
2637 1 19 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.973 -0.201 18852
2638 1 19 . 1 1 15 15 ARG H H 15 8.278 8.278 7.584 0.694 18852
2639 1 19 . 1 1 16 16 TRP N N 16 121.055 121.055 119.537 1.518 18852
2640 1 19 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.480 -0.091 18852
2641 1 19 . 1 1 16 16 TRP C C 16 178.621 178.621 178.607 0.014 18852
2642 1 19 . 1 1 16 16 TRP CA C 16 61.013 61.013 59.648 1.365 18852
2643 1 19 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.555 -0.759 18852
2644 1 19 . 1 1 16 16 TRP H H 16 8.464 8.464 7.579 0.885 18852
2645 1 19 . 1 1 17 17 ARG N N 17 119.474 119.474 119.662 -0.188 18852
2646 1 19 . 1 1 17 17 ARG HA H 17 3.910 3.910 4.228 -0.318 18852
2647 1 19 . 1 1 17 17 ARG C C 17 179.120 179.120 178.530 0.590 18852
2648 1 19 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.285 1.342 18852
2649 1 19 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.934 -0.027 18852
2650 1 19 . 1 1 17 17 ARG H H 17 8.537 8.537 8.237 0.300 18852
2651 1 19 . 1 1 18 18 GLU N N 18 119.223 119.223 118.862 0.361 18852
2652 1 19 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.026 0.035 18852
2653 1 19 . 1 1 18 18 GLU C C 18 179.163 179.163 178.968 0.195 18852
2654 1 19 . 1 1 18 18 GLU CA C 18 59.138 59.138 59.215 -0.077 18852
2655 1 19 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.323 -0.188 18852
2656 1 19 . 1 1 18 18 GLU H H 18 8.346 8.346 8.385 -0.039 18852
2657 1 19 . 1 1 19 19 ARG N N 19 119.942 119.942 118.737 1.205 18852
2658 1 19 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.065 -0.019 18852
2659 1 19 . 1 1 19 19 ARG C C 19 178.634 178.634 179.069 -0.435 18852
2660 1 19 . 1 1 19 19 ARG CA C 19 59.016 59.016 59.033 -0.017 18852
2661 1 19 . 1 1 19 19 ARG CB C 19 29.371 29.371 29.907 -0.536 18852
2662 1 19 . 1 1 19 19 ARG H H 19 8.104 8.104 7.615 0.489 18852
2663 1 19 . 1 1 20 20 GLN N N 20 118.373 118.373 119.260 -0.887 18852
2664 1 19 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.213 -0.321 18852
2665 1 19 . 1 1 20 20 GLN C C 20 178.465 178.465 178.018 0.447 18852
2666 1 19 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.545 -0.375 18852
2667 1 19 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.490 -0.377 18852
2668 1 19 . 1 1 20 20 GLN H H 20 8.044 8.044 7.798 0.246 18852
2669 1 19 . 1 1 21 21 ARG N N 21 119.374 119.374 120.309 -0.935 18852
2670 1 19 . 1 1 21 21 ARG HA H 21 4.034 4.034 4.017 0.017 18852
2671 1 19 . 1 1 21 21 ARG C C 21 178.423 178.423 178.209 0.214 18852
2672 1 19 . 1 1 21 21 ARG CA C 21 58.765 58.765 58.695 0.070 18852
2673 1 19 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.642 0.034 18852
2674 1 19 . 1 1 21 21 ARG H H 21 8.079 8.079 8.304 -0.225 18852
2675 1 19 . 1 1 22 22 ALA N N 22 121.393 121.393 120.342 1.051 18852
2676 1 19 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.108 0.038 18852
2677 1 19 . 1 1 22 22 ALA C C 22 179.577 179.577 178.453 1.124 18852
2678 1 19 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.970 -0.703 18852
2679 1 19 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.469 -0.638 18852
2680 1 19 . 1 1 22 22 ALA H H 22 8.026 8.026 7.528 0.498 18852
2681 1 19 . 1 1 23 23 ALA N N 23 119.867 119.867 120.577 -0.710 18852
2682 1 19 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.152 0.006 18852
2683 1 19 . 1 1 23 23 ALA C C 23 178.616 178.616 179.389 -0.773 18852
2684 1 19 . 1 1 23 23 ALA CA C 23 53.714 53.714 54.027 -0.313 18852
2685 1 19 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.910 -0.865 18852
2686 1 19 . 1 1 23 23 ALA H H 23 7.938 7.938 7.550 0.388 18852
2687 1 19 . 1 1 24 24 ALA N N 24 119.652 119.652 121.704 -2.052 18852
2688 1 19 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.117 0.174 18852
2689 1 19 . 1 1 24 24 ALA C C 24 177.528 177.528 177.790 -0.262 18852
