data_19205
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 19205
_Entry.PDB_ID 2M7T
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 19205
_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 CYS N N 2 120.511 120.511 118.399 2.112 19205
2 1 1 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.833 0.040 19205
3 1 1 . 1 1 2 2 CYS CA C 2 53.145 53.145 55.270 -2.125 19205
4 1 1 . 1 1 2 2 CYS CB C 2 41.921 41.921 26.867 15.054 19205
5 1 1 . 1 1 2 2 CYS H H 2 8.866 8.866 8.614 0.252 19205
6 1 1 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.199 0.099 19205
7 1 1 . 1 1 3 3 PRO C C 3 176.294 176.294 175.518 0.776 19205
8 1 1 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.048 0.726 19205
9 1 1 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.284 1.607 19205
10 1 1 . 1 1 4 4 GLN N N 4 118.141 118.141 117.913 0.228 19205
11 1 1 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.654 -0.760 19205
12 1 1 . 1 1 4 4 GLN C C 4 176.143 176.143 175.162 0.981 19205
13 1 1 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.312 0.861 19205
14 1 1 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.765 -1.197 19205
15 1 1 . 1 1 4 4 GLN H H 4 7.648 7.648 8.298 -0.650 19205
16 1 1 . 1 1 5 5 GLY N N 5 108.656 108.656 107.008 1.648 19205
17 1 1 . 1 1 5 5 GLY C C 5 173.733 173.733 173.746 -0.013 19205
18 1 1 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.780 -0.523 19205
19 1 1 . 1 1 5 5 GLY H H 5 7.759 7.759 7.901 -0.142 19205
20 1 1 . 1 1 6 6 ARG N N 6 119.446 119.446 120.543 -1.097 19205
21 1 1 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.852 -0.463 19205
22 1 1 . 1 1 6 6 ARG C C 6 176.780 176.780 178.060 -1.280 19205
23 1 1 . 1 1 6 6 ARG CA C 6 55.538 55.538 53.797 1.741 19205
24 1 1 . 1 1 6 6 ARG CB C 6 31.543 31.543 31.652 -0.109 19205
25 1 1 . 1 1 6 6 ARG H H 6 7.865 7.865 8.147 -0.282 19205
26 1 1 . 1 1 7 7 GLY N N 7 109.318 109.318 109.918 -0.600 19205
27 1 1 . 1 1 7 7 GLY C C 7 174.275 174.275 174.877 -0.602 19205
28 1 1 . 1 1 7 7 GLY CA C 7 46.020 46.020 47.247 -1.227 19205
29 1 1 . 1 1 7 7 GLY H H 7 8.529 8.529 8.598 -0.069 19205
30 1 1 . 1 1 8 8 ASP N N 8 121.036 121.036 120.143 0.893 19205
31 1 1 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.734 -0.179 19205
32 1 1 . 1 1 8 8 ASP C C 8 175.562 175.562 174.716 0.846 19205
33 1 1 . 1 1 8 8 ASP CA C 8 53.748 53.748 53.555 0.193 19205
34 1 1 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.826 -0.767 19205
35 1 1 . 1 1 8 8 ASP H H 8 8.414 8.414 8.674 -0.260 19205
36 1 1 . 1 1 9 9 TRP N N 9 121.704 121.704 122.662 -0.958 19205
37 1 1 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.802 -0.309 19205
38 1 1 . 1 1 9 9 TRP C C 9 175.498 175.498 174.842 0.656 19205
39 1 1 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.792 1.302 19205
40 1 1 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.054 0.755 19205
41 1 1 . 1 1 9 9 TRP H H 9 7.814 7.814 7.595 0.219 19205
42 1 1 . 1 1 10 10 ALA N N 10 128.588 128.588 127.566 1.022 19205
43 1 1 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.414 -0.001 19205
44 1 1 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.711 -0.441 19205
45 1 1 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.537 -0.422 19205
46 1 1 . 1 1 10 10 ALA H H 10 8.163 8.163 8.031 0.132 19205
47 1 1 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.936 -0.605 19205
48 1 1 . 1 1 11 11 PRO C C 11 176.753 176.753 176.748 0.005 19205
49 1 1 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.101 0.895 19205
50 1 1 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.364 0.081 19205
51 1 1 . 1 1 12 12 THR N N 12 119.798 119.798 117.926 1.872 19205
52 1 1 . 1 1 12 12 THR HA H 12 4.512 4.512 4.726 -0.214 19205
53 1 1 . 1 1 12 12 THR C C 12 173.572 173.572 174.697 -1.125 19205
54 1 1 . 1 1 12 12 THR CA C 12 62.099 62.099 62.019 0.080 19205
55 1 1 . 1 1 12 12 THR CB C 12 71.060 71.060 70.240 0.820 19205
56 1 1 . 1 1 12 12 THR H H 12 9.006 9.006 8.603 0.403 19205
57 1 1 . 1 1 13 13 SER N N 13 123.494 123.494 122.423 1.071 19205
58 1 1 . 1 1 13 13 SER HA H 13 4.539 4.539 4.545 -0.006 19205
59 1 1 . 1 1 13 13 SER C C 13 172.953 172.953 174.620 -1.667 19205
60 1 1 . 1 1 13 13 SER CA C 13 58.421 58.421 58.430 -0.009 19205
61 1 1 . 1 1 13 13 SER CB C 13 63.844 63.844 62.941 0.903 19205
62 1 1 . 1 1 13 13 SER H H 13 8.805 8.805 8.795 0.010 19205
63 1 1 . 1 1 14 14 CYS N N 14 116.548 116.548 120.435 -3.887 19205
64 1 1 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.822 0.118 19205
65 1 1 . 1 1 14 14 CYS C C 14 172.746 172.746 173.838 -1.092 19205
66 1 1 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.806 -3.000 19205
67 1 1 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.917 15.688 19205
68 1 1 . 1 1 14 14 CYS H H 14 8.265 8.265 8.279 -0.014 19205
69 1 1 . 1 1 15 15 SER N N 15 113.958 113.958 114.383 -0.425 19205
70 1 1 . 1 1 15 15 SER HA H 15 4.531 4.531 4.667 -0.136 19205
71 1 1 . 1 1 15 15 SER C C 15 173.205 173.205 173.855 -0.650 19205
72 1 1 . 1 1 15 15 SER CA C 15 58.826 58.826 58.809 0.017 19205
73 1 1 . 1 1 15 15 SER CB C 15 65.097 65.097 65.138 -0.040 19205
74 1 1 . 1 1 15 15 SER H H 15 9.497 9.497 9.246 0.251 19205
75 1 1 . 1 1 16 16 GLN N N 16 118.516 118.516 119.258 -0.742 19205
76 1 1 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.742 0.002 19205
77 1 1 . 1 1 16 16 GLN C C 16 176.335 176.335 174.561 1.774 19205
78 1 1 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.719 -0.778 19205
79 1 1 . 1 1 16 16 GLN CB C 16 31.323 31.323 30.821 0.502 19205
80 1 1 . 1 1 16 16 GLN H H 16 8.049 8.049 7.987 0.062 19205
81 1 1 . 1 1 17 17 ASP N N 17 124.190 124.190 121.905 2.285 19205
82 1 1 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.445 -0.336 19205
83 1 1 . 1 1 17 17 ASP C C 17 178.349 178.349 178.073 0.276 19205
84 1 1 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.335 1.612 19205
85 1 1 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.455 -0.931 19205
86 1 1 . 1 1 17 17 ASP H H 17 9.208 9.208 8.833 0.375 19205
87 1 1 . 1 1 18 18 SER N N 18 112.259 112.259 112.788 -0.529 19205
88 1 1 . 1 1 18 18 SER HA H 18 4.228 4.228 4.229 -0.001 19205
89 1 1 . 1 1 18 18 SER C C 18 175.037 175.037 175.351 -0.314 19205
90 1 1 . 1 1 18 18 SER CA C 18 60.093 60.093 59.800 0.293 19205
91 1 1 . 1 1 18 18 SER CB C 18 62.134 62.134 63.032 -0.898 19205
92 1 1 . 1 1 18 18 SER H H 18 8.371 8.371 8.257 0.114 19205
93 1 1 . 1 1 19 19 ASP N N 19 120.750 120.750 120.069 0.681 19205
94 1 1 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.698 -0.107 19205
95 1 1 . 1 1 19 19 ASP C C 19 175.958 175.958 176.432 -0.474 19205
96 1 1 . 1 1 19 19 ASP CA C 19 55.885 55.885 54.846 1.039 19205
97 1 1 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.000 1.022 19205
98 1 1 . 1 1 19 19 ASP H H 19 7.697 7.697 7.738 -0.041 19205
99 1 1 . 1 1 20 20 CYS N N 20 118.125 118.125 117.289 0.836 19205
100 1 1 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.674 0.303 19205
101 1 1 . 1 1 20 20 CYS C C 20 174.152 174.152 174.543 -0.391 19205
102 1 1 . 1 1 20 20 CYS CA C 20 51.981 51.981 57.671 -5.690 19205
103 1 1 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.718 10.256 19205
104 1 1 . 1 1 20 20 CYS H H 20 7.947 7.947 7.654 0.293 19205
105 1 1 . 1 1 21 21 LEU N N 21 121.658 121.658 121.383 0.275 19205
106 1 1 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.351 -0.184 19205
107 1 1 . 1 1 21 21 LEU C C 21 176.589 176.589 177.594 -1.005 19205
108 1 1 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.553 0.333 19205
109 1 1 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.713 0.210 19205
110 1 1 . 1 1 21 21 LEU H H 21 8.522 8.522 8.426 0.096 19205
111 1 1 . 1 1 22 22 ALA N N 22 121.907 121.907 122.908 -1.001 19205
112 1 1 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.171 -0.099 19205
113 1 1 . 1 1 22 22 ALA C C 22 178.382 178.382 178.568 -0.186 19205
114 1 1 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.565 0.400 19205
115 1 1 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.369 -0.425 19205
116 1 1 . 1 1 22 22 ALA H H 22 8.104 8.104 8.436 -0.332 19205
117 1 1 . 1 1 23 23 GLY N N 23 110.790 110.790 111.367 -0.577 19205
118 1 1 . 1 1 23 23 GLY C C 23 174.553 174.553 174.596 -0.043 19205
119 1 1 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.868 -0.247 19205
120 1 1 . 1 1 23 23 GLY H H 23 8.644 8.644 8.633 0.011 19205
121 1 1 . 1 1 24 24 CYS N N 24 119.431 119.431 120.082 -0.651 19205
122 1 1 . 1 1 24 24 CYS HA H 24 4.850 4.850 5.092 -0.242 19205
123 1 1 . 1 1 24 24 CYS C C 24 172.768 172.768 174.309 -1.541 19205
124 1 1 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.732 -3.830 19205
125 1 1 . 1 1 24 24 CYS CB C 24 46.168 46.168 29.696 16.472 19205
126 1 1 . 1 1 24 24 CYS H H 24 8.491 8.491 7.625 0.866 19205
127 1 1 . 1 1 25 25 VAL N N 25 115.469 115.469 117.248 -1.779 19205
128 1 1 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.636 -0.269 19205
129 1 1 . 1 1 25 25 VAL C C 25 175.161 175.161 173.884 1.277 19205
130 1 1 . 1 1 25 25 VAL CA C 25 59.327 59.327 59.309 0.019 19205
131 1 1 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.360 0.675 19205
132 1 1 . 1 1 25 25 VAL H H 25 9.324 9.324 9.055 0.269 19205
133 1 1 . 1 1 26 26 CYS N N 26 123.350 123.350 121.391 1.959 19205
134 1 1 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.907 -0.097 19205
135 1 1 . 1 1 26 26 CYS C C 26 174.891 174.891 176.082 -1.191 19205
136 1 1 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.777 -3.578 19205
137 1 1 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.617 12.643 19205
138 1 1 . 1 1 26 26 CYS H H 26 9.346 9.346 8.857 0.489 19205
139 1 1 . 1 1 27 27 GLY N N 27 117.742 117.742 116.695 1.047 19205
140 1 1 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.206 1.252 19205
141 1 1 . 1 1 27 27 GLY H H 27 8.259 8.259 9.080 -0.821 19205
142 1 1 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.426 -0.056 19205
143 1 1 . 1 1 28 28 PRO C C 28 176.720 176.720 176.762 -0.042 19205
144 1 1 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.450 0.036 19205
145 1 1 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.651 -0.098 19205
146 1 1 . 1 1 29 29 ASN N N 29 114.300 114.300 116.212 -1.912 19205
147 1 1 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.687 -0.038 19205
148 1 1 . 1 1 29 29 ASN C C 29 175.490 175.490 176.400 -0.910 19205
149 1 1 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.816 -0.481 19205
150 1 1 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.505 0.061 19205
151 1 1 . 1 1 29 29 ASN H H 29 8.061 8.061 8.184 -0.123 19205
152 1 1 . 1 1 30 30 GLY N N 30 107.086 107.086 107.280 -0.194 19205
153 1 1 . 1 1 30 30 GLY C C 30 173.758 173.758 173.011 0.747 19205
154 1 1 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.369 0.943 19205
155 1 1 . 1 1 30 30 GLY H H 30 8.294 8.294 7.913 0.381 19205
156 1 1 . 1 1 31 31 PHE N N 31 115.129 115.129 118.362 -3.233 19205
157 1 1 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.361 -0.011 19205
158 1 1 . 1 1 31 31 PHE C C 31 176.773 176.773 175.028 1.745 19205
159 1 1 . 1 1 31 31 PHE CA C 31 56.410 56.410 55.844 0.566 19205
160 1 1 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.749 -0.275 19205
161 1 1 . 1 1 31 31 PHE H H 31 7.167 7.167 8.194 -1.027 19205
162 1 1 . 1 1 32 32 CYS N N 32 123.123 123.123 120.480 2.643 19205
163 1 1 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.222 -0.123 19205
164 1 1 . 1 1 32 32 CYS C C 32 175.875 175.875 175.825 0.050 19205
165 1 1 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.129 -3.699 19205
166 1 1 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.702 15.385 19205
167 1 1 . 1 1 32 32 CYS H H 32 8.708 8.708 8.926 -0.218 19205
168 1 2 . 1 1 2 2 CYS N N 2 120.511 120.511 116.761 3.750 19205
169 1 2 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.997 -0.124 19205
170 1 2 . 1 1 2 2 CYS CA C 2 53.145 53.145 57.012 -3.867 19205
171 1 2 . 1 1 2 2 CYS CB C 2 41.921 41.921 28.956 12.965 19205
172 1 2 . 1 1 2 2 CYS H H 2 8.866 8.866 8.144 0.722 19205
173 1 2 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.260 0.038 19205
174 1 2 . 1 1 3 3 PRO C C 3 176.294 176.294 175.559 0.735 19205
175 1 2 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.163 0.611 19205
176 1 2 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.382 1.509 19205
177 1 2 . 1 1 4 4 GLN N N 4 118.141 118.141 117.674 0.467 19205
178 1 2 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.653 -0.759 19205
179 1 2 . 1 1 4 4 GLN C C 4 176.143 176.143 175.149 0.994 19205
180 1 2 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.426 0.747 19205
181 1 2 . 1 1 4 4 GLN CB C 4 29.568 29.568 31.047 -1.479 19205
182 1 2 . 1 1 4 4 GLN H H 4 7.648 7.648 8.309 -0.661 19205
183 1 2 . 1 1 5 5 GLY N N 5 108.656 108.656 107.269 1.387 19205
184 1 2 . 1 1 5 5 GLY C C 5 173.733 173.733 173.646 0.087 19205
185 1 2 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.849 -0.592 19205
186 1 2 . 1 1 5 5 GLY H H 5 7.759 7.759 7.662 0.097 19205
187 1 2 . 1 1 6 6 ARG N N 6 119.446 119.446 120.679 -1.233 19205
188 1 2 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.885 -0.496 19205
189 1 2 . 1 1 6 6 ARG C C 6 176.780 176.780 177.114 -0.334 19205
190 1 2 . 1 1 6 6 ARG CA C 6 55.538 55.538 53.289 2.249 19205
191 1 2 . 1 1 6 6 ARG CB C 6 31.543 31.543 31.197 0.346 19205
192 1 2 . 1 1 6 6 ARG H H 6 7.865 7.865 8.141 -0.276 19205
193 1 2 . 1 1 7 7 GLY N N 7 109.318 109.318 109.321 -0.003 19205
194 1 2 . 1 1 7 7 GLY C C 7 174.275 174.275 174.846 -0.571 19205
195 1 2 . 1 1 7 7 GLY CA C 7 46.020 46.020 46.526 -0.506 19205
196 1 2 . 1 1 7 7 GLY H H 7 8.529 8.529 8.542 -0.013 19205
197 1 2 . 1 1 8 8 ASP N N 8 121.036 121.036 119.496 1.540 19205
198 1 2 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.653 -0.098 19205
199 1 2 . 1 1 8 8 ASP C C 8 175.562 175.562 176.286 -0.724 19205
200 1 2 . 1 1 8 8 ASP CA C 8 53.748 53.748 54.239 -0.491 19205
201 1 2 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.792 -0.733 19205
202 1 2 . 1 1 8 8 ASP H H 8 8.414 8.414 8.645 -0.231 19205
203 1 2 . 1 1 9 9 TRP N N 9 121.704 121.704 121.750 -0.046 19205
204 1 2 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.664 -0.171 19205
205 1 2 . 1 1 9 9 TRP C C 9 175.498 175.498 175.098 0.400 19205
206 1 2 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.708 1.386 19205
207 1 2 . 1 1 9 9 TRP CB C 9 29.809 29.809 28.281 1.528 19205
208 1 2 . 1 1 9 9 TRP H H 9 7.814 7.814 8.056 -0.242 19205
209 1 2 . 1 1 10 10 ALA N N 10 128.588 128.588 128.106 0.482 19205
210 1 2 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.438 -0.025 19205
211 1 2 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.578 -0.308 19205
212 1 2 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.615 -0.500 19205
213 1 2 . 1 1 10 10 ALA H H 10 8.163 8.163 7.774 0.389 19205
214 1 2 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.859 -0.528 19205
215 1 2 . 1 1 11 11 PRO C C 11 176.753 176.753 176.556 0.197 19205
216 1 2 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.184 0.811 19205
217 1 2 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.424 0.021 19205
218 1 2 . 1 1 12 12 THR N N 12 119.798 119.798 118.239 1.559 19205