2690 1 19 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.627 -0.921 18852
2691 1 19 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.223 -0.632 18852
2692 1 19 . 1 1 24 24 ALA H H 24 7.693 7.693 8.394 -0.701 18852
2693 1 19 . 1 1 25 25 ALA N N 25 121.574 121.574 120.698 0.876 18852
2694 1 19 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.530 -0.201 18852
2695 1 19 . 1 1 25 25 ALA C C 25 176.649 176.649 175.939 0.710 18852
2696 1 19 . 1 1 25 25 ALA CA C 25 52.566 52.566 51.112 1.454 18852
2697 1 19 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.256 -1.626 18852
2698 1 19 . 1 1 25 25 ALA H H 25 7.679 7.679 7.738 -0.059 18852
2699 1 20 . 1 1 2 2 ALA HA H 2 4.239 4.239 4.151 0.088 18852
2700 1 20 . 1 1 2 2 ALA C C 2 179.180 179.180 179.725 -0.545 18852
2701 1 20 . 1 1 2 2 ALA CA C 2 54.532 54.532 54.566 -0.034 18852
2702 1 20 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.575 -1.178 18852
2703 1 20 . 1 1 3 3 MET N N 3 117.814 117.814 118.195 -0.381 18852
2704 1 20 . 1 1 3 3 MET HA H 3 4.354 4.354 4.306 0.048 18852
2705 1 20 . 1 1 3 3 MET C C 3 177.926 177.926 177.659 0.267 18852
2706 1 20 . 1 1 3 3 MET CA C 3 57.876 57.876 57.799 0.077 18852
2707 1 20 . 1 1 3 3 MET CB C 3 31.673 31.673 32.281 -0.608 18852
2708 1 20 . 1 1 3 3 MET H H 3 8.613 8.613 8.370 0.243 18852
2709 1 20 . 1 1 4 4 ALA N N 4 122.603 122.603 120.521 2.082 18852
2710 1 20 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.196 0.032 18852
2711 1 20 . 1 1 4 4 ALA C C 4 179.940 179.940 179.104 0.836 18852
2712 1 20 . 1 1 4 4 ALA CA C 4 54.689 54.689 54.788 -0.099 18852
2713 1 20 . 1 1 4 4 ALA CB C 4 18.025 18.025 18.444 -0.419 18852
2714 1 20 . 1 1 4 4 ALA H H 4 8.324 8.324 8.266 0.058 18852
2715 1 20 . 1 1 5 5 THR N N 5 112.671 112.671 112.413 0.258 18852
2716 1 20 . 1 1 5 5 THR HA H 5 4.121 4.121 4.115 0.006 18852
2717 1 20 . 1 1 5 5 THR C C 5 176.085 176.085 176.559 -0.474 18852
2718 1 20 . 1 1 5 5 THR CA C 5 65.053 65.053 64.712 0.341 18852
2719 1 20 . 1 1 5 5 THR CB C 5 68.989 68.989 68.884 0.105 18852
2720 1 20 . 1 1 5 5 THR H H 5 7.966 7.966 8.161 -0.195 18852
2721 1 20 . 1 1 6 6 ARG N N 6 122.300 122.300 121.885 0.415 18852
2722 1 20 . 1 1 6 6 ARG HA H 6 4.057 4.057 3.995 0.062 18852
2723 1 20 . 1 1 6 6 ARG C C 6 178.983 178.983 178.732 0.251 18852
2724 1 20 . 1 1 6 6 ARG CA C 6 59.963 59.963 58.781 1.182 18852
2725 1 20 . 1 1 6 6 ARG CB C 6 29.853 29.853 29.711 0.142 18852
2726 1 20 . 1 1 6 6 ARG H H 6 8.244 8.244 8.272 -0.028 18852
2727 1 20 . 1 1 7 7 GLN N N 7 118.940 118.940 119.316 -0.376 18852
2728 1 20 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.095 -0.037 18852
2729 1 20 . 1 1 7 7 GLN C C 7 177.997 177.997 177.672 0.325 18852
2730 1 20 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.703 0.032 18852
2731 1 20 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.493 -0.305 18852
2732 1 20 . 1 1 7 7 GLN H H 7 8.424 8.424 7.769 0.655 18852
2733 1 20 . 1 1 8 8 ALA N N 8 122.920 122.920 122.198 0.722 18852
2734 1 20 . 1 1 8 8 ALA HA H 8 4.217 4.217 3.988 0.229 18852
2735 1 20 . 1 1 8 8 ALA C C 8 180.837 180.837 179.704 1.133 18852
2736 1 20 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.873 0.446 18852
2737 1 20 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.173 -0.478 18852
2738 1 20 . 1 1 8 8 ALA H H 8 8.306 8.306 7.632 0.674 18852
2739 1 20 . 1 1 9 9 ARG N N 9 118.721 118.721 117.589 1.132 18852
2740 1 20 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.061 -0.011 18852
2741 1 20 . 1 1 9 9 ARG C C 9 178.843 178.843 178.992 -0.149 18852
2742 1 20 . 1 1 9 9 ARG CA C 9 59.721 59.721 59.071 0.650 18852
2743 1 20 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.785 0.383 18852
2744 1 20 . 1 1 9 9 ARG H H 9 8.263 8.263 7.766 0.497 18852
2745 1 20 . 1 1 10 10 ARG N N 10 120.338 120.338 119.781 0.557 18852
2746 1 20 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.138 -0.064 18852
2747 1 20 . 1 1 10 10 ARG C C 10 179.024 179.024 178.697 0.327 18852
2748 1 20 . 1 1 10 10 ARG CA C 10 59.542 59.542 59.550 -0.008 18852
2749 1 20 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.950 -0.046 18852
2750 1 20 . 1 1 10 10 ARG H H 10 8.251 8.251 8.186 0.065 18852
2751 1 20 . 1 1 11 11 ASN N N 11 118.863 118.863 118.243 0.620 18852
2752 1 20 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.478 0.065 18852
2753 1 20 . 1 1 11 11 ASN C C 11 177.279 177.279 177.817 -0.538 18852
2754 1 20 . 1 1 11 11 ASN CA C 11 55.979 55.979 55.932 0.047 18852
2755 1 20 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.147 -0.164 18852
2756 1 20 . 1 1 11 11 ASN H H 11 8.551 8.551 7.976 0.575 18852
2757 1 20 . 1 1 12 12 ARG N N 12 120.917 120.917 120.820 0.097 18852
2758 1 20 . 1 1 12 12 ARG HA H 12 4.079 4.079 4.079 -0.000 18852
2759 1 20 . 1 1 12 12 ARG C C 12 178.488 178.488 178.915 -0.427 18852
2760 1 20 . 1 1 12 12 ARG CA C 12 59.787 59.787 58.662 1.125 18852
2761 1 20 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.150 -0.213 18852
2762 1 20 . 1 1 12 12 ARG H H 12 8.253 8.253 8.425 -0.172 18852
2763 1 20 . 1 1 13 13 ARG N N 13 119.263 119.263 119.652 -0.389 18852
2764 1 20 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.210 -0.021 18852
2765 1 20 . 1 1 13 13 ARG C C 13 178.479 178.479 178.768 -0.289 18852
2766 1 20 . 1 1 13 13 ARG CA C 13 59.572 59.572 58.994 0.578 18852
2767 1 20 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.564 0.503 18852
2768 1 20 . 1 1 13 13 ARG H H 13 8.167 8.167 7.666 0.501 18852
2769 1 20 . 1 1 14 14 ARG N N 14 119.756 119.756 119.002 0.754 18852
2770 1 20 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.090 0.051 18852
2771 1 20 . 1 1 14 14 ARG C C 14 178.817 178.817 178.372 0.445 18852
2772 1 20 . 1 1 14 14 ARG CA C 14 59.695 59.695 58.706 0.989 18852
2773 1 20 . 1 1 14 14 ARG CB C 14 29.812 29.812 29.678 0.134 18852
2774 1 20 . 1 1 14 14 ARG H H 14 8.285 8.285 8.589 -0.304 18852
2775 1 20 . 1 1 15 15 ARG N N 15 119.026 119.026 120.431 -1.405 18852
2776 1 20 . 1 1 15 15 ARG HA H 15 4.158 4.158 3.980 0.178 18852
2777 1 20 . 1 1 15 15 ARG C C 15 178.909 178.909 178.505 0.404 18852
2778 1 20 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.547 -0.314 18852
2779 1 20 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.516 0.256 18852
2780 1 20 . 1 1 15 15 ARG H H 15 8.278 8.278 7.703 0.575 18852
2781 1 20 . 1 1 16 16 TRP N N 16 121.055 121.055 118.801 2.254 18852
2782 1 20 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.357 0.032 18852
2783 1 20 . 1 1 16 16 TRP C C 16 178.621 178.621 178.904 -0.283 18852
2784 1 20 . 1 1 16 16 TRP CA C 16 61.013 61.013 59.794 1.220 18852
2785 1 20 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.136 -0.340 18852
2786 1 20 . 1 1 16 16 TRP H H 16 8.464 8.464 7.626 0.838 18852
2787 1 20 . 1 1 17 17 ARG N N 17 119.474 119.474 119.353 0.121 18852
2788 1 20 . 1 1 17 17 ARG HA H 17 3.910 3.910 4.114 -0.204 18852
2789 1 20 . 1 1 17 17 ARG C C 17 179.120 179.120 178.469 0.651 18852
2790 1 20 . 1 1 17 17 ARG CA C 17 59.627 59.627 59.103 0.524 18852
2791 1 20 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.662 0.245 18852
2792 1 20 . 1 1 17 17 ARG H H 17 8.537 8.537 7.516 1.021 18852
2793 1 20 . 1 1 18 18 GLU N N 18 119.223 119.223 117.906 1.317 18852
2794 1 20 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.072 -0.011 18852
2795 1 20 . 1 1 18 18 GLU C C 18 179.163 179.163 178.985 0.178 18852
2796 1 20 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.832 0.306 18852
2797 1 20 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.265 -0.130 18852
2798 1 20 . 1 1 18 18 GLU H H 18 8.346 8.346 8.266 0.080 18852