219 1 2 . 1 1 12 12 THR HA H 12 4.512 4.512 4.695 -0.183 19205
220 1 2 . 1 1 12 12 THR C C 12 173.572 173.572 174.678 -1.106 19205
221 1 2 . 1 1 12 12 THR CA C 12 62.099 62.099 61.733 0.366 19205
222 1 2 . 1 1 12 12 THR CB C 12 71.060 71.060 70.064 0.996 19205
223 1 2 . 1 1 12 12 THR H H 12 9.006 9.006 8.923 0.083 19205
224 1 2 . 1 1 13 13 SER N N 13 123.494 123.494 122.429 1.065 19205
225 1 2 . 1 1 13 13 SER HA H 13 4.539 4.539 4.563 -0.024 19205
226 1 2 . 1 1 13 13 SER C C 13 172.953 172.953 174.421 -1.468 19205
227 1 2 . 1 1 13 13 SER CA C 13 58.421 58.421 58.309 0.112 19205
228 1 2 . 1 1 13 13 SER CB C 13 63.844 63.844 63.145 0.699 19205
229 1 2 . 1 1 13 13 SER H H 13 8.805 8.805 8.765 0.040 19205
230 1 2 . 1 1 14 14 CYS N N 14 116.548 116.548 119.026 -2.478 19205
231 1 2 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.981 -0.041 19205
232 1 2 . 1 1 14 14 CYS C C 14 172.746 172.746 173.607 -0.861 19205
233 1 2 . 1 1 14 14 CYS CA C 14 53.806 53.806 57.196 -3.390 19205
234 1 2 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.645 15.960 19205
235 1 2 . 1 1 14 14 CYS H H 14 8.265 8.265 8.403 -0.138 19205
236 1 2 . 1 1 15 15 SER N N 15 113.958 113.958 114.479 -0.521 19205
237 1 2 . 1 1 15 15 SER HA H 15 4.531 4.531 4.616 -0.085 19205
238 1 2 . 1 1 15 15 SER C C 15 173.205 173.205 173.671 -0.466 19205
239 1 2 . 1 1 15 15 SER CA C 15 58.826 58.826 58.438 0.388 19205
240 1 2 . 1 1 15 15 SER CB C 15 65.097 65.097 64.511 0.586 19205
241 1 2 . 1 1 15 15 SER H H 15 9.497 9.497 9.112 0.385 19205
242 1 2 . 1 1 16 16 GLN N N 16 118.516 118.516 118.840 -0.324 19205
243 1 2 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.705 0.039 19205
244 1 2 . 1 1 16 16 GLN C C 16 176.335 176.335 174.484 1.851 19205
245 1 2 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.808 -0.867 19205
246 1 2 . 1 1 16 16 GLN CB C 16 31.323 31.323 30.775 0.548 19205
247 1 2 . 1 1 16 16 GLN H H 16 8.049 8.049 7.695 0.354 19205
248 1 2 . 1 1 17 17 ASP N N 17 124.190 124.190 122.055 2.135 19205
249 1 2 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.440 -0.331 19205
250 1 2 . 1 1 17 17 ASP C C 17 178.349 178.349 178.302 0.047 19205
251 1 2 . 1 1 17 17 ASP CA C 17 58.947 58.947 56.918 2.029 19205
252 1 2 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.431 -0.909 19205
253 1 2 . 1 1 17 17 ASP H H 17 9.208 9.208 8.878 0.330 19205
254 1 2 . 1 1 18 18 SER N N 18 112.259 112.259 112.707 -0.448 19205
255 1 2 . 1 1 18 18 SER HA H 18 4.228 4.228 4.245 -0.017 19205
256 1 2 . 1 1 18 18 SER C C 18 175.037 175.037 175.182 -0.145 19205
257 1 2 . 1 1 18 18 SER CA C 18 60.093 60.093 59.756 0.337 19205
258 1 2 . 1 1 18 18 SER CB C 18 62.134 62.134 62.998 -0.864 19205
259 1 2 . 1 1 18 18 SER H H 18 8.371 8.371 8.125 0.246 19205
260 1 2 . 1 1 19 19 ASP N N 19 120.750 120.750 120.586 0.164 19205
261 1 2 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.661 -0.070 19205
262 1 2 . 1 1 19 19 ASP C C 19 175.958 175.958 176.405 -0.447 19205
263 1 2 . 1 1 19 19 ASP CA C 19 55.885 55.885 55.060 0.825 19205
264 1 2 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.170 0.852 19205
265 1 2 . 1 1 19 19 ASP H H 19 7.697 7.697 7.714 -0.017 19205
266 1 2 . 1 1 20 20 CYS N N 20 118.125 118.125 116.564 1.561 19205
267 1 2 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.643 0.334 19205
268 1 2 . 1 1 20 20 CYS C C 20 174.152 174.152 175.043 -0.891 19205
269 1 2 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.402 -6.421 19205
270 1 2 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.428 10.546 19205
271 1 2 . 1 1 20 20 CYS H H 20 7.947 7.947 7.590 0.357 19205
272 1 2 . 1 1 21 21 LEU N N 21 121.658 121.658 121.607 0.051 19205
273 1 2 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.347 -0.180 19205
274 1 2 . 1 1 21 21 LEU C C 21 176.589 176.589 177.415 -0.826 19205
275 1 2 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.495 0.391 19205
276 1 2 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.732 0.191 19205
277 1 2 . 1 1 21 21 LEU H H 21 8.522 8.522 8.401 0.121 19205
278 1 2 . 1 1 22 22 ALA N N 22 121.907 121.907 122.838 -0.931 19205
279 1 2 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.203 -0.131 19205
280 1 2 . 1 1 22 22 ALA C C 22 178.382 178.382 178.550 -0.168 19205
281 1 2 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.368 0.597 19205
282 1 2 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.458 -0.514 19205
283 1 2 . 1 1 22 22 ALA H H 22 8.104 8.104 8.414 -0.310 19205
284 1 2 . 1 1 23 23 GLY N N 23 110.790 110.790 111.726 -0.936 19205
285 1 2 . 1 1 23 23 GLY C C 23 174.553 174.553 174.332 0.221 19205
286 1 2 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.854 -0.233 19205
287 1 2 . 1 1 23 23 GLY H H 23 8.644 8.644 8.727 -0.083 19205
288 1 2 . 1 1 24 24 CYS N N 24 119.431 119.431 118.117 1.314 19205
289 1 2 . 1 1 24 24 CYS HA H 24 4.850 4.850 5.168 -0.318 19205
290 1 2 . 1 1 24 24 CYS C C 24 172.768 172.768 173.862 -1.094 19205
291 1 2 . 1 1 24 24 CYS CA C 24 54.902 54.902 57.948 -3.046 19205
292 1 2 . 1 1 24 24 CYS CB C 24 46.168 46.168 30.428 15.740 19205
293 1 2 . 1 1 24 24 CYS H H 24 8.491 8.491 7.597 0.894 19205
294 1 2 . 1 1 25 25 VAL N N 25 115.469 115.469 116.191 -0.722 19205
295 1 2 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.668 -0.301 19205
296 1 2 . 1 1 25 25 VAL C C 25 175.161 175.161 173.657 1.504 19205
297 1 2 . 1 1 25 25 VAL CA C 25 59.327 59.327 58.919 0.408 19205
298 1 2 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.224 0.811 19205
299 1 2 . 1 1 25 25 VAL H H 25 9.324 9.324 9.141 0.183 19205
300 1 2 . 1 1 26 26 CYS N N 26 123.350 123.350 120.471 2.879 19205
301 1 2 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.755 0.055 19205
302 1 2 . 1 1 26 26 CYS C C 26 174.891 174.891 175.822 -0.931 19205
303 1 2 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.785 -3.586 19205
304 1 2 . 1 1 26 26 CYS CB C 26 38.260 38.260 26.093 12.167 19205
305 1 2 . 1 1 26 26 CYS H H 26 9.346 9.346 8.879 0.467 19205
306 1 2 . 1 1 27 27 GLY N N 27 117.742 117.742 116.336 1.406 19205
307 1 2 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.087 1.371 19205
308 1 2 . 1 1 27 27 GLY H H 27 8.259 8.259 8.980 -0.721 19205
309 1 2 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.448 -0.078 19205
310 1 2 . 1 1 28 28 PRO C C 28 176.720 176.720 176.805 -0.085 19205
311 1 2 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.428 0.058 19205
312 1 2 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.676 -0.123 19205
313 1 2 . 1 1 29 29 ASN N N 29 114.300 114.300 116.435 -2.135 19205
314 1 2 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.673 -0.024 19205
315 1 2 . 1 1 29 29 ASN C C 29 175.490 175.490 176.446 -0.956 19205
316 1 2 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.933 -0.598 19205
317 1 2 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.574 -0.008 19205
318 1 2 . 1 1 29 29 ASN H H 29 8.061 8.061 8.235 -0.174 19205
319 1 2 . 1 1 30 30 GLY N N 30 107.086 107.086 107.107 -0.021 19205
320 1 2 . 1 1 30 30 GLY C C 30 173.758 173.758 172.947 0.811 19205
321 1 2 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.204 1.108 19205
322 1 2 . 1 1 30 30 GLY H H 30 8.294 8.294 7.926 0.368 19205
323 1 2 . 1 1 31 31 PHE N N 31 115.129 115.129 118.581 -3.452 19205
324 1 2 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.318 0.032 19205
325 1 2 . 1 1 31 31 PHE C C 31 176.773 176.773 175.306 1.467 19205
326 1 2 . 1 1 31 31 PHE CA C 31 56.410 56.410 55.954 0.456 19205
327 1 2 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.525 -0.051 19205
328 1 2 . 1 1 31 31 PHE H H 31 7.167 7.167 8.256 -1.089 19205
329 1 2 . 1 1 32 32 CYS N N 32 123.123 123.123 120.616 2.507 19205
330 1 2 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.171 -0.072 19205
331 1 2 . 1 1 32 32 CYS C C 32 175.875 175.875 175.875 0.000 19205
332 1 2 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.375 -3.945 19205
333 1 2 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.593 15.494 19205
334 1 2 . 1 1 32 32 CYS H H 32 8.708 8.708 8.924 -0.216 19205
335 1 3 . 1 1 2 2 CYS N N 2 120.511 120.511 118.203 2.308 19205
336 1 3 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.881 -0.008 19205
337 1 3 . 1 1 2 2 CYS CA C 2 53.145 53.145 55.122 -1.977 19205
338 1 3 . 1 1 2 2 CYS CB C 2 41.921 41.921 26.997 14.925 19205
339 1 3 . 1 1 2 2 CYS H H 2 8.866 8.866 8.639 0.227 19205
340 1 3 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.192 0.106 19205
341 1 3 . 1 1 3 3 PRO C C 3 176.294 176.294 175.500 0.794 19205
342 1 3 . 1 1 3 3 PRO CA C 3 63.774 63.774 62.986 0.787 19205
343 1 3 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.104 1.787 19205
344 1 3 . 1 1 4 4 GLN N N 4 118.141 118.141 117.369 0.772 19205
345 1 3 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.654 -0.760 19205
346 1 3 . 1 1 4 4 GLN C C 4 176.143 176.143 175.676 0.467 19205
347 1 3 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.593 0.580 19205
348 1 3 . 1 1 4 4 GLN CB C 4 29.568 29.568 31.070 -1.502 19205
349 1 3 . 1 1 4 4 GLN H H 4 7.648 7.648 8.240 -0.592 19205
350 1 3 . 1 1 5 5 GLY N N 5 108.656 108.656 107.116 1.540 19205
351 1 3 . 1 1 5 5 GLY C C 5 173.733 173.733 173.756 -0.023 19205
352 1 3 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.607 -0.350 19205
353 1 3 . 1 1 5 5 GLY H H 5 7.759 7.759 7.648 0.111 19205
354 1 3 . 1 1 6 6 ARG N N 6 119.446 119.446 120.404 -0.958 19205
355 1 3 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.842 -0.453 19205
356 1 3 . 1 1 6 6 ARG C C 6 176.780 176.780 177.876 -1.096 19205
357 1 3 . 1 1 6 6 ARG CA C 6 55.538 55.538 53.583 1.955 19205
358 1 3 . 1 1 6 6 ARG CB C 6 31.543 31.543 31.727 -0.184 19205
359 1 3 . 1 1 6 6 ARG H H 6 7.865 7.865 7.948 -0.083 19205
360 1 3 . 1 1 7 7 GLY N N 7 109.318 109.318 110.558 -1.240 19205
361 1 3 . 1 1 7 7 GLY C C 7 174.275 174.275 174.499 -0.224 19205
362 1 3 . 1 1 7 7 GLY CA C 7 46.020 46.020 46.974 -0.954 19205
363 1 3 . 1 1 7 7 GLY H H 7 8.529 8.529 8.633 -0.104 19205
364 1 3 . 1 1 8 8 ASP N N 8 121.036 121.036 119.823 1.213 19205
365 1 3 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.699 -0.144 19205
366 1 3 . 1 1 8 8 ASP C C 8 175.562 175.562 174.994 0.568 19205
367 1 3 . 1 1 8 8 ASP CA C 8 53.748 53.748 54.109 -0.361 19205
368 1 3 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.526 -0.467 19205
369 1 3 . 1 1 8 8 ASP H H 8 8.414 8.414 8.724 -0.310 19205
370 1 3 . 1 1 9 9 TRP N N 9 121.704 121.704 122.746 -1.042 19205
371 1 3 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.786 -0.293 19205
372 1 3 . 1 1 9 9 TRP C C 9 175.498 175.498 174.649 0.849 19205
373 1 3 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.921 1.173 19205
374 1 3 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.675 0.134 19205
375 1 3 . 1 1 9 9 TRP H H 9 7.814 7.814 7.700 0.114 19205
376 1 3 . 1 1 10 10 ALA N N 10 128.588 128.588 127.872 0.716 19205
377 1 3 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.405 0.008 19205
378 1 3 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.709 -0.439 19205
379 1 3 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.576 -0.461 19205
380 1 3 . 1 1 10 10 ALA H H 10 8.163 8.163 8.303 -0.140 19205
381 1 3 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.935 -0.604 19205
382 1 3 . 1 1 11 11 PRO C C 11 176.753 176.753 176.660 0.093 19205
383 1 3 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.100 0.896 19205
384 1 3 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.527 -0.082 19205
385 1 3 . 1 1 12 12 THR N N 12 119.798 119.798 117.869 1.929 19205
386 1 3 . 1 1 12 12 THR HA H 12 4.512 4.512 4.757 -0.245 19205
387 1 3 . 1 1 12 12 THR C C 12 173.572 173.572 174.435 -0.863 19205
388 1 3 . 1 1 12 12 THR CA C 12 62.099 62.099 62.077 0.022 19205
389 1 3 . 1 1 12 12 THR CB C 12 71.060 71.060 70.059 1.000 19205
390 1 3 . 1 1 12 12 THR H H 12 9.006 9.006 8.877 0.129 19205
391 1 3 . 1 1 13 13 SER N N 13 123.494 123.494 122.224 1.270 19205
392 1 3 . 1 1 13 13 SER HA H 13 4.539 4.539 4.415 0.124 19205
393 1 3 . 1 1 13 13 SER C C 13 172.953 172.953 174.778 -1.825 19205
394 1 3 . 1 1 13 13 SER CA C 13 58.421 58.421 58.325 0.096 19205
395 1 3 . 1 1 13 13 SER CB C 13 63.844 63.844 63.553 0.291 19205
396 1 3 . 1 1 13 13 SER H H 13 8.805 8.805 8.669 0.136 19205
397 1 3 . 1 1 14 14 CYS N N 14 116.548 116.548 119.743 -3.195 19205
398 1 3 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.865 0.075 19205
399 1 3 . 1 1 14 14 CYS C C 14 172.746 172.746 173.595 -0.849 19205
400 1 3 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.889 -3.083 19205
401 1 3 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.091 16.514 19205
402 1 3 . 1 1 14 14 CYS H H 14 8.265 8.265 8.039 0.226 19205
403 1 3 . 1 1 15 15 SER N N 15 113.958 113.958 114.297 -0.339 19205
404 1 3 . 1 1 15 15 SER HA H 15 4.531 4.531 4.659 -0.128 19205
405 1 3 . 1 1 15 15 SER C C 15 173.205 173.205 173.821 -0.616 19205
406 1 3 . 1 1 15 15 SER CA C 15 58.826 58.826 58.656 0.170 19205
407 1 3 . 1 1 15 15 SER CB C 15 65.097 65.097 64.980 0.117 19205
408 1 3 . 1 1 15 15 SER H H 15 9.497 9.497 9.070 0.427 19205
409 1 3 . 1 1 16 16 GLN N N 16 118.516 118.516 118.464 0.052 19205
410 1 3 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.546 0.198 19205
411 1 3 . 1 1 16 16 GLN C C 16 176.335 176.335 174.799 1.536 19205
412 1 3 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.677 -0.736 19205
413 1 3 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.358 -0.035 19205
414 1 3 . 1 1 16 16 GLN H H 16 8.049 8.049 7.608 0.441 19205
415 1 3 . 1 1 17 17 ASP N N 17 124.190 124.190 122.300 1.890 19205
416 1 3 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.423 -0.314 19205
417 1 3 . 1 1 17 17 ASP C C 17 178.349 178.349 177.809 0.540 19205
418 1 3 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.180 1.767 19205
419 1 3 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.408 -0.885 19205
420 1 3 . 1 1 17 17 ASP H H 17 9.208 9.208 8.793 0.415 19205
421 1 3 . 1 1 18 18 SER N N 18 112.259 112.259 111.604 0.655 19205
422 1 3 . 1 1 18 18 SER HA H 18 4.228 4.228 4.238 -0.010 19205
423 1 3 . 1 1 18 18 SER C C 18 175.037 175.037 174.838 0.199 19205
424 1 3 . 1 1 18 18 SER CA C 18 60.093 60.093 59.832 0.261 19205
425 1 3 . 1 1 18 18 SER CB C 18 62.134 62.134 62.831 -0.697 19205
426 1 3 . 1 1 18 18 SER H H 18 8.371 8.371 8.129 0.242 19205
427 1 3 . 1 1 19 19 ASP N N 19 120.750 120.750 120.827 -0.077 19205
428 1 3 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.736 -0.145 19205
429 1 3 . 1 1 19 19 ASP C C 19 175.958 175.958 176.250 -0.292 19205
430 1 3 . 1 1 19 19 ASP CA C 19 55.885 55.885 54.694 1.192 19205
431 1 3 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.199 0.823 19205
432 1 3 . 1 1 19 19 ASP H H 19 7.697 7.697 7.833 -0.136 19205
433 1 3 . 1 1 20 20 CYS N N 20 118.125 118.125 116.669 1.456 19205
434 1 3 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.722 0.255 19205
435 1 3 . 1 1 20 20 CYS C C 20 174.152 174.152 174.685 -0.533 19205
436 1 3 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.262 -6.281 19205
437 1 3 . 1 1 20 20 CYS CB C 20 39.974 39.974 30.035 9.940 19205
438 1 3 . 1 1 20 20 CYS H H 20 7.947 7.947 7.703 0.244 19205
439 1 3 . 1 1 21 21 LEU N N 21 121.658 121.658 121.198 0.460 19205