2799 1 20 . 1 1 19 19 ARG N N 19 119.942 119.942 118.928 1.014 18852
2800 1 20 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.222 -0.176 18852
2801 1 20 . 1 1 19 19 ARG C C 19 178.634 178.634 178.988 -0.354 18852
2802 1 20 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.216 0.800 18852
2803 1 20 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.490 -1.119 18852
2804 1 20 . 1 1 19 19 ARG H H 19 8.104 8.104 8.109 -0.005 18852
2805 1 20 . 1 1 20 20 GLN N N 20 118.373 118.373 120.096 -1.723 18852
2806 1 20 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.124 -0.232 18852
2807 1 20 . 1 1 20 20 GLN C C 20 178.465 178.465 177.927 0.538 18852
2808 1 20 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.831 -0.661 18852
2809 1 20 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.430 -0.317 18852
2810 1 20 . 1 1 20 20 GLN H H 20 8.044 8.044 7.941 0.103 18852
2811 1 20 . 1 1 21 21 ARG N N 21 119.374 119.374 119.693 -0.319 18852
2812 1 20 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.984 0.050 18852
2813 1 20 . 1 1 21 21 ARG C C 21 178.423 178.423 178.553 -0.130 18852
2814 1 20 . 1 1 21 21 ARG CA C 21 58.765 58.765 59.478 -0.713 18852
2815 1 20 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.831 -0.155 18852
2816 1 20 . 1 1 21 21 ARG H H 21 8.079 8.079 7.747 0.332 18852
2817 1 20 . 1 1 22 22 ALA N N 22 121.393 121.393 121.059 0.334 18852
2818 1 20 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.106 0.040 18852
2819 1 20 . 1 1 22 22 ALA C C 22 179.577 179.577 178.453 1.124 18852
2820 1 20 . 1 1 22 22 ALA CA C 22 54.267 54.267 55.094 -0.828 18852
2821 1 20 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.477 -0.646 18852
2822 1 20 . 1 1 22 22 ALA H H 22 8.026 8.026 7.634 0.392 18852
2823 1 20 . 1 1 23 23 ALA N N 23 119.867 119.867 120.658 -0.791 18852
2824 1 20 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.313 -0.155 18852
2825 1 20 . 1 1 23 23 ALA C C 23 178.616 178.616 179.328 -0.712 18852
2826 1 20 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.734 -0.020 18852
2827 1 20 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.699 -0.654 18852
2828 1 20 . 1 1 23 23 ALA H H 23 7.938 7.938 7.562 0.376 18852
2829 1 20 . 1 1 24 24 ALA N N 24 119.652 119.652 121.629 -1.977 18852
2830 1 20 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.092 0.199 18852
2831 1 20 . 1 1 24 24 ALA C C 24 177.528 177.528 177.840 -0.312 18852
2832 1 20 . 1 1 24 24 ALA CA C 24 52.706 52.706 54.153 -1.446 18852
2833 1 20 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.245 -0.654 18852
2834 1 20 . 1 1 24 24 ALA H H 24 7.693 7.693 8.269 -0.576 18852
2835 1 20 . 1 1 25 25 ALA N N 25 121.574 121.574 120.410 1.164 18852
2836 1 20 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.496 -0.167 18852
2837 1 20 . 1 1 25 25 ALA C C 25 176.649 176.649 175.639 1.010 18852
2838 1 20 . 1 1 25 25 ALA CA C 25 52.566 52.566 51.012 1.554 18852
2839 1 20 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.322 -1.692 18852
2840 1 20 . 1 1 25 25 ALA H H 25 7.679 7.679 7.969 -0.290 18852
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 23 1.272 -0.468 1.209 18852
2 1 1 "Average Difference" HA 24 0.127 0.012 0.130 18852
3 1 1 "Average Difference" C 24 0.607 -0.239 0.571 18852
4 1 1 "Average Difference" CA 24 0.856 -0.306 0.816 18852
5 1 1 "Average Difference" CB 24 0.599 0.351 0.496 18852
6 1 1 "Average Difference" HN 23 0.525 -0.369 0.382 18852
7 1 2 "Average Difference" N 23 1.179 -0.349 1.152 18852
8 1 2 "Average Difference" HA 24 0.112 -0.019 0.113 18852
9 1 2 "Average Difference" C 24 0.581 -0.244 0.539 18852
10 1 2 "Average Difference" CA 24 0.658 -0.287 0.604 18852
11 1 2 "Average Difference" CB 24 0.520 0.298 0.436 18852
12 1 2 "Average Difference" HN 23 0.519 -0.390 0.351 18852
13 1 3 "Average Difference" N 23 1.085 -0.382 1.038 18852
14 1 3 "Average Difference" HA 24 0.136 0.019 0.138 18852
15 1 3 "Average Difference" C 24 0.562 -0.227 0.526 18852
16 1 3 "Average Difference" CA 24 0.862 -0.376 0.793 18852
17 1 3 "Average Difference" CB 24 0.565 0.345 0.457 18852
18 1 3 "Average Difference" HN 23 0.505 -0.296 0.418 18852
19 1 4 "Average Difference" N 23 1.028 -0.186 1.034 18852
20 1 4 "Average Difference" HA 24 0.143 -0.021 0.144 18852
21 1 4 "Average Difference" C 24 0.571 -0.201 0.546 18852
22 1 4 "Average Difference" CA 24 0.783 -0.279 0.747 18852
23 1 4 "Average Difference" CB 24 0.570 0.282 0.506 18852
24 1 4 "Average Difference" HN 23 0.468 -0.349 0.319 18852
25 1 5 "Average Difference" N 23 1.401 -0.184 1.420 18852
26 1 5 "Average Difference" HA 24 0.142 -0.043 0.139 18852
27 1 5 "Average Difference" C 24 0.570 -0.224 0.536 18852
28 1 5 "Average Difference" CA 24 0.872 -0.189 0.870 18852
29 1 5 "Average Difference" CB 24 0.556 0.271 0.497 18852
30 1 5 "Average Difference" HN 23 0.430 -0.329 0.283 18852
31 1 6 "Average Difference" N 23 1.074 -0.322 1.047 18852
32 1 6 "Average Difference" HA 24 0.172 -0.056 0.166 18852
33 1 6 "Average Difference" C 24 0.546 -0.194 0.521 18852
34 1 6 "Average Difference" CA 24 0.710 -0.173 0.703 18852
35 1 6 "Average Difference" CB 24 0.548 0.219 0.513 18852
36 1 6 "Average Difference" HN 23 0.513 -0.321 0.409 18852
37 1 7 "Average Difference" N 23 1.016 -0.358 0.972 18852
38 1 7 "Average Difference" HA 24 0.138 -0.040 0.135 18852
39 1 7 "Average Difference" C 24 0.607 -0.224 0.576 18852
40 1 7 "Average Difference" CA 24 0.749 -0.243 0.724 18852
41 1 7 "Average Difference" CB 24 0.523 0.277 0.453 18852
42 1 7 "Average Difference" HN 23 0.459 -0.347 0.308 18852
43 1 8 "Average Difference" N 23 0.831 -0.460 0.708 18852
44 1 8 "Average Difference" HA 24 0.115 -0.030 0.114 18852
45 1 8 "Average Difference" C 24 0.557 -0.206 0.528 18852
46 1 8 "Average Difference" CA 24 0.708 -0.230 0.684 18852
47 1 8 "Average Difference" CB 24 0.588 0.248 0.545 18852
48 1 8 "Average Difference" HN 23 0.530 -0.387 0.371 18852
49 1 9 "Average Difference" N 23 1.089 -0.220 1.091 18852
50 1 9 "Average Difference" HA 24 0.113 -0.023 0.113 18852
51 1 9 "Average Difference" C 24 0.560 -0.265 0.503 18852
52 1 9 "Average Difference" CA 24 0.734 -0.206 0.719 18852
53 1 9 "Average Difference" CB 24 0.597 0.239 0.559 18852
54 1 9 "Average Difference" HN 23 0.454 -0.272 0.371 18852
55 1 10 "Average Difference" N 23 1.289 -0.396 1.254 18852
56 1 10 "Average Difference" HA 24 0.170 -0.013 0.173 18852
57 1 10 "Average Difference" C 24 0.548 -0.171 0.532 18852
58 1 10 "Average Difference" CA 24 0.747 -0.216 0.730 18852
59 1 10 "Average Difference" CB 24 0.662 0.313 0.596 18852
60 1 10 "Average Difference" HN 23 0.423 -0.285 0.319 18852
61 1 11 "Average Difference" N 23 0.927 -0.372 0.868 18852
62 1 11 "Average Difference" HA 24 0.096 -0.025 0.095 18852
63 1 11 "Average Difference" C 24 0.570 -0.215 0.539 18852
64 1 11 "Average Difference" CA 24 0.718 -0.102 0.726 18852
65 1 11 "Average Difference" CB 24 0.517 0.279 0.445 18852
66 1 11 "Average Difference" HN 23 0.524 -0.362 0.388 18852
67 1 12 "Average Difference" N 23 1.156 -0.225 1.159 18852
68 1 12 "Average Difference" HA 24 0.111 -0.013 0.113 18852
69 1 12 "Average Difference" C 24 0.642 -0.261 0.599 18852
70 1 12 "Average Difference" CA 24 0.942 -0.263 0.924 18852
71 1 12 "Average Difference" CB 24 0.531 0.296 0.450 18852
72 1 12 "Average Difference" HN 23 0.441 -0.295 0.335 18852
73 1 13 "Average Difference" N 23 1.010 -0.239 1.003 18852
74 1 13 "Average Difference" HA 24 0.139 -0.001 0.142 18852
75 1 13 "Average Difference" C 24 0.527 -0.144 0.518 18852
76 1 13 "Average Difference" CA 24 0.801 -0.266 0.772 18852
77 1 13 "Average Difference" CB 24 0.571 0.262 0.519 18852