440 1 3 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.363 -0.196 19205
441 1 3 . 1 1 21 21 LEU C C 21 176.589 176.589 177.574 -0.985 19205
442 1 3 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.462 0.424 19205
443 1 3 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.750 0.173 19205
444 1 3 . 1 1 21 21 LEU H H 21 8.522 8.522 8.503 0.019 19205
445 1 3 . 1 1 22 22 ALA N N 22 121.907 121.907 123.267 -1.360 19205
446 1 3 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.131 -0.059 19205
447 1 3 . 1 1 22 22 ALA C C 22 178.382 178.382 178.508 -0.126 19205
448 1 3 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.657 0.308 19205
449 1 3 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.089 -0.145 19205
450 1 3 . 1 1 22 22 ALA H H 22 8.104 8.104 8.466 -0.362 19205
451 1 3 . 1 1 23 23 GLY N N 23 110.790 110.790 111.601 -0.811 19205
452 1 3 . 1 1 23 23 GLY C C 23 174.553 174.553 174.562 -0.009 19205
453 1 3 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.813 -0.192 19205
454 1 3 . 1 1 23 23 GLY H H 23 8.644 8.644 8.608 0.036 19205
455 1 3 . 1 1 24 24 CYS N N 24 119.431 119.431 119.628 -0.197 19205
456 1 3 . 1 1 24 24 CYS HA H 24 4.850 4.850 5.076 -0.226 19205
457 1 3 . 1 1 24 24 CYS C C 24 172.768 172.768 174.091 -1.323 19205
458 1 3 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.427 -3.525 19205
459 1 3 . 1 1 24 24 CYS CB C 24 46.168 46.168 30.275 15.893 19205
460 1 3 . 1 1 24 24 CYS H H 24 8.491 8.491 7.750 0.741 19205
461 1 3 . 1 1 25 25 VAL N N 25 115.469 115.469 115.509 -0.040 19205
462 1 3 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.579 -0.212 19205
463 1 3 . 1 1 25 25 VAL C C 25 175.161 175.161 173.919 1.242 19205
464 1 3 . 1 1 25 25 VAL CA C 25 59.327 59.327 58.665 0.662 19205
465 1 3 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.462 0.573 19205
466 1 3 . 1 1 25 25 VAL H H 25 9.324 9.324 8.827 0.497 19205
467 1 3 . 1 1 26 26 CYS N N 26 123.350 123.350 120.658 2.692 19205
468 1 3 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.806 0.004 19205
469 1 3 . 1 1 26 26 CYS C C 26 174.891 174.891 175.805 -0.914 19205
470 1 3 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.459 -3.260 19205
471 1 3 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.958 12.302 19205
472 1 3 . 1 1 26 26 CYS H H 26 9.346 9.346 8.871 0.475 19205
473 1 3 . 1 1 27 27 GLY N N 27 117.742 117.742 116.615 1.127 19205
474 1 3 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.034 1.424 19205
475 1 3 . 1 1 27 27 GLY H H 27 8.259 8.259 8.946 -0.687 19205
476 1 3 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.435 -0.065 19205
477 1 3 . 1 1 28 28 PRO C C 28 176.720 176.720 176.798 -0.078 19205
478 1 3 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.378 0.108 19205
479 1 3 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.645 -0.092 19205
480 1 3 . 1 1 29 29 ASN N N 29 114.300 114.300 116.560 -2.260 19205
481 1 3 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.681 -0.032 19205
482 1 3 . 1 1 29 29 ASN C C 29 175.490 175.490 176.461 -0.971 19205
483 1 3 . 1 1 29 29 ASN CA C 29 52.335 52.335 53.009 -0.674 19205
484 1 3 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.657 -0.091 19205
485 1 3 . 1 1 29 29 ASN H H 29 8.061 8.061 8.231 -0.170 19205
486 1 3 . 1 1 30 30 GLY N N 30 107.086 107.086 107.333 -0.247 19205
487 1 3 . 1 1 30 30 GLY C C 30 173.758 173.758 172.907 0.851 19205
488 1 3 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.086 1.226 19205
489 1 3 . 1 1 30 30 GLY H H 30 8.294 8.294 7.970 0.324 19205
490 1 3 . 1 1 31 31 PHE N N 31 115.129 115.129 118.144 -3.015 19205
491 1 3 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.275 0.075 19205
492 1 3 . 1 1 31 31 PHE C C 31 176.773 176.773 175.124 1.649 19205
493 1 3 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.275 0.135 19205
494 1 3 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.800 -0.326 19205
495 1 3 . 1 1 31 31 PHE H H 31 7.167 7.167 8.206 -1.039 19205
496 1 3 . 1 1 32 32 CYS N N 32 123.123 123.123 120.765 2.358 19205
497 1 3 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.136 -0.037 19205
498 1 3 . 1 1 32 32 CYS C C 32 175.875 175.875 176.023 -0.148 19205
499 1 3 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.450 -4.020 19205
500 1 3 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.435 15.652 19205
501 1 3 . 1 1 32 32 CYS H H 32 8.708 8.708 8.829 -0.121 19205
502 1 4 . 1 1 2 2 CYS N N 2 120.511 120.511 118.462 2.049 19205
503 1 4 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.882 -0.009 19205
504 1 4 . 1 1 2 2 CYS CA C 2 53.145 53.145 55.141 -1.996 19205
505 1 4 . 1 1 2 2 CYS CB C 2 41.921 41.921 27.152 14.769 19205
506 1 4 . 1 1 2 2 CYS H H 2 8.866 8.866 8.729 0.137 19205
507 1 4 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.263 0.035 19205
508 1 4 . 1 1 3 3 PRO C C 3 176.294 176.294 175.751 0.543 19205
509 1 4 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.283 0.491 19205
510 1 4 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.043 1.848 19205
511 1 4 . 1 1 4 4 GLN N N 4 118.141 118.141 118.524 -0.383 19205
512 1 4 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.684 -0.790 19205
513 1 4 . 1 1 4 4 GLN C C 4 176.143 176.143 174.857 1.286 19205
514 1 4 . 1 1 4 4 GLN CA C 4 56.173 56.173 54.758 1.415 19205
515 1 4 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.154 -0.586 19205
516 1 4 . 1 1 4 4 GLN H H 4 7.648 7.648 8.140 -0.492 19205
517 1 4 . 1 1 5 5 GLY N N 5 108.656 108.656 106.656 2.000 19205
518 1 4 . 1 1 5 5 GLY C C 5 173.733 173.733 173.398 0.335 19205
519 1 4 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.459 -0.202 19205
520 1 4 . 1 1 5 5 GLY H H 5 7.759 7.759 7.837 -0.078 19205
521 1 4 . 1 1 6 6 ARG N N 6 119.446 119.446 120.900 -1.454 19205
522 1 4 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.872 -0.483 19205
523 1 4 . 1 1 6 6 ARG C C 6 176.780 176.780 177.687 -0.907 19205
524 1 4 . 1 1 6 6 ARG CA C 6 55.538 55.538 54.176 1.362 19205
525 1 4 . 1 1 6 6 ARG CB C 6 31.543 31.543 31.936 -0.393 19205
526 1 4 . 1 1 6 6 ARG H H 6 7.865 7.865 8.312 -0.447 19205
527 1 4 . 1 1 7 7 GLY N N 7 109.318 109.318 110.699 -1.381 19205
528 1 4 . 1 1 7 7 GLY C C 7 174.275 174.275 174.526 -0.251 19205
529 1 4 . 1 1 7 7 GLY CA C 7 46.020 46.020 46.887 -0.867 19205
530 1 4 . 1 1 7 7 GLY H H 7 8.529 8.529 8.567 -0.038 19205
531 1 4 . 1 1 8 8 ASP N N 8 121.036 121.036 119.761 1.275 19205
532 1 4 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.741 -0.186 19205
533 1 4 . 1 1 8 8 ASP C C 8 175.562 175.562 175.030 0.532 19205
534 1 4 . 1 1 8 8 ASP CA C 8 53.748 53.748 53.956 -0.208 19205
535 1 4 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.529 -0.470 19205
536 1 4 . 1 1 8 8 ASP H H 8 8.414 8.414 8.823 -0.409 19205
537 1 4 . 1 1 9 9 TRP N N 9 121.704 121.704 122.297 -0.593 19205
538 1 4 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.815 -0.322 19205
539 1 4 . 1 1 9 9 TRP C C 9 175.498 175.498 174.913 0.585 19205
540 1 4 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.969 1.125 19205
541 1 4 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.985 -0.176 19205
542 1 4 . 1 1 9 9 TRP H H 9 7.814 7.814 7.397 0.417 19205
543 1 4 . 1 1 10 10 ALA N N 10 128.588 128.588 128.608 -0.020 19205
544 1 4 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.477 -0.064 19205
545 1 4 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.604 -0.334 19205
546 1 4 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.598 -0.483 19205
547 1 4 . 1 1 10 10 ALA H H 10 8.163 8.163 8.401 -0.238 19205
548 1 4 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.946 -0.615 19205
549 1 4 . 1 1 11 11 PRO C C 11 176.753 176.753 176.730 0.023 19205
550 1 4 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.193 0.803 19205
551 1 4 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.401 0.044 19205
552 1 4 . 1 1 12 12 THR N N 12 119.798 119.798 117.339 2.459 19205
553 1 4 . 1 1 12 12 THR HA H 12 4.512 4.512 4.756 -0.244 19205
554 1 4 . 1 1 12 12 THR C C 12 173.572 173.572 174.524 -0.952 19205
555 1 4 . 1 1 12 12 THR CA C 12 62.099 62.099 61.798 0.301 19205
556 1 4 . 1 1 12 12 THR CB C 12 71.060 71.060 70.201 0.859 19205
557 1 4 . 1 1 12 12 THR H H 12 9.006 9.006 8.366 0.640 19205
558 1 4 . 1 1 13 13 SER N N 13 123.494 123.494 121.594 1.900 19205
559 1 4 . 1 1 13 13 SER HA H 13 4.539 4.539 4.534 0.005 19205
560 1 4 . 1 1 13 13 SER C C 13 172.953 172.953 174.341 -1.388 19205
561 1 4 . 1 1 13 13 SER CA C 13 58.421 58.421 58.060 0.361 19205
562 1 4 . 1 1 13 13 SER CB C 13 63.844 63.844 63.172 0.672 19205
563 1 4 . 1 1 13 13 SER H H 13 8.805 8.805 8.643 0.162 19205
564 1 4 . 1 1 14 14 CYS N N 14 116.548 116.548 119.611 -3.063 19205
565 1 4 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.899 0.041 19205
566 1 4 . 1 1 14 14 CYS C C 14 172.746 172.746 173.465 -0.719 19205
567 1 4 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.803 -2.997 19205
568 1 4 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.500 16.105 19205
569 1 4 . 1 1 14 14 CYS H H 14 8.265 8.265 8.403 -0.138 19205
570 1 4 . 1 1 15 15 SER N N 15 113.958 113.958 113.993 -0.035 19205
571 1 4 . 1 1 15 15 SER HA H 15 4.531 4.531 4.671 -0.140 19205
572 1 4 . 1 1 15 15 SER C C 15 173.205 173.205 173.679 -0.474 19205
573 1 4 . 1 1 15 15 SER CA C 15 58.826 58.826 58.606 0.220 19205
574 1 4 . 1 1 15 15 SER CB C 15 65.097 65.097 65.164 -0.067 19205
575 1 4 . 1 1 15 15 SER H H 15 9.497 9.497 9.193 0.304 19205
576 1 4 . 1 1 16 16 GLN N N 16 118.516 118.516 118.804 -0.288 19205
577 1 4 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.694 0.050 19205
578 1 4 . 1 1 16 16 GLN C C 16 176.335 176.335 174.580 1.755 19205
579 1 4 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.628 -0.687 19205
580 1 4 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.105 0.218 19205
581 1 4 . 1 1 16 16 GLN H H 16 8.049 8.049 7.897 0.152 19205
582 1 4 . 1 1 17 17 ASP N N 17 124.190 124.190 121.848 2.342 19205
583 1 4 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.431 -0.323 19205
584 1 4 . 1 1 17 17 ASP C C 17 178.349 178.349 177.991 0.358 19205
585 1 4 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.292 1.655 19205
586 1 4 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.400 -0.877 19205
587 1 4 . 1 1 17 17 ASP H H 17 9.208 9.208 8.839 0.369 19205
588 1 4 . 1 1 18 18 SER N N 18 112.259 112.259 113.057 -0.798 19205
589 1 4 . 1 1 18 18 SER HA H 18 4.228 4.228 4.231 -0.003 19205
590 1 4 . 1 1 18 18 SER C C 18 175.037 175.037 175.426 -0.389 19205
591 1 4 . 1 1 18 18 SER CA C 18 60.093 60.093 60.335 -0.242 19205
592 1 4 . 1 1 18 18 SER CB C 18 62.134 62.134 62.866 -0.732 19205
593 1 4 . 1 1 18 18 SER H H 18 8.371 8.371 8.406 -0.035 19205
594 1 4 . 1 1 19 19 ASP N N 19 120.750 120.750 120.635 0.115 19205
595 1 4 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.595 -0.004 19205
596 1 4 . 1 1 19 19 ASP C C 19 175.958 175.958 176.646 -0.688 19205
597 1 4 . 1 1 19 19 ASP CA C 19 55.885 55.885 55.321 0.564 19205
598 1 4 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.018 1.004 19205
599 1 4 . 1 1 19 19 ASP H H 19 7.697 7.697 7.700 -0.003 19205
600 1 4 . 1 1 20 20 CYS N N 20 118.125 118.125 116.973 1.152 19205
601 1 4 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.526 0.451 19205
602 1 4 . 1 1 20 20 CYS C C 20 174.152 174.152 174.886 -0.734 19205
603 1 4 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.643 -6.662 19205
604 1 4 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.075 10.899 19205
605 1 4 . 1 1 20 20 CYS H H 20 7.947 7.947 7.732 0.215 19205
606 1 4 . 1 1 21 21 LEU N N 21 121.658 121.658 120.807 0.851 19205
607 1 4 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.409 -0.242 19205
608 1 4 . 1 1 21 21 LEU C C 21 176.589 176.589 177.287 -0.698 19205
609 1 4 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.309 0.577 19205
610 1 4 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.813 0.110 19205
611 1 4 . 1 1 21 21 LEU H H 21 8.522 8.522 8.482 0.040 19205
612 1 4 . 1 1 22 22 ALA N N 22 121.907 121.907 122.828 -0.921 19205
613 1 4 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.184 -0.112 19205
614 1 4 . 1 1 22 22 ALA C C 22 178.382 178.382 178.467 -0.085 19205
615 1 4 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.500 0.465 19205
616 1 4 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.308 -0.364 19205
617 1 4 . 1 1 22 22 ALA H H 22 8.104 8.104 8.448 -0.344 19205
618 1 4 . 1 1 23 23 GLY N N 23 110.790 110.790 112.145 -1.355 19205
619 1 4 . 1 1 23 23 GLY C C 23 174.553 174.553 174.545 0.008 19205
620 1 4 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.636 -0.015 19205
621 1 4 . 1 1 23 23 GLY H H 23 8.644 8.644 8.782 -0.138 19205
622 1 4 . 1 1 24 24 CYS N N 24 119.431 119.431 119.108 0.323 19205
623 1 4 . 1 1 24 24 CYS HA H 24 4.850 4.850 5.305 -0.455 19205
624 1 4 . 1 1 24 24 CYS C C 24 172.768 172.768 174.001 -1.233 19205
625 1 4 . 1 1 24 24 CYS CA C 24 54.902 54.902 57.847 -2.945 19205
626 1 4 . 1 1 24 24 CYS CB C 24 46.168 46.168 29.852 16.316 19205
627 1 4 . 1 1 24 24 CYS H H 24 8.491 8.491 7.670 0.821 19205
628 1 4 . 1 1 25 25 VAL N N 25 115.469 115.469 115.631 -0.162 19205
629 1 4 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.614 -0.247 19205
630 1 4 . 1 1 25 25 VAL C C 25 175.161 175.161 173.884 1.277 19205
631 1 4 . 1 1 25 25 VAL CA C 25 59.327 59.327 59.290 0.037 19205
632 1 4 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.777 0.258 19205
633 1 4 . 1 1 25 25 VAL H H 25 9.324 9.324 8.915 0.409 19205
634 1 4 . 1 1 26 26 CYS N N 26 123.350 123.350 121.476 1.874 19205
635 1 4 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.769 0.041 19205
636 1 4 . 1 1 26 26 CYS C C 26 174.891 174.891 176.229 -1.338 19205
637 1 4 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.687 -3.488 19205
638 1 4 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.448 12.812 19205
639 1 4 . 1 1 26 26 CYS H H 26 9.346 9.346 8.886 0.460 19205
640 1 4 . 1 1 27 27 GLY N N 27 117.742 117.742 116.823 0.919 19205
641 1 4 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.130 1.328 19205
642 1 4 . 1 1 27 27 GLY H H 27 8.259 8.259 8.908 -0.649 19205
643 1 4 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.422 -0.052 19205
644 1 4 . 1 1 28 28 PRO C C 28 176.720 176.720 176.914 -0.194 19205
645 1 4 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.374 0.112 19205
646 1 4 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.665 -0.112 19205
647 1 4 . 1 1 29 29 ASN N N 29 114.300 114.300 116.555 -2.255 19205
648 1 4 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.665 -0.016 19205
649 1 4 . 1 1 29 29 ASN C C 29 175.490 175.490 176.443 -0.953 19205
650 1 4 . 1 1 29 29 ASN CA C 29 52.335 52.335 53.145 -0.811 19205
651 1 4 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.683 -0.117 19205
652 1 4 . 1 1 29 29 ASN H H 29 8.061 8.061 8.280 -0.219 19205
653 1 4 . 1 1 30 30 GLY N N 30 107.086 107.086 106.878 0.208 19205
654 1 4 . 1 1 30 30 GLY C C 30 173.758 173.758 172.810 0.948 19205
655 1 4 . 1 1 30 30 GLY CA C 30 46.312 46.312 44.896 1.416 19205
656 1 4 . 1 1 30 30 GLY H H 30 8.294 8.294 7.906 0.388 19205
657 1 4 . 1 1 31 31 PHE N N 31 115.129 115.129 118.363 -3.234 19205
658 1 4 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.330 0.020 19205
659 1 4 . 1 1 31 31 PHE C C 31 176.773 176.773 175.419 1.354 19205
660 1 4 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.166 0.244 19205
661 1 4 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.663 -0.189 19205
662 1 4 . 1 1 31 31 PHE H H 31 7.167 7.167 8.444 -1.277 19205
663 1 4 . 1 1 32 32 CYS N N 32 123.123 123.123 120.778 2.345 19205
664 1 4 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.074 0.025 19205
665 1 4 . 1 1 32 32 CYS C C 32 175.875 175.875 175.925 -0.050 19205
666 1 4 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.489 -4.059 19205
667 1 4 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.186 15.901 19205
668 1 4 . 1 1 32 32 CYS H H 32 8.708 8.708 8.862 -0.154 19205
669 1 5 . 1 1 2 2 CYS N N 2 120.511 120.511 116.974 3.537 19205
670 1 5 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.996 -0.123 19205
671 1 5 . 1 1 2 2 CYS CA C 2 53.145 53.145 56.963 -3.818 19205
672 1 5 . 1 1 2 2 CYS CB C 2 41.921 41.921 28.810 13.111 19205
673 1 5 . 1 1 2 2 CYS H H 2 8.866 8.866 8.171 0.695 19205
674 1 5 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.154 0.144 19205
675 1 5 . 1 1 3 3 PRO C C 3 176.294 176.294 175.752 0.542 19205
676 1 5 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.525 0.249 19205
677 1 5 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.329 1.562 19205
678 1 5 . 1 1 4 4 GLN N N 4 118.141 118.141 115.857 2.284 19205
679 1 5 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.642 -0.748 19205
680 1 5 . 1 1 4 4 GLN C C 4 176.143 176.143 175.750 0.393 19205
681 1 5 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.577 0.596 19205
682 1 5 . 1 1 4 4 GLN CB C 4 29.568 29.568 31.317 -1.749 19205
683 1 5 . 1 1 4 4 GLN H H 4 7.648 7.648 8.134 -0.486 19205
684 1 5 . 1 1 5 5 GLY N N 5 108.656 108.656 108.388 0.268 19205
685 1 5 . 1 1 5 5 GLY C C 5 173.733 173.733 173.936 -0.203 19205
686 1 5 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.421 -0.164 19205
687 1 5 . 1 1 5 5 GLY H H 5 7.759 7.759 7.756 0.003 19205
688 1 5 . 1 1 6 6 ARG N N 6 119.446 119.446 120.353 -0.907 19205
689 1 5 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.747 -0.358 19205
690 1 5 . 1 1 6 6 ARG C C 6 176.780 176.780 178.163 -1.383 19205
691 1 5 . 1 1 6 6 ARG CA C 6 55.538 55.538 53.732 1.806 19205
692 1 5 . 1 1 6 6 ARG CB C 6 31.543 31.543 31.500 0.043 19205
693 1 5 . 1 1 6 6 ARG H H 6 7.865 7.865 7.837 0.028 19205
694 1 5 . 1 1 7 7 GLY N N 7 109.318 109.318 110.385 -1.067 19205
695 1 5 . 1 1 7 7 GLY C C 7 174.275 174.275 174.482 -0.207 19205
696 1 5 . 1 1 7 7 GLY CA C 7 46.020 46.020 47.020 -1.000 19205
697 1 5 . 1 1 7 7 GLY H H 7 8.529 8.529 8.626 -0.097 19205
698 1 5 . 1 1 8 8 ASP N N 8 121.036 121.036 119.328 1.708 19205
699 1 5 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.733 -0.178 19205
700 1 5 . 1 1 8 8 ASP C C 8 175.562 175.562 175.053 0.509 19205
701 1 5 . 1 1 8 8 ASP CA C 8 53.748 53.748 53.979 -0.231 19205
702 1 5 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.662 -0.603 19205
703 1 5 . 1 1 8 8 ASP H H 8 8.414 8.414 8.753 -0.339 19205
704 1 5 . 1 1 9 9 TRP N N 9 121.704 121.704 123.170 -1.466 19205
705 1 5 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.782 -0.289 19205
706 1 5 . 1 1 9 9 TRP C C 9 175.498 175.498 174.715 0.783 19205
707 1 5 . 1 1 9 9 TRP CA C 9 57.094 57.094 56.019 1.075 19205
708 1 5 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.089 0.720 19205
709 1 5 . 1 1 9 9 TRP H H 9 7.814 7.814 7.652 0.162 19205
710 1 5 . 1 1 10 10 ALA N N 10 128.588 128.588 128.194 0.394 19205
711 1 5 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.427 -0.014 19205
712 1 5 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.711 -0.441 19205
713 1 5 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.636 -0.521 19205
714 1 5 . 1 1 10 10 ALA H H 10 8.163 8.163 8.068 0.095 19205
715 1 5 . 1 1 11 11 PRO HA H 11 4.331 4.331 5.104 -0.773 19205
716 1 5 . 1 1 11 11 PRO C C 11 176.753 176.753 176.657 0.096 19205
717 1 5 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.104 0.892 19205
718 1 5 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.617 -0.172 19205
719 1 5 . 1 1 12 12 THR N N 12 119.798 119.798 117.384 2.414 19205
720 1 5 . 1 1 12 12 THR HA H 12 4.512 4.512 4.786 -0.274 19205
721 1 5 . 1 1 12 12 THR C C 12 173.572 173.572 174.300 -0.728 19205
722 1 5 . 1 1 12 12 THR CA C 12 62.099 62.099 61.688 0.411 19205
723 1 5 . 1 1 12 12 THR CB C 12 71.060 71.060 70.630 0.430 19205
724 1 5 . 1 1 12 12 THR H H 12 9.006 9.006 8.414 0.592 19205
725 1 5 . 1 1 13 13 SER N N 13 123.494 123.494 121.941 1.553 19205
726 1 5 . 1 1 13 13 SER HA H 13 4.539 4.539 4.338 0.201 19205
727 1 5 . 1 1 13 13 SER C C 13 172.953 172.953 174.383 -1.430 19205
728 1 5 . 1 1 13 13 SER CA C 13 58.421 58.421 58.246 0.175 19205
729 1 5 . 1 1 13 13 SER CB C 13 63.844 63.844 62.904 0.940 19205
730 1 5 . 1 1 13 13 SER H H 13 8.805 8.805 8.624 0.181 19205
731 1 5 . 1 1 14 14 CYS N N 14 116.548 116.548 120.212 -3.664 19205
732 1 5 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.801 0.139 19205
733 1 5 . 1 1 14 14 CYS C C 14 172.746 172.746 173.644 -0.898 19205
734 1 5 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.743 -2.937 19205
735 1 5 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.810 15.795 19205
736 1 5 . 1 1 14 14 CYS H H 14 8.265 8.265 8.311 -0.046 19205
737 1 5 . 1 1 15 15 SER N N 15 113.958 113.958 114.018 -0.060 19205
738 1 5 . 1 1 15 15 SER HA H 15 4.531 4.531 4.657 -0.126 19205
739 1 5 . 1 1 15 15 SER C C 15 173.205 173.205 173.764 -0.559 19205
740 1 5 . 1 1 15 15 SER CA C 15 58.826 58.826 58.635 0.191 19205
741 1 5 . 1 1 15 15 SER CB C 15 65.097 65.097 65.124 -0.027 19205
742 1 5 . 1 1 15 15 SER H H 15 9.497 9.497 9.252 0.245 19205
743 1 5 . 1 1 16 16 GLN N N 16 118.516 118.516 118.724 -0.208 19205
744 1 5 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.693 0.051 19205
745 1 5 . 1 1 16 16 GLN C C 16 176.335 176.335 174.604 1.731 19205
746 1 5 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.592 -0.651 19205
747 1 5 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.099 0.223 19205
748 1 5 . 1 1 16 16 GLN H H 16 8.049 8.049 8.004 0.045 19205
749 1 5 . 1 1 17 17 ASP N N 17 124.190 124.190 121.598 2.592 19205
750 1 5 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.435 -0.326 19205
751 1 5 . 1 1 17 17 ASP C C 17 178.349 178.349 178.125 0.224 19205
752 1 5 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.002 1.945 19205
753 1 5 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.224 -0.701 19205
754 1 5 . 1 1 17 17 ASP H H 17 9.208 9.208 8.908 0.300 19205
755 1 5 . 1 1 18 18 SER N N 18 112.259 112.259 112.656 -0.397 19205
756 1 5 . 1 1 18 18 SER HA H 18 4.228 4.228 4.278 -0.050 19205
757 1 5 . 1 1 18 18 SER C C 18 175.037 175.037 175.101 -0.064 19205
758 1 5 . 1 1 18 18 SER CA C 18 60.093 60.093 59.918 0.175 19205
759 1 5 . 1 1 18 18 SER CB C 18 62.134 62.134 62.822 -0.688 19205
760 1 5 . 1 1 18 18 SER H H 18 8.371 8.371 8.210 0.161 19205
761 1 5 . 1 1 19 19 ASP N N 19 120.750 120.750 120.817 -0.067 19205
762 1 5 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.642 -0.051 19205
763 1 5 . 1 1 19 19 ASP C C 19 175.958 175.958 176.438 -0.480 19205
764 1 5 . 1 1 19 19 ASP CA C 19 55.885 55.885 55.000 0.885 19205
765 1 5 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.091 0.931 19205
766 1 5 . 1 1 19 19 ASP H H 19 7.697 7.697 7.713 -0.016 19205
767 1 5 . 1 1 20 20 CYS N N 20 118.125 118.125 116.543 1.582 19205
768 1 5 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.679 0.298 19205
769 1 5 . 1 1 20 20 CYS C C 20 174.152 174.152 174.685 -0.533 19205
770 1 5 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.112 -6.131 19205
771 1 5 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.710 10.264 19205
772 1 5 . 1 1 20 20 CYS H H 20 7.947 7.947 7.696 0.251 19205
773 1 5 . 1 1 21 21 LEU N N 21 121.658 121.658 121.156 0.502 19205
774 1 5 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.382 -0.215 19205
775 1 5 . 1 1 21 21 LEU C C 21 176.589 176.589 177.490 -0.901 19205
776 1 5 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.310 0.576 19205
777 1 5 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.789 0.134 19205
778 1 5 . 1 1 21 21 LEU H H 21 8.522 8.522 8.339 0.183 19205
779 1 5 . 1 1 22 22 ALA N N 22 121.907 121.907 122.896 -0.989 19205
780 1 5 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.176 -0.104 19205
781 1 5 . 1 1 22 22 ALA C C 22 178.382 178.382 178.473 -0.091 19205
782 1 5 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.401 0.564 19205
783 1 5 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.177 -0.233 19205
784 1 5 . 1 1 22 22 ALA H H 22 8.104 8.104 8.437 -0.333 19205
785 1 5 . 1 1 23 23 GLY N N 23 110.790 110.790 112.211 -1.421 19205
786 1 5 . 1 1 23 23 GLY C C 23 174.553 174.553 174.421 0.132 19205
787 1 5 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.703 -0.083 19205
788 1 5 . 1 1 23 23 GLY H H 23 8.644 8.644 8.798 -0.154 19205
789 1 5 . 1 1 24 24 CYS N N 24 119.431 119.431 118.310 1.121 19205
790 1 5 . 1 1 24 24 CYS HA H 24 4.850 4.850 4.905 -0.055 19205
791 1 5 . 1 1 24 24 CYS C C 24 172.768 172.768 173.873 -1.105 19205
792 1 5 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.051 -3.149 19205
793 1 5 . 1 1 24 24 CYS CB C 24 46.168 46.168 30.031 16.137 19205
794 1 5 . 1 1 24 24 CYS H H 24 8.491 8.491 7.646 0.845 19205
795 1 5 . 1 1 25 25 VAL N N 25 115.469 115.469 115.675 -0.206 19205
796 1 5 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.645 -0.278 19205
797 1 5 . 1 1 25 25 VAL C C 25 175.161 175.161 173.811 1.350 19205
798 1 5 . 1 1 25 25 VAL CA C 25 59.327 59.327 59.271 0.056 19205
799 1 5 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.824 0.211 19205
800 1 5 . 1 1 25 25 VAL H H 25 9.324 9.324 9.097 0.227 19205
801 1 5 . 1 1 26 26 CYS N N 26 123.350 123.350 121.265 2.085 19205
802 1 5 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.776 0.034 19205
803 1 5 . 1 1 26 26 CYS C C 26 174.891 174.891 176.231 -1.340 19205
804 1 5 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.620 -3.421 19205
805 1 5 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.494 12.767 19205
806 1 5 . 1 1 26 26 CYS H H 26 9.346 9.346 8.825 0.521 19205
807 1 5 . 1 1 27 27 GLY N N 27 117.742 117.742 116.680 1.062 19205
808 1 5 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.237 1.221 19205
809 1 5 . 1 1 27 27 GLY H H 27 8.259 8.259 8.878 -0.619 19205
810 1 5 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.443 -0.073 19205
811 1 5 . 1 1 28 28 PRO C C 28 176.720 176.720 176.778 -0.058 19205
812 1 5 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.351 0.135 19205
813 1 5 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.635 -0.082 19205
814 1 5 . 1 1 29 29 ASN N N 29 114.300 114.300 116.423 -2.123 19205
815 1 5 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.694 -0.045 19205
816 1 5 . 1 1 29 29 ASN C C 29 175.490 175.490 176.461 -0.971 19205
817 1 5 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.938 -0.603 19205
818 1 5 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.726 -0.160 19205
819 1 5 . 1 1 29 29 ASN H H 29 8.061 8.061 8.210 -0.149 19205
820 1 5 . 1 1 30 30 GLY N N 30 107.086 107.086 107.228 -0.142 19205
821 1 5 . 1 1 30 30 GLY C C 30 173.758 173.758 172.870 0.888 19205
822 1 5 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.098 1.214 19205
823 1 5 . 1 1 30 30 GLY H H 30 8.294 8.294 8.004 0.290 19205
824 1 5 . 1 1 31 31 PHE N N 31 115.129 115.129 118.426 -3.297 19205
825 1 5 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.289 0.061 19205
826 1 5 . 1 1 31 31 PHE C C 31 176.773 176.773 175.277 1.496 19205
827 1 5 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.248 0.162 19205
828 1 5 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.663 -0.189 19205
829 1 5 . 1 1 31 31 PHE H H 31 7.167 7.167 8.396 -1.229 19205
830 1 5 . 1 1 32 32 CYS N N 32 123.123 123.123 121.026 2.097 19205
831 1 5 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.273 -0.174 19205
832 1 5 . 1 1 32 32 CYS C C 32 175.875 175.875 175.825 0.050 19205
833 1 5 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.295 -3.865 19205
834 1 5 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.531 15.556 19205
835 1 5 . 1 1 32 32 CYS H H 32 8.708 8.708 8.921 -0.213 19205
836 1 6 . 1 1 2 2 CYS N N 2 120.511 120.511 118.501 2.010 19205
837 1 6 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.831 0.042 19205
838 1 6 . 1 1 2 2 CYS CA C 2 53.145 53.145 55.362 -2.217 19205
839 1 6 . 1 1 2 2 CYS CB C 2 41.921 41.921 26.898 15.023 19205
840 1 6 . 1 1 2 2 CYS H H 2 8.866 8.866 8.607 0.259 19205
841 1 6 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.225 0.073 19205
842 1 6 . 1 1 3 3 PRO C C 3 176.294 176.294 175.536 0.758 19205
843 1 6 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.053 0.721 19205
844 1 6 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.241 1.650 19205
845 1 6 . 1 1 4 4 GLN N N 4 118.141 118.141 117.869 0.272 19205
846 1 6 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.639 -0.745 19205
847 1 6 . 1 1 4 4 GLN C C 4 176.143 176.143 175.527 0.616 19205
848 1 6 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.275 0.898 19205
849 1 6 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.356 -0.788 19205
850 1 6 . 1 1 4 4 GLN H H 4 7.648 7.648 8.252 -0.604 19205
851 1 6 . 1 1 5 5 GLY N N 5 108.656 108.656 106.819 1.837 19205
852 1 6 . 1 1 5 5 GLY C C 5 173.733 173.733 173.251 0.482 19205
853 1 6 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.490 -0.233 19205
854 1 6 . 1 1 5 5 GLY H H 5 7.759 7.759 8.015 -0.256 19205
855 1 6 . 1 1 6 6 ARG N N 6 119.446 119.446 119.896 -0.450 19205
856 1 6 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.839 -0.450 19205
857 1 6 . 1 1 6 6 ARG C C 6 176.780 176.780 177.249 -0.469 19205
858 1 6 . 1 1 6 6 ARG CA C 6 55.538 55.538 54.535 1.003 19205
859 1 6 . 1 1 6 6 ARG CB C 6 31.543 31.543 32.561 -1.018 19205
860 1 6 . 1 1 6 6 ARG H H 6 7.865 7.865 8.551 -0.686 19205
861 1 6 . 1 1 7 7 GLY N N 7 109.318 109.318 110.191 -0.873 19205
862 1 6 . 1 1 7 7 GLY C C 7 174.275 174.275 174.542 -0.267 19205
863 1 6 . 1 1 7 7 GLY CA C 7 46.020 46.020 46.989 -0.969 19205
864 1 6 . 1 1 7 7 GLY H H 7 8.529 8.529 8.655 -0.126 19205
865 1 6 . 1 1 8 8 ASP N N 8 121.036 121.036 118.466 2.570 19205
866 1 6 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.672 -0.117 19205
867 1 6 . 1 1 8 8 ASP C C 8 175.562 175.562 175.096 0.466 19205
868 1 6 . 1 1 8 8 ASP CA C 8 53.748 53.748 54.103 -0.355 19205
869 1 6 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.885 -0.826 19205
870 1 6 . 1 1 8 8 ASP H H 8 8.414 8.414 8.690 -0.276 19205
871 1 6 . 1 1 9 9 TRP N N 9 121.704 121.704 122.755 -1.051 19205
872 1 6 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.795 -0.302 19205
873 1 6 . 1 1 9 9 TRP C C 9 175.498 175.498 174.695 0.803 19205
874 1 6 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.883 1.211 19205
875 1 6 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.015 0.794 19205