78 1 13 "Average Difference" HN 23 0.462 -0.296 0.362 18852
79 1 14 "Average Difference" N 23 1.586 -0.568 1.514 18852
80 1 14 "Average Difference" HA 24 0.145 0.028 0.145 18852
81 1 14 "Average Difference" C 24 0.610 -0.350 0.511 18852
82 1 14 "Average Difference" CA 24 1.052 -0.505 0.942 18852
83 1 14 "Average Difference" CB 24 0.624 0.339 0.535 18852
84 1 14 "Average Difference" HN 23 0.507 -0.345 0.381 18852
85 1 15 "Average Difference" N 23 0.921 -0.361 0.867 18852
86 1 15 "Average Difference" HA 24 0.108 -0.021 0.109 18852
87 1 15 "Average Difference" C 24 0.494 -0.171 0.473 18852
88 1 15 "Average Difference" CA 24 0.584 -0.235 0.546 18852
89 1 15 "Average Difference" CB 24 0.581 0.315 0.499 18852
90 1 15 "Average Difference" HN 23 0.455 -0.337 0.312 18852
91 1 16 "Average Difference" N 23 1.058 -0.255 1.050 18852
92 1 16 "Average Difference" HA 24 0.126 -0.042 0.121 18852
93 1 16 "Average Difference" C 24 0.596 -0.188 0.577 18852
94 1 16 "Average Difference" CA 24 0.781 -0.116 0.789 18852
95 1 16 "Average Difference" CB 24 0.512 0.259 0.451 18852
96 1 16 "Average Difference" HN 23 0.518 -0.302 0.430 18852
97 1 17 "Average Difference" N 23 0.976 -0.174 0.982 18852
98 1 17 "Average Difference" HA 24 0.115 -0.036 0.111 18852
99 1 17 "Average Difference" C 24 0.553 -0.158 0.541 18852
100 1 17 "Average Difference" CA 24 0.637 -0.108 0.641 18852
101 1 17 "Average Difference" CB 24 0.501 0.214 0.463 18852
102 1 17 "Average Difference" HN 23 0.495 -0.255 0.434 18852
103 1 18 "Average Difference" N 23 1.188 -0.294 1.177 18852
104 1 18 "Average Difference" HA 24 0.125 -0.005 0.127 18852
105 1 18 "Average Difference" C 24 0.665 -0.292 0.610 18852
106 1 18 "Average Difference" CA 24 0.898 -0.382 0.830 18852
107 1 18 "Average Difference" CB 24 0.549 0.220 0.513 18852
108 1 18 "Average Difference" HN 23 0.463 -0.294 0.365 18852
109 1 19 "Average Difference" N 23 1.250 -0.254 1.251 18852
110 1 19 "Average Difference" HA 24 0.134 0.018 0.135 18852
111 1 19 "Average Difference" C 24 0.564 -0.215 0.532 18852
112 1 19 "Average Difference" CA 24 0.901 -0.208 0.896 18852
113 1 19 "Average Difference" CB 24 0.596 0.311 0.519 18852
114 1 19 "Average Difference" HN 23 0.450 -0.247 0.384 18852
115 1 20 "Average Difference" N 23 1.083 -0.238 1.080 18852
116 1 20 "Average Difference" HA 24 0.118 -0.000 0.121 18852
117 1 20 "Average Difference" C 24 0.564 -0.136 0.559 18852
118 1 20 "Average Difference" CA 24 0.749 -0.240 0.725 18852
119 1 20 "Average Difference" CB 24 0.597 0.306 0.523 18852
120 1 20 "Average Difference" HN 23 0.459 -0.235 0.403 18852
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 18852
_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 4.239 4.239 4.210 0.029 18852
2 1 . 1 1 2 2 ALA C C 2 179.180 179.180 179.460 -0.280 18852
3 1 . 1 1 2 2 ALA CA C 2 54.532 54.532 54.136 0.397 18852
4 1 . 1 1 2 2 ALA CB C 2 18.397 18.397 19.252 -0.855 18852
5 1 . 1 1 3 3 MET N N 3 117.814 117.814 117.590 0.224 18852
6 1 . 1 1 3 3 MET HA H 3 4.354 4.354 4.276 0.077 18852
7 1 . 1 1 3 3 MET C C 3 177.926 177.926 177.840 0.086 18852
8 1 . 1 1 3 3 MET CA C 3 57.876 57.876 57.528 0.348 18852
9 1 . 1 1 3 3 MET CB C 3 31.673 31.673 32.076 -0.403 18852
10 1 . 1 1 3 3 MET H H 3 8.613 8.613 8.181 0.433 18852
11 1 . 1 1 4 4 ALA N N 4 122.603 122.603 121.405 1.198 18852
12 1 . 1 1 4 4 ALA HA H 4 4.228 4.228 4.127 0.101 18852
13 1 . 1 1 4 4 ALA C C 4 179.940 179.940 179.368 0.572 18852
14 1 . 1 1 4 4 ALA CA C 4 54.689 54.689 55.109 -0.420 18852
15 1 . 1 1 4 4 ALA CB C 4 18.025 18.025 18.106 -0.081 18852
16 1 . 1 1 4 4 ALA H H 4 8.324 8.324 8.231 0.093 18852
17 1 . 1 1 5 5 THR N N 5 112.671 112.671 113.361 -0.690 18852
18 1 . 1 1 5 5 THR HA H 5 4.121 4.121 3.975 0.146 18852
19 1 . 1 1 5 5 THR C C 5 176.085 176.085 176.539 -0.454 18852