876 1 6 . 1 1 9 9 TRP H H 9 7.814 7.814 7.395 0.419 19205
877 1 6 . 1 1 10 10 ALA N N 10 128.588 128.588 127.538 1.050 19205
878 1 6 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.450 -0.037 19205
879 1 6 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.538 -0.267 19205
880 1 6 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.681 -0.566 19205
881 1 6 . 1 1 10 10 ALA H H 10 8.163 8.163 8.113 0.050 19205
882 1 6 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.790 -0.459 19205
883 1 6 . 1 1 11 11 PRO C C 11 176.753 176.753 176.554 0.199 19205
884 1 6 . 1 1 11 11 PRO CA C 11 62.996 62.996 61.981 1.015 19205
885 1 6 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.385 0.060 19205
886 1 6 . 1 1 12 12 THR N N 12 119.798 119.798 115.937 3.861 19205
887 1 6 . 1 1 12 12 THR HA H 12 4.512 4.512 4.778 -0.266 19205
888 1 6 . 1 1 12 12 THR C C 12 173.572 173.572 174.536 -0.964 19205
889 1 6 . 1 1 12 12 THR CA C 12 62.099 62.099 61.476 0.623 19205
890 1 6 . 1 1 12 12 THR CB C 12 71.060 71.060 70.661 0.399 19205
891 1 6 . 1 1 12 12 THR H H 12 9.006 9.006 8.520 0.486 19205
892 1 6 . 1 1 13 13 SER N N 13 123.494 123.494 121.345 2.149 19205
893 1 6 . 1 1 13 13 SER HA H 13 4.539 4.539 4.600 -0.061 19205
894 1 6 . 1 1 13 13 SER C C 13 172.953 172.953 174.349 -1.396 19205
895 1 6 . 1 1 13 13 SER CA C 13 58.421 58.421 58.256 0.165 19205
896 1 6 . 1 1 13 13 SER CB C 13 63.844 63.844 63.261 0.584 19205
897 1 6 . 1 1 13 13 SER H H 13 8.805 8.805 8.657 0.148 19205
898 1 6 . 1 1 14 14 CYS N N 14 116.548 116.548 119.734 -3.186 19205
899 1 6 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.782 0.158 19205
900 1 6 . 1 1 14 14 CYS C C 14 172.746 172.746 173.615 -0.869 19205
901 1 6 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.915 -3.109 19205
902 1 6 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.613 15.992 19205
903 1 6 . 1 1 14 14 CYS H H 14 8.265 8.265 8.615 -0.350 19205
904 1 6 . 1 1 15 15 SER N N 15 113.958 113.958 114.322 -0.364 19205
905 1 6 . 1 1 15 15 SER HA H 15 4.531 4.531 4.666 -0.135 19205
906 1 6 . 1 1 15 15 SER C C 15 173.205 173.205 173.848 -0.643 19205
907 1 6 . 1 1 15 15 SER CA C 15 58.826 58.826 58.782 0.044 19205
908 1 6 . 1 1 15 15 SER CB C 15 65.097 65.097 65.024 0.073 19205
909 1 6 . 1 1 15 15 SER H H 15 9.497 9.497 9.200 0.297 19205
910 1 6 . 1 1 16 16 GLN N N 16 118.516 118.516 119.280 -0.764 19205
911 1 6 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.725 0.019 19205
912 1 6 . 1 1 16 16 GLN C C 16 176.335 176.335 174.527 1.808 19205
913 1 6 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.779 -0.838 19205
914 1 6 . 1 1 16 16 GLN CB C 16 31.323 31.323 30.925 0.397 19205
915 1 6 . 1 1 16 16 GLN H H 16 8.049 8.049 7.993 0.056 19205
916 1 6 . 1 1 17 17 ASP N N 17 124.190 124.190 121.383 2.807 19205
917 1 6 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.517 -0.408 19205
918 1 6 . 1 1 17 17 ASP C C 17 178.349 178.349 178.139 0.210 19205
919 1 6 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.008 1.940 19205
920 1 6 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.286 -0.763 19205
921 1 6 . 1 1 17 17 ASP H H 17 9.208 9.208 8.911 0.297 19205
922 1 6 . 1 1 18 18 SER N N 18 112.259 112.259 112.446 -0.187 19205
923 1 6 . 1 1 18 18 SER HA H 18 4.228 4.228 4.303 -0.075 19205
924 1 6 . 1 1 18 18 SER C C 18 175.037 175.037 174.987 0.050 19205
925 1 6 . 1 1 18 18 SER CA C 18 60.093 60.093 59.620 0.473 19205
926 1 6 . 1 1 18 18 SER CB C 18 62.134 62.134 62.942 -0.808 19205
927 1 6 . 1 1 18 18 SER H H 18 8.371 8.371 8.181 0.190 19205
928 1 6 . 1 1 19 19 ASP N N 19 120.750 120.750 120.435 0.315 19205
929 1 6 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.712 -0.120 19205
930 1 6 . 1 1 19 19 ASP C C 19 175.958 175.958 176.096 -0.138 19205
931 1 6 . 1 1 19 19 ASP CA C 19 55.885 55.885 54.774 1.111 19205
932 1 6 . 1 1 19 19 ASP CB C 19 42.022 42.022 40.996 1.026 19205
933 1 6 . 1 1 19 19 ASP H H 19 7.697 7.697 7.696 0.001 19205
934 1 6 . 1 1 20 20 CYS N N 20 118.125 118.125 116.436 1.689 19205
935 1 6 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.622 0.355 19205
936 1 6 . 1 1 20 20 CYS C C 20 174.152 174.152 175.134 -0.982 19205
937 1 6 . 1 1 20 20 CYS CA C 20 51.981 51.981 57.952 -5.971 19205
938 1 6 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.291 10.683 19205
939 1 6 . 1 1 20 20 CYS H H 20 7.947 7.947 7.543 0.404 19205
940 1 6 . 1 1 21 21 LEU N N 21 121.658 121.658 121.282 0.376 19205
941 1 6 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.361 -0.194 19205
942 1 6 . 1 1 21 21 LEU C C 21 176.589 176.589 177.546 -0.957 19205
943 1 6 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.463 0.423 19205
944 1 6 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.656 0.267 19205
945 1 6 . 1 1 21 21 LEU H H 21 8.522 8.522 8.533 -0.011 19205
946 1 6 . 1 1 22 22 ALA N N 22 121.907 121.907 123.119 -1.212 19205
947 1 6 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.131 -0.059 19205
948 1 6 . 1 1 22 22 ALA C C 22 178.382 178.382 178.509 -0.127 19205
949 1 6 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.622 0.343 19205
950 1 6 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.168 -0.224 19205
951 1 6 . 1 1 22 22 ALA H H 22 8.104 8.104 8.449 -0.345 19205
952 1 6 . 1 1 23 23 GLY N N 23 110.790 110.790 112.436 -1.646 19205
953 1 6 . 1 1 23 23 GLY C C 23 174.553 174.553 174.652 -0.099 19205
954 1 6 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.799 -0.178 19205
955 1 6 . 1 1 23 23 GLY H H 23 8.644 8.644 8.732 -0.088 19205
956 1 6 . 1 1 24 24 CYS N N 24 119.431 119.431 119.775 -0.344 19205
957 1 6 . 1 1 24 24 CYS HA H 24 4.850 4.850 4.737 0.113 19205
958 1 6 . 1 1 24 24 CYS C C 24 172.768 172.768 174.506 -1.738 19205
959 1 6 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.890 -3.988 19205
960 1 6 . 1 1 24 24 CYS CB C 24 46.168 46.168 28.802 17.366 19205
961 1 6 . 1 1 24 24 CYS H H 24 8.491 8.491 7.686 0.805 19205
962 1 6 . 1 1 25 25 VAL N N 25 115.469 115.469 116.512 -1.043 19205
963 1 6 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.630 -0.263 19205
964 1 6 . 1 1 25 25 VAL C C 25 175.161 175.161 174.060 1.101 19205
965 1 6 . 1 1 25 25 VAL CA C 25 59.327 59.327 59.213 0.114 19205
966 1 6 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.706 0.329 19205
967 1 6 . 1 1 25 25 VAL H H 25 9.324 9.324 9.129 0.195 19205
968 1 6 . 1 1 26 26 CYS N N 26 123.350 123.350 121.541 1.809 19205
969 1 6 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.830 -0.020 19205
970 1 6 . 1 1 26 26 CYS C C 26 174.891 174.891 176.163 -1.272 19205
971 1 6 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.884 -3.685 19205
972 1 6 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.518 12.742 19205
973 1 6 . 1 1 26 26 CYS H H 26 9.346 9.346 8.888 0.458 19205
974 1 6 . 1 1 27 27 GLY N N 27 117.742 117.742 116.734 1.008 19205
975 1 6 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.175 1.283 19205
976 1 6 . 1 1 27 27 GLY H H 27 8.259 8.259 8.968 -0.709 19205
977 1 6 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.444 -0.074 19205
978 1 6 . 1 1 28 28 PRO C C 28 176.720 176.720 176.764 -0.044 19205
979 1 6 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.375 0.111 19205
980 1 6 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.647 -0.094 19205
981 1 6 . 1 1 29 29 ASN N N 29 114.300 114.300 116.340 -2.040 19205
982 1 6 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.692 -0.043 19205
983 1 6 . 1 1 29 29 ASN C C 29 175.490 175.490 176.404 -0.914 19205
984 1 6 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.861 -0.526 19205
985 1 6 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.570 -0.004 19205
986 1 6 . 1 1 29 29 ASN H H 29 8.061 8.061 8.209 -0.148 19205
987 1 6 . 1 1 30 30 GLY N N 30 107.086 107.086 107.258 -0.172 19205
988 1 6 . 1 1 30 30 GLY C C 30 173.758 173.758 172.889 0.869 19205
989 1 6 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.248 1.064 19205
990 1 6 . 1 1 30 30 GLY H H 30 8.294 8.294 7.998 0.296 19205
991 1 6 . 1 1 31 31 PHE N N 31 115.129 115.129 118.489 -3.360 19205
992 1 6 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.343 0.007 19205
993 1 6 . 1 1 31 31 PHE C C 31 176.773 176.773 175.352 1.421 19205
994 1 6 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.055 0.355 19205
995 1 6 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.465 0.009 19205
996 1 6 . 1 1 31 31 PHE H H 31 7.167 7.167 8.219 -1.052 19205
997 1 6 . 1 1 32 32 CYS N N 32 123.123 123.123 120.558 2.565 19205
998 1 6 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.151 -0.052 19205
999 1 6 . 1 1 32 32 CYS C C 32 175.875 175.875 175.845 0.030 19205
1000 1 6 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.331 -3.901 19205
1001 1 6 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.731 15.356 19205
1002 1 6 . 1 1 32 32 CYS H H 32 8.708 8.708 8.991 -0.283 19205
1003 1 7 . 1 1 2 2 CYS N N 2 120.511 120.511 116.752 3.759 19205
1004 1 7 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.982 -0.109 19205
1005 1 7 . 1 1 2 2 CYS CA C 2 53.145 53.145 56.012 -2.867 19205
1006 1 7 . 1 1 2 2 CYS CB C 2 41.921 41.921 29.199 12.722 19205
1007 1 7 . 1 1 2 2 CYS H H 2 8.866 8.866 8.519 0.347 19205
1008 1 7 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.263 0.035 19205
1009 1 7 . 1 1 3 3 PRO C C 3 176.294 176.294 175.804 0.490 19205
1010 1 7 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.393 0.381 19205
1011 1 7 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.557 1.334 19205
1012 1 7 . 1 1 4 4 GLN N N 4 118.141 118.141 116.629 1.512 19205
1013 1 7 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.669 -0.775 19205
1014 1 7 . 1 1 4 4 GLN C C 4 176.143 176.143 175.423 0.720 19205
1015 1 7 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.386 0.787 19205
1016 1 7 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.939 -1.371 19205
1017 1 7 . 1 1 4 4 GLN H H 4 7.648 7.648 8.084 -0.436 19205
1018 1 7 . 1 1 5 5 GLY N N 5 108.656 108.656 106.772 1.884 19205
1019 1 7 . 1 1 5 5 GLY C C 5 173.733 173.733 173.822 -0.089 19205
1020 1 7 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.749 -0.492 19205
1021 1 7 . 1 1 5 5 GLY H H 5 7.759 7.759 7.604 0.155 19205
1022 1 7 . 1 1 6 6 ARG N N 6 119.446 119.446 120.511 -1.065 19205
1023 1 7 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.818 -0.429 19205
1024 1 7 . 1 1 6 6 ARG C C 6 176.780 176.780 177.152 -0.372 19205
1025 1 7 . 1 1 6 6 ARG CA C 6 55.538 55.538 54.300 1.238 19205
1026 1 7 . 1 1 6 6 ARG CB C 6 31.543 31.543 31.163 0.380 19205
1027 1 7 . 1 1 6 6 ARG H H 6 7.865 7.865 7.766 0.099 19205
1028 1 7 . 1 1 7 7 GLY N N 7 109.318 109.318 109.294 0.024 19205
1029 1 7 . 1 1 7 7 GLY C C 7 174.275 174.275 174.875 -0.600 19205
1030 1 7 . 1 1 7 7 GLY CA C 7 46.020 46.020 46.541 -0.521 19205
1031 1 7 . 1 1 7 7 GLY H H 7 8.529 8.529 8.559 -0.030 19205
1032 1 7 . 1 1 8 8 ASP N N 8 121.036 121.036 119.512 1.524 19205
1033 1 7 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.725 -0.170 19205
1034 1 7 . 1 1 8 8 ASP C C 8 175.562 175.562 176.361 -0.799 19205
1035 1 7 . 1 1 8 8 ASP CA C 8 53.748 53.748 53.948 -0.200 19205
1036 1 7 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.843 -0.784 19205
1037 1 7 . 1 1 8 8 ASP H H 8 8.414 8.414 8.661 -0.247 19205
1038 1 7 . 1 1 9 9 TRP N N 9 121.704 121.704 122.283 -0.579 19205
1039 1 7 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.624 -0.131 19205
1040 1 7 . 1 1 9 9 TRP C C 9 175.498 175.498 175.217 0.281 19205
1041 1 7 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.946 1.148 19205
1042 1 7 . 1 1 9 9 TRP CB C 9 29.809 29.809 28.059 1.750 19205
1043 1 7 . 1 1 9 9 TRP H H 9 7.814 7.814 8.242 -0.428 19205
1044 1 7 . 1 1 10 10 ALA N N 10 128.588 128.588 127.695 0.893 19205
1045 1 7 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.426 -0.013 19205
1046 1 7 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.566 -0.296 19205
1047 1 7 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.742 -0.627 19205
1048 1 7 . 1 1 10 10 ALA H H 10 8.163 8.163 7.724 0.439 19205
1049 1 7 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.871 -0.540 19205
1050 1 7 . 1 1 11 11 PRO C C 11 176.753 176.753 176.593 0.160 19205
1051 1 7 . 1 1 11 11 PRO CA C 11 62.996 62.996 61.857 1.139 19205
1052 1 7 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.551 -0.106 19205
1053 1 7 . 1 1 12 12 THR N N 12 119.798 119.798 116.078 3.720 19205
1054 1 7 . 1 1 12 12 THR HA H 12 4.512 4.512 4.746 -0.234 19205
1055 1 7 . 1 1 12 12 THR C C 12 173.572 173.572 174.682 -1.110 19205
1056 1 7 . 1 1 12 12 THR CA C 12 62.099 62.099 61.873 0.226 19205
1057 1 7 . 1 1 12 12 THR CB C 12 71.060 71.060 70.563 0.497 19205
1058 1 7 . 1 1 12 12 THR H H 12 9.006 9.006 8.487 0.519 19205
1059 1 7 . 1 1 13 13 SER N N 13 123.494 123.494 121.841 1.653 19205
1060 1 7 . 1 1 13 13 SER HA H 13 4.539 4.539 4.273 0.266 19205
1061 1 7 . 1 1 13 13 SER C C 13 172.953 172.953 174.452 -1.499 19205
1062 1 7 . 1 1 13 13 SER CA C 13 58.421 58.421 58.323 0.098 19205
1063 1 7 . 1 1 13 13 SER CB C 13 63.844 63.844 62.836 1.008 19205
1064 1 7 . 1 1 13 13 SER H H 13 8.805 8.805 8.742 0.063 19205
1065 1 7 . 1 1 14 14 CYS N N 14 116.548 116.548 121.280 -4.732 19205
1066 1 7 . 1 1 14 14 CYS HA H 14 4.940 4.940 5.033 -0.093 19205
1067 1 7 . 1 1 14 14 CYS C C 14 172.746 172.746 173.523 -0.777 19205
1068 1 7 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.715 -2.909 19205
1069 1 7 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.604 16.001 19205
1070 1 7 . 1 1 14 14 CYS H H 14 8.265 8.265 8.565 -0.300 19205
1071 1 7 . 1 1 15 15 SER N N 15 113.958 113.958 114.100 -0.142 19205
1072 1 7 . 1 1 15 15 SER HA H 15 4.531 4.531 4.604 -0.073 19205
1073 1 7 . 1 1 15 15 SER C C 15 173.205 173.205 173.766 -0.561 19205
1074 1 7 . 1 1 15 15 SER CA C 15 58.826 58.826 58.513 0.313 19205
1075 1 7 . 1 1 15 15 SER CB C 15 65.097 65.097 64.749 0.348 19205
1076 1 7 . 1 1 15 15 SER H H 15 9.497 9.497 9.170 0.327 19205
1077 1 7 . 1 1 16 16 GLN N N 16 118.516 118.516 118.929 -0.413 19205
1078 1 7 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.702 0.042 19205
1079 1 7 . 1 1 16 16 GLN C C 16 176.335 176.335 174.587 1.748 19205
1080 1 7 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.666 -0.725 19205
1081 1 7 . 1 1 16 16 GLN CB C 16 31.323 31.323 30.943 0.380 19205
1082 1 7 . 1 1 16 16 GLN H H 16 8.049 8.049 7.788 0.261 19205
1083 1 7 . 1 1 17 17 ASP N N 17 124.190 124.190 121.411 2.779 19205
1084 1 7 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.450 -0.341 19205
1085 1 7 . 1 1 17 17 ASP C C 17 178.349 178.349 178.180 0.169 19205
1086 1 7 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.060 1.887 19205
1087 1 7 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.224 -0.701 19205
1088 1 7 . 1 1 17 17 ASP H H 17 9.208 9.208 8.929 0.279 19205
1089 1 7 . 1 1 18 18 SER N N 18 112.259 112.259 113.030 -0.771 19205
1090 1 7 . 1 1 18 18 SER HA H 18 4.228 4.228 4.269 -0.041 19205
1091 1 7 . 1 1 18 18 SER C C 18 175.037 175.037 175.129 -0.092 19205
1092 1 7 . 1 1 18 18 SER CA C 18 60.093 60.093 59.981 0.112 19205
1093 1 7 . 1 1 18 18 SER CB C 18 62.134 62.134 62.952 -0.818 19205
1094 1 7 . 1 1 18 18 SER H H 18 8.371 8.371 8.200 0.171 19205