20 1 . 1 1 5 5 THR CA C 5 65.053 65.053 65.935 -0.882 18852
21 1 . 1 1 5 5 THR CB C 5 68.989 68.989 68.580 0.409 18852
22 1 . 1 1 5 5 THR H H 5 7.966 7.966 7.800 0.166 18852
23 1 . 1 1 6 6 ARG N N 6 122.300 122.300 121.461 0.839 18852
24 1 . 1 1 6 6 ARG HA H 6 4.057 4.057 4.002 0.055 18852
25 1 . 1 1 6 6 ARG C C 6 178.983 178.983 178.678 0.305 18852
26 1 . 1 1 6 6 ARG CA C 6 59.963 59.963 59.235 0.728 18852
27 1 . 1 1 6 6 ARG CB C 6 29.853 29.853 29.977 -0.124 18852
28 1 . 1 1 6 6 ARG H H 6 8.244 8.244 7.670 0.574 18852
29 1 . 1 1 7 7 GLN N N 7 118.940 118.940 118.842 0.098 18852
30 1 . 1 1 7 7 GLN HA H 7 4.058 4.058 4.098 -0.040 18852
31 1 . 1 1 7 7 GLN C C 7 177.997 177.997 177.887 0.110 18852
32 1 . 1 1 7 7 GLN CA C 7 58.735 58.735 58.371 0.364 18852
33 1 . 1 1 7 7 GLN CB C 7 28.188 28.188 28.344 -0.156 18852
34 1 . 1 1 7 7 GLN H H 7 8.424 8.424 7.824 0.600 18852
35 1 . 1 1 8 8 ALA N N 8 122.920 122.920 122.253 0.667 18852
36 1 . 1 1 8 8 ALA HA H 8 4.217 4.217 4.029 0.188 18852
37 1 . 1 1 8 8 ALA C C 8 180.837 180.837 179.600 1.237 18852
38 1 . 1 1 8 8 ALA CA C 8 55.319 55.319 54.905 0.414 18852
39 1 . 1 1 8 8 ALA CB C 8 17.695 17.695 18.241 -0.546 18852
40 1 . 1 1 8 8 ALA H H 8 8.306 8.306 7.884 0.422 18852
41 1 . 1 1 9 9 ARG N N 9 118.721 118.721 117.935 0.786 18852
42 1 . 1 1 9 9 ARG HA H 9 4.050 4.050 4.061 -0.010 18852
43 1 . 1 1 9 9 ARG C C 9 178.843 178.843 178.644 0.199 18852
44 1 . 1 1 9 9 ARG CA C 9 59.721 59.721 58.817 0.904 18852
45 1 . 1 1 9 9 ARG CB C 9 30.168 30.168 29.912 0.256 18852
46 1 . 1 1 9 9 ARG H H 9 8.263 8.263 7.851 0.412 18852
47 1 . 1 1 10 10 ARG N N 10 120.338 120.338 119.059 1.279 18852
48 1 . 1 1 10 10 ARG HA H 10 4.074 4.074 4.107 -0.033 18852
49 1 . 1 1 10 10 ARG C C 10 179.024 179.024 178.565 0.459 18852
50 1 . 1 1 10 10 ARG CA C 10 59.542 59.542 59.189 0.353 18852
51 1 . 1 1 10 10 ARG CB C 10 29.904 29.904 29.849 0.055 18852
52 1 . 1 1 10 10 ARG H H 10 8.251 8.251 7.823 0.428 18852
53 1 . 1 1 11 11 ASN N N 11 118.863 118.863 118.162 0.701 18852
54 1 . 1 1 11 11 ASN HA H 11 4.543 4.543 4.497 0.046 18852
55 1 . 1 1 11 11 ASN C C 11 177.279 177.279 177.487 -0.208 18852
56 1 . 1 1 11 11 ASN CA C 11 55.979 55.979 55.954 0.025 18852
57 1 . 1 1 11 11 ASN CB C 11 37.983 37.983 38.062 -0.079 18852
58 1 . 1 1 11 11 ASN H H 11 8.551 8.551 8.046 0.505 18852
59 1 . 1 1 12 12 ARG N N 12 120.917 120.917 120.696 0.221 18852
60 1 . 1 1 12 12 ARG HA H 12 4.079 4.079 4.035 0.044 18852
61 1 . 1 1 12 12 ARG C C 12 178.488 178.488 178.548 -0.060 18852
62 1 . 1 1 12 12 ARG CA C 12 59.787 59.787 59.217 0.570 18852
63 1 . 1 1 12 12 ARG CB C 12 29.937 29.937 30.092 -0.155 18852
64 1 . 1 1 12 12 ARG H H 12 8.253 8.253 8.117 0.136 18852
65 1 . 1 1 13 13 ARG N N 13 119.263 119.263 118.245 1.018 18852
66 1 . 1 1 13 13 ARG HA H 13 4.189 4.189 4.220 -0.031 18852
67 1 . 1 1 13 13 ARG C C 13 178.479 178.479 178.790 -0.311 18852
68 1 . 1 1 13 13 ARG CA C 13 59.572 59.572 58.708 0.864 18852
69 1 . 1 1 13 13 ARG CB C 13 30.067 30.067 29.794 0.273 18852
70 1 . 1 1 13 13 ARG H H 13 8.167 8.167 7.874 0.293 18852
71 1 . 1 1 14 14 ARG N N 14 119.756 119.756 120.178 -0.422 18852
72 1 . 1 1 14 14 ARG HA H 14 4.141 4.141 4.085 0.056 18852
73 1 . 1 1 14 14 ARG C C 14 178.817 178.817 178.510 0.307 18852
74 1 . 1 1 14 14 ARG CA C 14 59.695 59.695 59.166 0.529 18852
75 1 . 1 1 14 14 ARG CB C 14 29.812 29.812 29.965 -0.153 18852
76 1 . 1 1 14 14 ARG H H 14 8.285 8.285 8.013 0.272 18852
77 1 . 1 1 15 15 ARG N N 15 119.026 119.026 119.533 -0.507 18852
78 1 . 1 1 15 15 ARG HA H 15 4.158 4.158 4.060 0.098 18852
79 1 . 1 1 15 15 ARG C C 15 178.909 178.909 178.583 0.326 18852
80 1 . 1 1 15 15 ARG CA C 15 59.233 59.233 59.333 -0.100 18852
81 1 . 1 1 15 15 ARG CB C 15 29.772 29.772 29.735 0.037 18852
82 1 . 1 1 15 15 ARG H H 15 8.278 8.278 7.998 0.280 18852
83 1 . 1 1 16 16 TRP N N 16 121.055 121.055 119.928 1.127 18852
84 1 . 1 1 16 16 TRP HA H 16 4.389 4.389 4.396 -0.007 18852
85 1 . 1 1 16 16 TRP C C 16 178.621 178.621 178.279 0.342 18852
86 1 . 1 1 16 16 TRP CA C 16 61.013 61.013 60.025 0.988 18852
87 1 . 1 1 16 16 TRP CB C 16 28.796 28.796 29.234 -0.438 18852
88 1 . 1 1 16 16 TRP H H 16 8.464 8.464 7.737 0.727 18852
89 1 . 1 1 17 17 ARG N N 17 119.474 119.474 119.218 0.256 18852
90 1 . 1 1 17 17 ARG HA H 17 3.910 3.910 3.919 -0.009 18852
91 1 . 1 1 17 17 ARG C C 17 179.120 179.120 178.555 0.565 18852
92 1 . 1 1 17 17 ARG CA C 17 59.627 59.627 58.875 0.752 18852
93 1 . 1 1 17 17 ARG CB C 17 29.907 29.907 29.756 0.151 18852
94 1 . 1 1 17 17 ARG H H 17 8.537 8.537 7.746 0.791 18852
95 1 . 1 1 18 18 GLU N N 18 119.223 119.223 118.274 0.949 18852
96 1 . 1 1 18 18 GLU HA H 18 4.061 4.061 4.046 0.015 18852
97 1 . 1 1 18 18 GLU C C 18 179.163 179.163 179.081 0.082 18852
98 1 . 1 1 18 18 GLU CA C 18 59.138 59.138 58.936 0.202 18852
99 1 . 1 1 18 18 GLU CB C 18 29.135 29.135 29.267 -0.132 18852
100 1 . 1 1 18 18 GLU H H 18 8.346 8.346 8.003 0.343 18852
101 1 . 1 1 19 19 ARG N N 19 119.942 119.942 118.970 0.972 18852
102 1 . 1 1 19 19 ARG HA H 19 4.046 4.046 4.137 -0.092 18852
103 1 . 1 1 19 19 ARG C C 19 178.634 178.634 178.804 -0.170 18852
104 1 . 1 1 19 19 ARG CA C 19 59.016 59.016 58.377 0.639 18852
105 1 . 1 1 19 19 ARG CB C 19 29.371 29.371 30.190 -0.819 18852
106 1 . 1 1 19 19 ARG H H 19 8.104 8.104 8.011 0.093 18852
107 1 . 1 1 20 20 GLN N N 20 118.373 118.373 119.309 -0.936 18852
108 1 . 1 1 20 20 GLN HA H 20 3.892 3.892 4.056 -0.164 18852
109 1 . 1 1 20 20 GLN C C 20 178.465 178.465 177.699 0.766 18852
110 1 . 1 1 20 20 GLN CA C 20 58.170 58.170 58.554 -0.384 18852
111 1 . 1 1 20 20 GLN CB C 20 28.113 28.113 28.291 -0.178 18852
112 1 . 1 1 20 20 GLN H H 20 8.044 8.044 7.821 0.223 18852
113 1 . 1 1 21 21 ARG N N 21 119.374 119.374 119.821 -0.447 18852
114 1 . 1 1 21 21 ARG HA H 21 4.034 4.034 3.983 0.051 18852
115 1 . 1 1 21 21 ARG C C 21 178.423 178.423 178.318 0.105 18852
116 1 . 1 1 21 21 ARG CA C 21 58.765 58.765 58.987 -0.222 18852
117 1 . 1 1 21 21 ARG CB C 21 29.676 29.676 29.866 -0.190 18852
118 1 . 1 1 21 21 ARG H H 21 8.079 8.079 7.736 0.343 18852
119 1 . 1 1 22 22 ALA N N 22 121.393 121.393 120.327 1.066 18852
120 1 . 1 1 22 22 ALA HA H 22 4.146 4.146 4.128 0.018 18852
121 1 . 1 1 22 22 ALA C C 22 179.577 179.577 178.345 1.232 18852
122 1 . 1 1 22 22 ALA CA C 22 54.267 54.267 54.897 -0.630 18852
123 1 . 1 1 22 22 ALA CB C 22 17.831 17.831 18.469 -0.638 18852
124 1 . 1 1 22 22 ALA H H 22 8.026 8.026 7.615 0.411 18852
125 1 . 1 1 23 23 ALA N N 23 119.867 119.867 120.619 -0.751 18852
126 1 . 1 1 23 23 ALA HA H 23 4.158 4.158 4.266 -0.107 18852
127 1 . 1 1 23 23 ALA C C 23 178.616 178.616 179.299 -0.683 18852
128 1 . 1 1 23 23 ALA CA C 23 53.714 53.714 53.877 -0.163 18852
129 1 . 1 1 23 23 ALA CB C 23 18.045 18.045 18.705 -0.660 18852
130 1 . 1 1 23 23 ALA H H 23 7.938 7.938 7.555 0.383 18852
131 1 . 1 1 24 24 ALA N N 24 119.652 119.652 121.002 -1.350 18852
132 1 . 1 1 24 24 ALA HA H 24 4.291 4.291 4.116 0.175 18852
133 1 . 1 1 24 24 ALA C C 24 177.528 177.528 177.653 -0.125 18852
134 1 . 1 1 24 24 ALA CA C 24 52.706 52.706 53.793 -1.087 18852
135 1 . 1 1 24 24 ALA CB C 24 18.591 18.591 19.225 -0.634 18852
136 1 . 1 1 24 24 ALA H H 24 7.693 7.693 8.306 -0.613 18852
137 1 . 1 1 25 25 ALA N N 25 121.574 121.574 120.622 0.952 18852
138 1 . 1 1 25 25 ALA HA H 25 4.329 4.329 4.563 -0.234 18852
139 1 . 1 1 25 25 ALA C C 25 176.649 176.649 175.862 0.787 18852
140 1 . 1 1 25 25 ALA CA C 25 52.566 52.566 50.839 1.727 18852
141 1 . 1 1 25 25 ALA CB C 25 18.630 18.630 20.343 -1.713 18852
142 1 . 1 1 25 25 ALA H H 25 7.679 7.679 7.737 -0.058 18852
stop_
save_