1095 1 7 . 1 1 19 19 ASP N N 19 120.750 120.750 120.840 -0.090 19205
1096 1 7 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.646 -0.055 19205
1097 1 7 . 1 1 19 19 ASP C C 19 175.958 175.958 176.368 -0.410 19205
1098 1 7 . 1 1 19 19 ASP CA C 19 55.885 55.885 55.033 0.852 19205
1099 1 7 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.103 0.919 19205
1100 1 7 . 1 1 19 19 ASP H H 19 7.697 7.697 7.689 0.008 19205
1101 1 7 . 1 1 20 20 CYS N N 20 118.125 118.125 116.250 1.875 19205
1102 1 7 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.708 0.269 19205
1103 1 7 . 1 1 20 20 CYS C C 20 174.152 174.152 174.549 -0.397 19205
1104 1 7 . 1 1 20 20 CYS CA C 20 51.981 51.981 57.909 -5.928 19205
1105 1 7 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.993 9.981 19205
1106 1 7 . 1 1 20 20 CYS H H 20 7.947 7.947 7.668 0.279 19205
1107 1 7 . 1 1 21 21 LEU N N 21 121.658 121.658 121.374 0.284 19205
1108 1 7 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.361 -0.194 19205
1109 1 7 . 1 1 21 21 LEU C C 21 176.589 176.589 177.425 -0.836 19205
1110 1 7 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.507 0.380 19205
1111 1 7 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.737 0.186 19205
1112 1 7 . 1 1 21 21 LEU H H 21 8.522 8.522 8.328 0.194 19205
1113 1 7 . 1 1 22 22 ALA N N 22 121.907 121.907 122.590 -0.683 19205
1114 1 7 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.255 -0.183 19205
1115 1 7 . 1 1 22 22 ALA C C 22 178.382 178.382 178.501 -0.119 19205
1116 1 7 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.275 0.690 19205
1117 1 7 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.640 -0.696 19205
1118 1 7 . 1 1 22 22 ALA H H 22 8.104 8.104 8.412 -0.308 19205
1119 1 7 . 1 1 23 23 GLY N N 23 110.790 110.790 110.957 -0.167 19205
1120 1 7 . 1 1 23 23 GLY C C 23 174.553 174.553 174.307 0.246 19205
1121 1 7 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.984 -0.363 19205
1122 1 7 . 1 1 23 23 GLY H H 23 8.644 8.644 8.638 0.006 19205
1123 1 7 . 1 1 24 24 CYS N N 24 119.431 119.431 119.548 -0.117 19205
1124 1 7 . 1 1 24 24 CYS HA H 24 4.850 4.850 5.256 -0.406 19205
1125 1 7 . 1 1 24 24 CYS C C 24 172.768 172.768 173.896 -1.128 19205
1126 1 7 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.764 -3.862 19205
1127 1 7 . 1 1 24 24 CYS CB C 24 46.168 46.168 30.064 16.105 19205
1128 1 7 . 1 1 24 24 CYS H H 24 8.491 8.491 7.622 0.869 19205
1129 1 7 . 1 1 25 25 VAL N N 25 115.469 115.469 117.382 -1.913 19205
1130 1 7 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.650 -0.283 19205
1131 1 7 . 1 1 25 25 VAL C C 25 175.161 175.161 173.712 1.449 19205
1132 1 7 . 1 1 25 25 VAL CA C 25 59.327 59.327 58.830 0.498 19205
1133 1 7 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.208 0.827 19205
1134 1 7 . 1 1 25 25 VAL H H 25 9.324 9.324 9.172 0.152 19205
1135 1 7 . 1 1 26 26 CYS N N 26 123.350 123.350 120.724 2.626 19205
1136 1 7 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.695 0.115 19205
1137 1 7 . 1 1 26 26 CYS C C 26 174.891 174.891 176.012 -1.121 19205
1138 1 7 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.969 -3.770 19205
1139 1 7 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.747 12.513 19205
1140 1 7 . 1 1 26 26 CYS H H 26 9.346 9.346 8.739 0.607 19205
1141 1 7 . 1 1 27 27 GLY N N 27 117.742 117.742 116.764 0.978 19205
1142 1 7 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.151 1.307 19205
1143 1 7 . 1 1 27 27 GLY H H 27 8.259 8.259 8.931 -0.672 19205
1144 1 7 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.431 -0.061 19205
1145 1 7 . 1 1 28 28 PRO C C 28 176.720 176.720 176.837 -0.117 19205
1146 1 7 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.398 0.088 19205
1147 1 7 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.672 -0.119 19205
1148 1 7 . 1 1 29 29 ASN N N 29 114.300 114.300 116.415 -2.115 19205
1149 1 7 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.679 -0.030 19205
1150 1 7 . 1 1 29 29 ASN C C 29 175.490 175.490 176.408 -0.918 19205
1151 1 7 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.945 -0.610 19205
1152 1 7 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.605 -0.039 19205
1153 1 7 . 1 1 29 29 ASN H H 29 8.061 8.061 8.239 -0.178 19205
1154 1 7 . 1 1 30 30 GLY N N 30 107.086 107.086 107.124 -0.038 19205
1155 1 7 . 1 1 30 30 GLY C C 30 173.758 173.758 172.893 0.865 19205
1156 1 7 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.107 1.205 19205
1157 1 7 . 1 1 30 30 GLY H H 30 8.294 8.294 7.961 0.333 19205
1158 1 7 . 1 1 31 31 PHE N N 31 115.129 115.129 118.603 -3.474 19205
1159 1 7 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.402 -0.052 19205
1160 1 7 . 1 1 31 31 PHE C C 31 176.773 176.773 175.386 1.387 19205
1161 1 7 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.147 0.263 19205
1162 1 7 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.697 -0.223 19205
1163 1 7 . 1 1 31 31 PHE H H 31 7.167 7.167 8.248 -1.081 19205
1164 1 7 . 1 1 32 32 CYS N N 32 123.123 123.123 120.642 2.481 19205
1165 1 7 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.162 -0.062 19205
1166 1 7 . 1 1 32 32 CYS C C 32 175.875 175.875 175.907 -0.032 19205
1167 1 7 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.296 -3.866 19205
1168 1 7 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.431 15.656 19205
1169 1 7 . 1 1 32 32 CYS H H 32 8.708 8.708 8.927 -0.219 19205
1170 1 8 . 1 1 2 2 CYS N N 2 120.511 120.511 117.216 3.295 19205
1171 1 8 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.989 -0.116 19205
1172 1 8 . 1 1 2 2 CYS CA C 2 53.145 53.145 57.264 -4.119 19205
1173 1 8 . 1 1 2 2 CYS CB C 2 41.921 41.921 28.756 13.165 19205
1174 1 8 . 1 1 2 2 CYS H H 2 8.866 8.866 8.141 0.725 19205
1175 1 8 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.217 0.081 19205
1176 1 8 . 1 1 3 3 PRO C C 3 176.294 176.294 175.943 0.351 19205
1177 1 8 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.337 0.437 19205
1178 1 8 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.709 1.182 19205
1179 1 8 . 1 1 4 4 GLN N N 4 118.141 118.141 118.459 -0.318 19205
1180 1 8 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.661 -0.767 19205
1181 1 8 . 1 1 4 4 GLN C C 4 176.143 176.143 175.433 0.710 19205
1182 1 8 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.226 0.947 19205
1183 1 8 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.023 -0.455 19205
1184 1 8 . 1 1 4 4 GLN H H 4 7.648 7.648 8.116 -0.468 19205
1185 1 8 . 1 1 5 5 GLY N N 5 108.656 108.656 106.863 1.793 19205
1186 1 8 . 1 1 5 5 GLY C C 5 173.733 173.733 174.185 -0.452 19205
1187 1 8 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.078 0.179 19205
1188 1 8 . 1 1 5 5 GLY H H 5 7.759 7.759 7.689 0.070 19205
1189 1 8 . 1 1 6 6 ARG N N 6 119.446 119.446 120.482 -1.036 19205
1190 1 8 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.559 -0.170 19205
1191 1 8 . 1 1 6 6 ARG C C 6 176.780 176.780 178.097 -1.317 19205
1192 1 8 . 1 1 6 6 ARG CA C 6 55.538 55.538 55.138 0.400 19205
1193 1 8 . 1 1 6 6 ARG CB C 6 31.543 31.543 31.136 0.407 19205
1194 1 8 . 1 1 6 6 ARG H H 6 7.865 7.865 7.621 0.244 19205
1195 1 8 . 1 1 7 7 GLY N N 7 109.318 109.318 109.856 -0.538 19205
1196 1 8 . 1 1 7 7 GLY C C 7 174.275 174.275 174.991 -0.716 19205
1197 1 8 . 1 1 7 7 GLY CA C 7 46.020 46.020 47.029 -1.009 19205
1198 1 8 . 1 1 7 7 GLY H H 7 8.529 8.529 8.744 -0.215 19205
1199 1 8 . 1 1 8 8 ASP N N 8 121.036 121.036 120.514 0.522 19205
1200 1 8 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.715 -0.160 19205
1201 1 8 . 1 1 8 8 ASP C C 8 175.562 175.562 175.324 0.238 19205
1202 1 8 . 1 1 8 8 ASP CA C 8 53.748 53.748 53.647 0.101 19205
1203 1 8 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.210 -0.151 19205
1204 1 8 . 1 1 8 8 ASP H H 8 8.414 8.414 8.624 -0.210 19205
1205 1 8 . 1 1 9 9 TRP N N 9 121.704 121.704 121.967 -0.263 19205
1206 1 8 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.794 -0.301 19205
1207 1 8 . 1 1 9 9 TRP C C 9 175.498 175.498 175.033 0.465 19205
1208 1 8 . 1 1 9 9 TRP CA C 9 57.094 57.094 56.023 1.071 19205
1209 1 8 . 1 1 9 9 TRP CB C 9 29.809 29.809 30.204 -0.395 19205
1210 1 8 . 1 1 9 9 TRP H H 9 7.814 7.814 7.596 0.218 19205
1211 1 8 . 1 1 10 10 ALA N N 10 128.588 128.588 128.695 -0.107 19205
1212 1 8 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.384 0.029 19205
1213 1 8 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.780 -0.510 19205
1214 1 8 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.390 -0.275 19205
1215 1 8 . 1 1 10 10 ALA H H 10 8.163 8.163 8.233 -0.070 19205
1216 1 8 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.997 -0.666 19205
1217 1 8 . 1 1 11 11 PRO C C 11 176.753 176.753 176.702 0.051 19205
1218 1 8 . 1 1 11 11 PRO CA C 11 62.996 62.996 61.904 1.092 19205
1219 1 8 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.689 -0.244 19205
1220 1 8 . 1 1 12 12 THR N N 12 119.798 119.798 117.240 2.558 19205
1221 1 8 . 1 1 12 12 THR HA H 12 4.512 4.512 4.716 -0.204 19205
1222 1 8 . 1 1 12 12 THR C C 12 173.572 173.572 174.583 -1.011 19205
1223 1 8 . 1 1 12 12 THR CA C 12 62.099 62.099 62.142 -0.044 19205
1224 1 8 . 1 1 12 12 THR CB C 12 71.060 71.060 70.099 0.961 19205
1225 1 8 . 1 1 12 12 THR H H 12 9.006 9.006 8.333 0.673 19205
1226 1 8 . 1 1 13 13 SER N N 13 123.494 123.494 121.895 1.599 19205
1227 1 8 . 1 1 13 13 SER HA H 13 4.539 4.539 4.342 0.197 19205
1228 1 8 . 1 1 13 13 SER C C 13 172.953 172.953 174.380 -1.427 19205
1229 1 8 . 1 1 13 13 SER CA C 13 58.421 58.421 58.148 0.273 19205
1230 1 8 . 1 1 13 13 SER CB C 13 63.844 63.844 62.989 0.855 19205
1231 1 8 . 1 1 13 13 SER H H 13 8.805 8.805 8.716 0.089 19205
1232 1 8 . 1 1 14 14 CYS N N 14 116.548 116.548 120.635 -4.087 19205
1233 1 8 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.847 0.093 19205
1234 1 8 . 1 1 14 14 CYS C C 14 172.746 172.746 173.767 -1.021 19205
1235 1 8 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.714 -2.908 19205
1236 1 8 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.660 15.945 19205
1237 1 8 . 1 1 14 14 CYS H H 14 8.265 8.265 8.491 -0.226 19205
1238 1 8 . 1 1 15 15 SER N N 15 113.958 113.958 114.304 -0.346 19205
1239 1 8 . 1 1 15 15 SER HA H 15 4.531 4.531 4.603 -0.071 19205
1240 1 8 . 1 1 15 15 SER C C 15 173.205 173.205 173.963 -0.758 19205
1241 1 8 . 1 1 15 15 SER CA C 15 58.826 58.826 58.999 -0.173 19205
1242 1 8 . 1 1 15 15 SER CB C 15 65.097 65.097 64.899 0.198 19205
1243 1 8 . 1 1 15 15 SER H H 15 9.497 9.497 9.076 0.421 19205
1244 1 8 . 1 1 16 16 GLN N N 16 118.516 118.516 119.390 -0.874 19205
1245 1 8 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.756 -0.012 19205
1246 1 8 . 1 1 16 16 GLN C C 16 176.335 176.335 174.638 1.697 19205
1247 1 8 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.689 -0.748 19205
1248 1 8 . 1 1 16 16 GLN CB C 16 31.323 31.323 30.930 0.393 19205
1249 1 8 . 1 1 16 16 GLN H H 16 8.049 8.049 7.831 0.218 19205
1250 1 8 . 1 1 17 17 ASP N N 17 124.190 124.190 121.724 2.466 19205
1251 1 8 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.467 -0.358 19205
1252 1 8 . 1 1 17 17 ASP C C 17 178.349 178.349 177.854 0.495 19205
1253 1 8 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.062 1.885 19205
1254 1 8 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.350 -0.827 19205
1255 1 8 . 1 1 17 17 ASP H H 17 9.208 9.208 8.874 0.334 19205
1256 1 8 . 1 1 18 18 SER N N 18 112.259 112.259 111.097 1.162 19205
1257 1 8 . 1 1 18 18 SER HA H 18 4.228 4.228 4.296 -0.068 19205
1258 1 8 . 1 1 18 18 SER C C 18 175.037 175.037 174.571 0.466 19205
1259 1 8 . 1 1 18 18 SER CA C 18 60.093 60.093 59.340 0.753 19205
1260 1 8 . 1 1 18 18 SER CB C 18 62.134 62.134 62.805 -0.671 19205
1261 1 8 . 1 1 18 18 SER H H 18 8.371 8.371 8.089 0.282 19205
1262 1 8 . 1 1 19 19 ASP N N 19 120.750 120.750 121.247 -0.497 19205
1263 1 8 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.792 -0.201 19205
1264 1 8 . 1 1 19 19 ASP C C 19 175.958 175.958 176.092 -0.134 19205
1265 1 8 . 1 1 19 19 ASP CA C 19 55.885 55.885 54.635 1.250 19205
1266 1 8 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.432 0.590 19205
1267 1 8 . 1 1 19 19 ASP H H 19 7.697 7.697 7.961 -0.264 19205
1268 1 8 . 1 1 20 20 CYS N N 20 118.125 118.125 116.859 1.266 19205
1269 1 8 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.706 0.271 19205
1270 1 8 . 1 1 20 20 CYS C C 20 174.152 174.152 174.854 -0.702 19205
1271 1 8 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.223 -6.242 19205
1272 1 8 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.881 10.093 19205
1273 1 8 . 1 1 20 20 CYS H H 20 7.947 7.947 7.655 0.292 19205
1274 1 8 . 1 1 21 21 LEU N N 21 121.658 121.658 121.629 0.029 19205
1275 1 8 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.354 -0.187 19205
1276 1 8 . 1 1 21 21 LEU C C 21 176.589 176.589 177.380 -0.791 19205
1277 1 8 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.429 0.457 19205
1278 1 8 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.752 0.171 19205
1279 1 8 . 1 1 21 21 LEU H H 21 8.522 8.522 8.448 0.074 19205
1280 1 8 . 1 1 22 22 ALA N N 22 121.907 121.907 123.414 -1.507 19205
1281 1 8 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.145 -0.073 19205
1282 1 8 . 1 1 22 22 ALA C C 22 178.382 178.382 178.524 -0.142 19205
1283 1 8 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.643 0.322 19205
1284 1 8 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.289 -0.345 19205
1285 1 8 . 1 1 22 22 ALA H H 22 8.104 8.104 8.473 -0.369 19205
1286 1 8 . 1 1 23 23 GLY N N 23 110.790 110.790 112.328 -1.538 19205
1287 1 8 . 1 1 23 23 GLY C C 23 174.553 174.553 174.725 -0.172 19205
1288 1 8 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.775 -0.154 19205
1289 1 8 . 1 1 23 23 GLY H H 23 8.644 8.644 8.749 -0.105 19205
1290 1 8 . 1 1 24 24 CYS N N 24 119.431 119.431 119.296 0.135 19205
1291 1 8 . 1 1 24 24 CYS HA H 24 4.850 4.850 4.817 0.033 19205
1292 1 8 . 1 1 24 24 CYS C C 24 172.768 172.768 174.125 -1.357 19205
1293 1 8 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.562 -3.659 19205
1294 1 8 . 1 1 24 24 CYS CB C 24 46.168 46.168 29.237 16.931 19205
1295 1 8 . 1 1 24 24 CYS H H 24 8.491 8.491 7.782 0.709 19205
1296 1 8 . 1 1 25 25 VAL N N 25 115.469 115.469 117.106 -1.637 19205
1297 1 8 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.803 -0.436 19205
1298 1 8 . 1 1 25 25 VAL C C 25 175.161 175.161 173.908 1.253 19205
1299 1 8 . 1 1 25 25 VAL CA C 25 59.327 59.327 58.830 0.497 19205
1300 1 8 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.501 0.534 19205
1301 1 8 . 1 1 25 25 VAL H H 25 9.324 9.324 8.893 0.431 19205
1302 1 8 . 1 1 26 26 CYS N N 26 123.350 123.350 121.481 1.869 19205
1303 1 8 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.798 0.012 19205
1304 1 8 . 1 1 26 26 CYS C C 26 174.891 174.891 176.058 -1.167 19205
1305 1 8 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.787 -3.588 19205
1306 1 8 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.595 12.665 19205
1307 1 8 . 1 1 26 26 CYS H H 26 9.346 9.346 8.805 0.541 19205
1308 1 8 . 1 1 27 27 GLY N N 27 117.742 117.742 116.730 1.012 19205
1309 1 8 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.031 1.427 19205
1310 1 8 . 1 1 27 27 GLY H H 27 8.259 8.259 8.908 -0.649 19205
1311 1 8 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.427 -0.057 19205
1312 1 8 . 1 1 28 28 PRO C C 28 176.720 176.720 176.894 -0.174 19205
1313 1 8 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.427 0.059 19205
1314 1 8 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.663 -0.110 19205
1315 1 8 . 1 1 29 29 ASN N N 29 114.300 114.300 116.600 -2.300 19205
1316 1 8 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.677 -0.028 19205
1317 1 8 . 1 1 29 29 ASN C C 29 175.490 175.490 176.483 -0.993 19205
1318 1 8 . 1 1 29 29 ASN CA C 29 52.335 52.335 53.112 -0.777 19205
1319 1 8 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.684 -0.118 19205
1320 1 8 . 1 1 29 29 ASN H H 29 8.061 8.061 8.270 -0.209 19205
1321 1 8 . 1 1 30 30 GLY N N 30 107.086 107.086 107.041 0.045 19205
1322 1 8 . 1 1 30 30 GLY C C 30 173.758 173.758 172.937 0.821 19205
1323 1 8 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.003 1.309 19205
1324 1 8 . 1 1 30 30 GLY H H 30 8.294 8.294 7.920 0.374 19205
1325 1 8 . 1 1 31 31 PHE N N 31 115.129 115.129 118.418 -3.289 19205
1326 1 8 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.323 0.027 19205
1327 1 8 . 1 1 31 31 PHE C C 31 176.773 176.773 175.272 1.501 19205
1328 1 8 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.318 0.092 19205
1329 1 8 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.775 -0.301 19205
1330 1 8 . 1 1 31 31 PHE H H 31 7.167 7.167 8.411 -1.244 19205
1331 1 8 . 1 1 32 32 CYS N N 32 123.123 123.123 120.633 2.490 19205
1332 1 8 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.188 -0.089 19205
1333 1 8 . 1 1 32 32 CYS C C 32 175.875 175.875 175.635 0.240 19205
1334 1 8 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.566 -4.136 19205
1335 1 8 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.442 15.645 19205
1336 1 8 . 1 1 32 32 CYS H H 32 8.708 8.708 8.789 -0.081 19205
1337 1 9 . 1 1 2 2 CYS N N 2 120.511 120.511 118.417 2.094 19205
1338 1 9 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.942 -0.069 19205
1339 1 9 . 1 1 2 2 CYS CA C 2 53.145 53.145 56.691 -3.546 19205
1340 1 9 . 1 1 2 2 CYS CB C 2 41.921 41.921 29.841 12.079 19205
1341 1 9 . 1 1 2 2 CYS H H 2 8.866 8.866 8.357 0.509 19205
1342 1 9 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.229 0.069 19205
1343 1 9 . 1 1 3 3 PRO C C 3 176.294 176.294 175.845 0.449 19205
1344 1 9 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.372 0.402 19205
1345 1 9 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.706 1.185 19205
1346 1 9 . 1 1 4 4 GLN N N 4 118.141 118.141 118.055 0.086 19205
1347 1 9 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.673 -0.779 19205
1348 1 9 . 1 1 4 4 GLN C C 4 176.143 176.143 175.286 0.857 19205
1349 1 9 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.368 0.805 19205
1350 1 9 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.905 -1.337 19205
1351 1 9 . 1 1 4 4 GLN H H 4 7.648 7.648 8.305 -0.657 19205
1352 1 9 . 1 1 5 5 GLY N N 5 108.656 108.656 107.181 1.475 19205
1353 1 9 . 1 1 5 5 GLY C C 5 173.733 173.733 173.856 -0.123 19205
1354 1 9 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.440 -0.183 19205
1355 1 9 . 1 1 5 5 GLY H H 5 7.759 7.759 7.806 -0.047 19205
1356 1 9 . 1 1 6 6 ARG N N 6 119.446 119.446 120.304 -0.858 19205
1357 1 9 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.608 -0.219 19205
1358 1 9 . 1 1 6 6 ARG C C 6 176.780 176.780 178.123 -1.343 19205
1359 1 9 . 1 1 6 6 ARG CA C 6 55.538 55.538 54.792 0.746 19205
1360 1 9 . 1 1 6 6 ARG CB C 6 31.543 31.543 31.617 -0.074 19205
1361 1 9 . 1 1 6 6 ARG H H 6 7.865 7.865 7.695 0.170 19205
1362 1 9 . 1 1 7 7 GLY N N 7 109.318 109.318 110.110 -0.792 19205
1363 1 9 . 1 1 7 7 GLY C C 7 174.275 174.275 174.957 -0.682 19205
1364 1 9 . 1 1 7 7 GLY CA C 7 46.020 46.020 47.282 -1.262 19205
1365 1 9 . 1 1 7 7 GLY H H 7 8.529 8.529 8.749 -0.220 19205
1366 1 9 . 1 1 8 8 ASP N N 8 121.036 121.036 120.183 0.853 19205
1367 1 9 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.683 -0.128 19205
1368 1 9 . 1 1 8 8 ASP C C 8 175.562 175.562 175.917 -0.355 19205
1369 1 9 . 1 1 8 8 ASP CA C 8 53.748 53.748 53.751 -0.003 19205
1370 1 9 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.534 -0.475 19205
1371 1 9 . 1 1 8 8 ASP H H 8 8.414 8.414 8.657 -0.243 19205
1372 1 9 . 1 1 9 9 TRP N N 9 121.704 121.704 122.985 -1.281 19205
1373 1 9 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.719 -0.226 19205
1374 1 9 . 1 1 9 9 TRP C C 9 175.498 175.498 175.087 0.411 19205
1375 1 9 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.998 1.096 19205
1376 1 9 . 1 1 9 9 TRP CB C 9 29.809 29.809 28.298 1.511 19205
1377 1 9 . 1 1 9 9 TRP H H 9 7.814 7.814 7.716 0.098 19205
1378 1 9 . 1 1 10 10 ALA N N 10 128.588 128.588 127.987 0.601 19205
1379 1 9 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.389 0.024 19205
1380 1 9 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.677 -0.407 19205
1381 1 9 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.540 -0.425 19205
1382 1 9 . 1 1 10 10 ALA H H 10 8.163 8.163 7.661 0.502 19205
1383 1 9 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.983 -0.652 19205
1384 1 9 . 1 1 11 11 PRO C C 11 176.753 176.753 176.861 -0.108 19205
1385 1 9 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.034 0.962 19205
1386 1 9 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.581 -0.136 19205
1387 1 9 . 1 1 12 12 THR N N 12 119.798 119.798 117.539 2.259 19205
1388 1 9 . 1 1 12 12 THR HA H 12 4.512 4.512 4.713 -0.201 19205
1389 1 9 . 1 1 12 12 THR C C 12 173.572 173.572 174.763 -1.191 19205
1390 1 9 . 1 1 12 12 THR CA C 12 62.099 62.099 62.078 0.021 19205
1391 1 9 . 1 1 12 12 THR CB C 12 71.060 71.060 69.788 1.272 19205
1392 1 9 . 1 1 12 12 THR H H 12 9.006 9.006 8.551 0.455 19205
1393 1 9 . 1 1 13 13 SER N N 13 123.494 123.494 122.206 1.288 19205
1394 1 9 . 1 1 13 13 SER HA H 13 4.539 4.539 4.208 0.331 19205
1395 1 9 . 1 1 13 13 SER C C 13 172.953 172.953 174.387 -1.434 19205
1396 1 9 . 1 1 13 13 SER CA C 13 58.421 58.421 58.445 -0.024 19205
1397 1 9 . 1 1 13 13 SER CB C 13 63.844 63.844 63.018 0.826 19205
1398 1 9 . 1 1 13 13 SER H H 13 8.805 8.805 8.797 0.008 19205
1399 1 9 . 1 1 14 14 CYS N N 14 116.548 116.548 120.014 -3.466 19205
1400 1 9 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.883 0.057 19205
1401 1 9 . 1 1 14 14 CYS C C 14 172.746 172.746 173.397 -0.651 19205
1402 1 9 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.769 -2.963 19205
1403 1 9 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.598 16.007 19205
1404 1 9 . 1 1 14 14 CYS H H 14 8.265 8.265 8.424 -0.159 19205
1405 1 9 . 1 1 15 15 SER N N 15 113.958 113.958 113.911 0.047 19205
1406 1 9 . 1 1 15 15 SER HA H 15 4.531 4.531 4.672 -0.141 19205
1407 1 9 . 1 1 15 15 SER C C 15 173.205 173.205 173.683 -0.478 19205
1408 1 9 . 1 1 15 15 SER CA C 15 58.826 58.826 58.524 0.302 19205
1409 1 9 . 1 1 15 15 SER CB C 15 65.097 65.097 65.192 -0.095 19205
1410 1 9 . 1 1 15 15 SER H H 15 9.497 9.497 9.135 0.362 19205
1411 1 9 . 1 1 16 16 GLN N N 16 118.516 118.516 118.843 -0.327 19205
1412 1 9 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.572 0.172 19205
1413 1 9 . 1 1 16 16 GLN C C 16 176.335 176.335 174.665 1.670 19205
1414 1 9 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.556 -0.615 19205
1415 1 9 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.511 -0.188 19205
1416 1 9 . 1 1 16 16 GLN H H 16 8.049 8.049 7.793 0.256 19205
1417 1 9 . 1 1 17 17 ASP N N 17 124.190 124.190 122.359 1.831 19205
1418 1 9 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.369 -0.260 19205
1419 1 9 . 1 1 17 17 ASP C C 17 178.349 178.349 177.821 0.528 19205
1420 1 9 . 1 1 17 17 ASP CA C 17 58.947 58.947 56.985 1.962 19205
1421 1 9 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.421 -0.898 19205
1422 1 9 . 1 1 17 17 ASP H H 17 9.208 9.208 8.782 0.426 19205
1423 1 9 . 1 1 18 18 SER N N 18 112.259 112.259 112.060 0.199 19205
1424 1 9 . 1 1 18 18 SER HA H 18 4.228 4.228 4.242 -0.014 19205
1425 1 9 . 1 1 18 18 SER C C 18 175.037 175.037 174.919 0.118 19205
1426 1 9 . 1 1 18 18 SER CA C 18 60.093 60.093 59.849 0.244 19205
1427 1 9 . 1 1 18 18 SER CB C 18 62.134 62.134 62.803 -0.669 19205
1428 1 9 . 1 1 18 18 SER H H 18 8.371 8.371 8.136 0.235 19205
1429 1 9 . 1 1 19 19 ASP N N 19 120.750 120.750 121.009 -0.259 19205
1430 1 9 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.702 -0.111 19205
1431 1 9 . 1 1 19 19 ASP C C 19 175.958 175.958 176.421 -0.463 19205
1432 1 9 . 1 1 19 19 ASP CA C 19 55.885 55.885 54.862 1.023 19205
1433 1 9 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.208 0.814 19205
1434 1 9 . 1 1 19 19 ASP H H 19 7.697 7.697 7.838 -0.141 19205
1435 1 9 . 1 1 20 20 CYS N N 20 118.125 118.125 116.561 1.564 19205
1436 1 9 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.638 0.339 19205
1437 1 9 . 1 1 20 20 CYS C C 20 174.152 174.152 175.065 -0.913 19205
1438 1 9 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.459 -6.479 19205
1439 1 9 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.500 10.475 19205
1440 1 9 . 1 1 20 20 CYS H H 20 7.947 7.947 7.677 0.270 19205
1441 1 9 . 1 1 21 21 LEU N N 21 121.658 121.658 121.152 0.506 19205
1442 1 9 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.393 -0.226 19205
1443 1 9 . 1 1 21 21 LEU C C 21 176.589 176.589 177.518 -0.929 19205
1444 1 9 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.323 0.563 19205
1445 1 9 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.808 0.115 19205
1446 1 9 . 1 1 21 21 LEU H H 21 8.522 8.522 8.470 0.052 19205
1447 1 9 . 1 1 22 22 ALA N N 22 121.907 121.907 123.079 -1.172 19205
1448 1 9 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.160 -0.088 19205
1449 1 9 . 1 1 22 22 ALA C C 22 178.382 178.382 178.553 -0.171 19205
1450 1 9 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.597 0.368 19205
1451 1 9 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.210 -0.266 19205
1452 1 9 . 1 1 22 22 ALA H H 22 8.104 8.104 8.469 -0.365 19205
1453 1 9 . 1 1 23 23 GLY N N 23 110.790 110.790 112.478 -1.688 19205
1454 1 9 . 1 1 23 23 GLY C C 23 174.553 174.553 174.787 -0.234 19205
1455 1 9 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.758 -0.137 19205
1456 1 9 . 1 1 23 23 GLY H H 23 8.644 8.644 8.761 -0.117 19205
1457 1 9 . 1 1 24 24 CYS N N 24 119.431 119.431 119.255 0.176 19205
1458 1 9 . 1 1 24 24 CYS HA H 24 4.850 4.850 4.970 -0.120 19205
1459 1 9 . 1 1 24 24 CYS C C 24 172.768 172.768 174.354 -1.586 19205
1460 1 9 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.300 -3.398 19205
1461 1 9 . 1 1 24 24 CYS CB C 24 46.168 46.168 29.139 17.029 19205
1462 1 9 . 1 1 24 24 CYS H H 24 8.491 8.491 7.756 0.735 19205
1463 1 9 . 1 1 25 25 VAL N N 25 115.469 115.469 116.430 -0.961 19205
1464 1 9 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.634 -0.267 19205
1465 1 9 . 1 1 25 25 VAL C C 25 175.161 175.161 173.828 1.333 19205
1466 1 9 . 1 1 25 25 VAL CA C 25 59.327 59.327 58.767 0.559 19205
1467 1 9 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.296 0.739 19205
1468 1 9 . 1 1 25 25 VAL H H 25 9.324 9.324 8.893 0.431 19205
1469 1 9 . 1 1 26 26 CYS N N 26 123.350 123.350 120.923 2.427 19205
1470 1 9 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.774 0.036 19205
1471 1 9 . 1 1 26 26 CYS C C 26 174.891 174.891 175.878 -0.987 19205
1472 1 9 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.627 -3.428 19205
1473 1 9 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.808 12.452 19205
1474 1 9 . 1 1 26 26 CYS H H 26 9.346 9.346 8.895 0.451 19205
1475 1 9 . 1 1 27 27 GLY N N 27 117.742 117.742 116.718 1.024 19205
1476 1 9 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.034 1.424 19205
1477 1 9 . 1 1 27 27 GLY H H 27 8.259 8.259 8.966 -0.707 19205
1478 1 9 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.414 -0.044 19205
1479 1 9 . 1 1 28 28 PRO C C 28 176.720 176.720 176.851 -0.131 19205
1480 1 9 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.432 0.054 19205
1481 1 9 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.663 -0.110 19205
1482 1 9 . 1 1 29 29 ASN N N 29 114.300 114.300 116.467 -2.167 19205
1483 1 9 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.686 -0.037 19205
1484 1 9 . 1 1 29 29 ASN C C 29 175.490 175.490 176.457 -0.967 19205
1485 1 9 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.994 -0.659 19205
1486 1 9 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.663 -0.097 19205
1487 1 9 . 1 1 29 29 ASN H H 29 8.061 8.061 8.234 -0.173 19205
1488 1 9 . 1 1 30 30 GLY N N 30 107.086 107.086 107.169 -0.083 19205
1489 1 9 . 1 1 30 30 GLY C C 30 173.758 173.758 172.884 0.874 19205
1490 1 9 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.092 1.220 19205
1491 1 9 . 1 1 30 30 GLY H H 30 8.294 8.294 7.956 0.338 19205
1492 1 9 . 1 1 31 31 PHE N N 31 115.129 115.129 118.333 -3.204 19205
1493 1 9 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.251 0.099 19205
1494 1 9 . 1 1 31 31 PHE C C 31 176.773 176.773 175.123 1.650 19205
1495 1 9 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.325 0.085 19205
1496 1 9 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.760 -0.286 19205
1497 1 9 . 1 1 31 31 PHE H H 31 7.167 7.167 8.265 -1.098 19205
1498 1 9 . 1 1 32 32 CYS N N 32 123.123 123.123 120.209 2.914 19205
1499 1 9 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.193 -0.094 19205
1500 1 9 . 1 1 32 32 CYS C C 32 175.875 175.875 175.917 -0.042 19205
1501 1 9 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.303 -3.873 19205
1502 1 9 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.433 15.654 19205
1503 1 9 . 1 1 32 32 CYS H H 32 8.708 8.708 8.880 -0.172 19205
1504 1 10 . 1 1 2 2 CYS N N 2 120.511 120.511 116.532 3.979 19205
1505 1 10 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.973 -0.100 19205
1506 1 10 . 1 1 2 2 CYS CA C 2 53.145 53.145 56.213 -3.068 19205
1507 1 10 . 1 1 2 2 CYS CB C 2 41.921 41.921 29.154 12.767 19205
1508 1 10 . 1 1 2 2 CYS H H 2 8.866 8.866 8.538 0.328 19205
1509 1 10 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.253 0.045 19205
1510 1 10 . 1 1 3 3 PRO C C 3 176.294 176.294 175.517 0.777 19205
1511 1 10 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.285 0.489 19205
1512 1 10 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.185 1.706 19205
1513 1 10 . 1 1 4 4 GLN N N 4 118.141 118.141 117.273 0.868 19205
1514 1 10 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.667 -0.772 19205
1515 1 10 . 1 1 4 4 GLN C C 4 176.143 176.143 174.968 1.175 19205
1516 1 10 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.157 1.016 19205
1517 1 10 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.709 -1.141 19205
1518 1 10 . 1 1 4 4 GLN H H 4 7.648 7.648 8.194 -0.546 19205
1519 1 10 . 1 1 5 5 GLY N N 5 108.656 108.656 106.754 1.902 19205
1520 1 10 . 1 1 5 5 GLY C C 5 173.733 173.733 173.793 -0.060 19205
1521 1 10 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.763 -0.506 19205
1522 1 10 . 1 1 5 5 GLY H H 5 7.759 7.759 7.672 0.087 19205
1523 1 10 . 1 1 6 6 ARG N N 6 119.446 119.446 120.453 -1.007 19205
1524 1 10 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.888 -0.499 19205
1525 1 10 . 1 1 6 6 ARG C C 6 176.780 176.780 178.110 -1.330 19205
1526 1 10 . 1 1 6 6 ARG CA C 6 55.538 55.538 53.991 1.547 19205
1527 1 10 . 1 1 6 6 ARG CB C 6 31.543 31.543 31.137 0.406 19205
1528 1 10 . 1 1 6 6 ARG H H 6 7.865 7.865 8.180 -0.315 19205
1529 1 10 . 1 1 7 7 GLY N N 7 109.318 109.318 109.989 -0.671 19205
1530 1 10 . 1 1 7 7 GLY C C 7 174.275 174.275 174.921 -0.646 19205
1531 1 10 . 1 1 7 7 GLY CA C 7 46.020 46.020 46.738 -0.718 19205
1532 1 10 . 1 1 7 7 GLY H H 7 8.529 8.529 8.644 -0.115 19205
1533 1 10 . 1 1 8 8 ASP N N 8 121.036 121.036 120.384 0.652 19205
1534 1 10 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.646 -0.092 19205
1535 1 10 . 1 1 8 8 ASP C C 8 175.562 175.562 175.217 0.345 19205
1536 1 10 . 1 1 8 8 ASP CA C 8 53.748 53.748 53.620 0.128 19205
1537 1 10 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.138 -0.079 19205
1538 1 10 . 1 1 8 8 ASP H H 8 8.414 8.414 8.657 -0.243 19205
1539 1 10 . 1 1 9 9 TRP N N 9 121.704 121.704 122.545 -0.841 19205
1540 1 10 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.835 -0.342 19205
1541 1 10 . 1 1 9 9 TRP C C 9 175.498 175.498 174.745 0.753 19205
1542 1 10 . 1 1 9 9 TRP CA C 9 57.094 57.094 56.048 1.046 19205
1543 1 10 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.768 0.041 19205
1544 1 10 . 1 1 9 9 TRP H H 9 7.814 7.814 7.471 0.343 19205
1545 1 10 . 1 1 10 10 ALA N N 10 128.588 128.588 127.434 1.154 19205
1546 1 10 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.424 -0.011 19205
1547 1 10 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.763 -0.493 19205
1548 1 10 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.679 -0.564 19205
1549 1 10 . 1 1 10 10 ALA H H 10 8.163 8.163 8.362 -0.199 19205
1550 1 10 . 1 1 11 11 PRO HA H 11 4.331 4.331 5.065 -0.734 19205
1551 1 10 . 1 1 11 11 PRO C C 11 176.753 176.753 176.748 0.005 19205
1552 1 10 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.279 0.717 19205
1553 1 10 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.727 -0.282 19205
1554 1 10 . 1 1 12 12 THR N N 12 119.798 119.798 117.150 2.648 19205
1555 1 10 . 1 1 12 12 THR HA H 12 4.512 4.512 4.755 -0.243 19205
1556 1 10 . 1 1 12 12 THR C C 12 173.572 173.572 174.317 -0.745 19205
1557 1 10 . 1 1 12 12 THR CA C 12 62.099 62.099 61.515 0.584 19205
1558 1 10 . 1 1 12 12 THR CB C 12 71.060 71.060 70.641 0.419 19205
1559 1 10 . 1 1 12 12 THR H H 12 9.006 9.006 8.383 0.623 19205
1560 1 10 . 1 1 13 13 SER N N 13 123.494 123.494 122.727 0.767 19205
1561 1 10 . 1 1 13 13 SER HA H 13 4.539 4.539 4.085 0.454 19205
1562 1 10 . 1 1 13 13 SER C C 13 172.953 172.953 174.778 -1.825 19205
1563 1 10 . 1 1 13 13 SER CA C 13 58.421 58.421 57.888 0.533 19205
1564 1 10 . 1 1 13 13 SER CB C 13 63.844 63.844 62.977 0.867 19205
1565 1 10 . 1 1 13 13 SER H H 13 8.805 8.805 8.659 0.146 19205
1566 1 10 . 1 1 14 14 CYS N N 14 116.548 116.548 120.619 -4.071 19205
1567 1 10 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.705 0.235 19205
1568 1 10 . 1 1 14 14 CYS C C 14 172.746 172.746 173.501 -0.755 19205
1569 1 10 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.819 -3.013 19205
1570 1 10 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.199 16.406 19205
1571 1 10 . 1 1 14 14 CYS H H 14 8.265 8.265 8.228 0.037 19205
1572 1 10 . 1 1 15 15 SER N N 15 113.958 113.958 113.931 0.027 19205
1573 1 10 . 1 1 15 15 SER HA H 15 4.531 4.531 4.660 -0.129 19205
1574 1 10 . 1 1 15 15 SER C C 15 173.205 173.205 173.671 -0.466 19205
1575 1 10 . 1 1 15 15 SER CA C 15 58.826 58.826 58.605 0.221 19205
1576 1 10 . 1 1 15 15 SER CB C 15 65.097 65.097 65.204 -0.107 19205
1577 1 10 . 1 1 15 15 SER H H 15 9.497 9.497 9.090 0.407 19205
1578 1 10 . 1 1 16 16 GLN N N 16 118.516 118.516 118.643 -0.127 19205
1579 1 10 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.550 0.194 19205
1580 1 10 . 1 1 16 16 GLN C C 16 176.335 176.335 174.659 1.676 19205
1581 1 10 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.637 -0.696 19205
1582 1 10 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.311 0.012 19205
1583 1 10 . 1 1 16 16 GLN H H 16 8.049 8.049 7.750 0.299 19205
1584 1 10 . 1 1 17 17 ASP N N 17 124.190 124.190 121.836 2.354 19205
1585 1 10 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.439 -0.330 19205
1586 1 10 . 1 1 17 17 ASP C C 17 178.349 178.349 177.751 0.598 19205
1587 1 10 . 1 1 17 17 ASP CA C 17 58.947 58.947 56.930 2.017 19205
1588 1 10 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.474 -0.951 19205
1589 1 10 . 1 1 17 17 ASP H H 17 9.208 9.208 8.769 0.439 19205
1590 1 10 . 1 1 18 18 SER N N 18 112.259 112.259 111.480 0.779 19205
1591 1 10 . 1 1 18 18 SER HA H 18 4.228 4.228 4.266 -0.038 19205
1592 1 10 . 1 1 18 18 SER C C 18 175.037 175.037 174.801 0.236 19205
1593 1 10 . 1 1 18 18 SER CA C 18 60.093 60.093 59.655 0.438 19205
1594 1 10 . 1 1 18 18 SER CB C 18 62.134 62.134 62.846 -0.712 19205
1595 1 10 . 1 1 18 18 SER H H 18 8.371 8.371 8.113 0.258 19205
1596 1 10 . 1 1 19 19 ASP N N 19 120.750 120.750 121.348 -0.598 19205
1597 1 10 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.715 -0.124 19205
1598 1 10 . 1 1 19 19 ASP C C 19 175.958 175.958 176.362 -0.404 19205
1599 1 10 . 1 1 19 19 ASP CA C 19 55.885 55.885 54.839 1.046 19205
1600 1 10 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.188 0.834 19205
1601 1 10 . 1 1 19 19 ASP H H 19 7.697 7.697 7.789 -0.092 19205
1602 1 10 . 1 1 20 20 CYS N N 20 118.125 118.125 116.445 1.680 19205
1603 1 10 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.683 0.294 19205
1604 1 10 . 1 1 20 20 CYS C C 20 174.152 174.152 174.703 -0.551 19205
1605 1 10 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.023 -6.042 19205
1606 1 10 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.763 10.211 19205
1607 1 10 . 1 1 20 20 CYS H H 20 7.947 7.947 7.675 0.272 19205
1608 1 10 . 1 1 21 21 LEU N N 21 121.658 121.658 121.229 0.429 19205
1609 1 10 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.363 -0.196 19205
1610 1 10 . 1 1 21 21 LEU C C 21 176.589 176.589 177.523 -0.934 19205
1611 1 10 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.336 0.550 19205
1612 1 10 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.605 0.318 19205
1613 1 10 . 1 1 21 21 LEU H H 21 8.522 8.522 8.294 0.228 19205
1614 1 10 . 1 1 22 22 ALA N N 22 121.907 121.907 123.042 -1.135 19205
1615 1 10 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.137 -0.065 19205
1616 1 10 . 1 1 22 22 ALA C C 22 178.382 178.382 178.522 -0.140 19205
1617 1 10 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.602 0.363 19205
1618 1 10 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.169 -0.226 19205
1619 1 10 . 1 1 22 22 ALA H H 22 8.104 8.104 8.464 -0.360 19205
1620 1 10 . 1 1 23 23 GLY N N 23 110.790 110.790 111.989 -1.199 19205
1621 1 10 . 1 1 23 23 GLY C C 23 174.553 174.553 174.733 -0.180 19205
1622 1 10 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.775 -0.154 19205
1623 1 10 . 1 1 23 23 GLY H H 23 8.644 8.644 8.678 -0.034 19205
1624 1 10 . 1 1 24 24 CYS N N 24 119.431 119.431 120.175 -0.744 19205
1625 1 10 . 1 1 24 24 CYS HA H 24 4.850 4.850 4.935 -0.085 19205
1626 1 10 . 1 1 24 24 CYS C C 24 172.768 172.768 174.430 -1.662 19205
1627 1 10 . 1 1 24 24 CYS CA C 24 54.902 54.902 59.829 -4.927 19205
1628 1 10 . 1 1 24 24 CYS CB C 24 46.168 46.168 29.117 17.051 19205
1629 1 10 . 1 1 24 24 CYS H H 24 8.491 8.491 7.768 0.723 19205
1630 1 10 . 1 1 25 25 VAL N N 25 115.469 115.469 119.420 -3.951 19205
1631 1 10 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.802 -0.435 19205
1632 1 10 . 1 1 25 25 VAL C C 25 175.161 175.161 173.792 1.369 19205
1633 1 10 . 1 1 25 25 VAL CA C 25 59.327 59.327 58.691 0.636 19205
1634 1 10 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.585 0.450 19205
1635 1 10 . 1 1 25 25 VAL H H 25 9.324 9.324 9.003 0.321 19205
1636 1 10 . 1 1 26 26 CYS N N 26 123.350 123.350 121.703 1.647 19205
1637 1 10 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.777 0.033 19205
1638 1 10 . 1 1 26 26 CYS C C 26 174.891 174.891 176.040 -1.149 19205
1639 1 10 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.793 -3.594 19205
1640 1 10 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.547 12.713 19205
1641 1 10 . 1 1 26 26 CYS H H 26 9.346 9.346 8.843 0.503 19205
1642 1 10 . 1 1 27 27 GLY N N 27 117.742 117.742 116.714 1.028 19205
1643 1 10 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.115 1.343 19205
1644 1 10 . 1 1 27 27 GLY H H 27 8.259 8.259 8.874 -0.616 19205
1645 1 10 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.429 -0.059 19205
1646 1 10 . 1 1 28 28 PRO C C 28 176.720 176.720 176.851 -0.131 19205
1647 1 10 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.457 0.030 19205
1648 1 10 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.638 -0.085 19205
1649 1 10 . 1 1 29 29 ASN N N 29 114.300 114.300 116.465 -2.165 19205
1650 1 10 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.693 -0.044 19205
1651 1 10 . 1 1 29 29 ASN C C 29 175.490 175.490 176.532 -1.042 19205
1652 1 10 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.944 -0.609 19205
1653 1 10 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.519 0.047 19205
1654 1 10 . 1 1 29 29 ASN H H 29 8.061 8.061 8.227 -0.166 19205
1655 1 10 . 1 1 30 30 GLY N N 30 107.086 107.086 107.379 -0.293 19205
1656 1 10 . 1 1 30 30 GLY C C 30 173.758 173.758 172.982 0.776 19205
1657 1 10 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.312 1.000 19205
1658 1 10 . 1 1 30 30 GLY H H 30 8.294 8.294 8.025 0.269 19205
1659 1 10 . 1 1 31 31 PHE N N 31 115.129 115.129 118.272 -3.143 19205
1660 1 10 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.255 0.095 19205
1661 1 10 . 1 1 31 31 PHE C C 31 176.773 176.773 175.213 1.560 19205
1662 1 10 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.415 -0.005 19205
1663 1 10 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.842 -0.368 19205
1664 1 10 . 1 1 31 31 PHE H H 31 7.167 7.167 8.272 -1.105 19205
1665 1 10 . 1 1 32 32 CYS N N 32 123.123 123.123 121.121 2.002 19205
1666 1 10 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.151 -0.052 19205
1667 1 10 . 1 1 32 32 CYS C C 32 175.875 175.875 175.839 0.036 19205
1668 1 10 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.375 -3.945 19205
1669 1 10 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.543 15.544 19205
1670 1 10 . 1 1 32 32 CYS H H 32 8.708 8.708 8.958 -0.250 19205
1671 1 11 . 1 1 2 2 CYS N N 2 120.511 120.511 118.249 2.262 19205
1672 1 11 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.941 -0.068 19205
1673 1 11 . 1 1 2 2 CYS CA C 2 53.145 53.145 56.520 -3.375 19205
1674 1 11 . 1 1 2 2 CYS CB C 2 41.921 41.921 30.091 11.830 19205
1675 1 11 . 1 1 2 2 CYS H H 2 8.866 8.866 8.340 0.526 19205
1676 1 11 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.210 0.088 19205
1677 1 11 . 1 1 3 3 PRO C C 3 176.294 176.294 175.562 0.732 19205
1678 1 11 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.090 0.684 19205
1679 1 11 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.271 1.620 19205
1680 1 11 . 1 1 4 4 GLN N N 4 118.141 118.141 118.111 0.030 19205
1681 1 11 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.648 -0.754 19205
1682 1 11 . 1 1 4 4 GLN C C 4 176.143 176.143 174.924 1.219 19205
1683 1 11 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.093 1.080 19205
1684 1 11 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.328 -0.760 19205
1685 1 11 . 1 1 4 4 GLN H H 4 7.648 7.648 8.261 -0.613 19205
1686 1 11 . 1 1 5 5 GLY N N 5 108.656 108.656 106.609 2.047 19205
1687 1 11 . 1 1 5 5 GLY C C 5 173.733 173.733 173.619 0.114 19205
1688 1 11 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.541 -0.284 19205
1689 1 11 . 1 1 5 5 GLY H H 5 7.759 7.759 7.803 -0.044 19205
1690 1 11 . 1 1 6 6 ARG N N 6 119.446 119.446 120.055 -0.609 19205
1691 1 11 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.881 -0.492 19205
1692 1 11 . 1 1 6 6 ARG C C 6 176.780 176.780 177.538 -0.758 19205
1693 1 11 . 1 1 6 6 ARG CA C 6 55.538 55.538 54.002 1.536 19205
1694 1 11 . 1 1 6 6 ARG CB C 6 31.543 31.543 32.667 -1.124 19205
1695 1 11 . 1 1 6 6 ARG H H 6 7.865 7.865 8.079 -0.214 19205
1696 1 11 . 1 1 7 7 GLY N N 7 109.318 109.318 110.931 -1.613 19205
1697 1 11 . 1 1 7 7 GLY C C 7 174.275 174.275 174.418 -0.143 19205
1698 1 11 . 1 1 7 7 GLY CA C 7 46.020 46.020 47.214 -1.194 19205
1699 1 11 . 1 1 7 7 GLY H H 7 8.529 8.529 8.684 -0.155 19205
1700 1 11 . 1 1 8 8 ASP N N 8 121.036 121.036 119.557 1.479 19205
1701 1 11 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.679 -0.124 19205
1702 1 11 . 1 1 8 8 ASP C C 8 175.562 175.562 174.745 0.817 19205
1703 1 11 . 1 1 8 8 ASP CA C 8 53.748 53.748 53.973 -0.225 19205
1704 1 11 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.316 -0.257 19205
1705 1 11 . 1 1 8 8 ASP H H 8 8.414 8.414 8.700 -0.286 19205
1706 1 11 . 1 1 9 9 TRP N N 9 121.704 121.704 122.612 -0.908 19205
1707 1 11 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.811 -0.318 19205
1708 1 11 . 1 1 9 9 TRP C C 9 175.498 175.498 174.779 0.719 19205
1709 1 11 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.862 1.232 19205
1710 1 11 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.600 0.209 19205
1711 1 11 . 1 1 9 9 TRP H H 9 7.814 7.814 8.139 -0.325 19205
1712 1 11 . 1 1 10 10 ALA N N 10 128.588 128.588 127.219 1.369 19205
1713 1 11 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.396 0.017 19205
1714 1 11 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.772 -0.502 19205
1715 1 11 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.515 -0.400 19205
1716 1 11 . 1 1 10 10 ALA H H 10 8.163 8.163 8.298 -0.135 19205
1717 1 11 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.856 -0.525 19205
1718 1 11 . 1 1 11 11 PRO C C 11 176.753 176.753 176.762 -0.009 19205
1719 1 11 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.106 0.890 19205
1720 1 11 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.546 -0.101 19205
1721 1 11 . 1 1 12 12 THR N N 12 119.798 119.798 117.602 2.196 19205
1722 1 11 . 1 1 12 12 THR HA H 12 4.512 4.512 4.734 -0.222 19205
1723 1 11 . 1 1 12 12 THR C C 12 173.572 173.572 174.655 -1.083 19205
1724 1 11 . 1 1 12 12 THR CA C 12 62.099 62.099 61.966 0.133 19205
1725 1 11 . 1 1 12 12 THR CB C 12 71.060 71.060 70.301 0.759 19205
1726 1 11 . 1 1 12 12 THR H H 12 9.006 9.006 8.391 0.615 19205
1727 1 11 . 1 1 13 13 SER N N 13 123.494 123.494 122.241 1.253 19205
1728 1 11 . 1 1 13 13 SER HA H 13 4.539 4.539 4.473 0.066 19205
1729 1 11 . 1 1 13 13 SER C C 13 172.953 172.953 174.576 -1.623 19205
1730 1 11 . 1 1 13 13 SER CA C 13 58.421 58.421 58.301 0.120 19205
1731 1 11 . 1 1 13 13 SER CB C 13 63.844 63.844 63.045 0.799 19205
1732 1 11 . 1 1 13 13 SER H H 13 8.805 8.805 8.753 0.052 19205
1733 1 11 . 1 1 14 14 CYS N N 14 116.548 116.548 120.052 -3.504 19205
1734 1 11 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.797 0.143 19205
1735 1 11 . 1 1 14 14 CYS C C 14 172.746 172.746 173.737 -0.991 19205
1736 1 11 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.793 -2.987 19205
1737 1 11 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.782 15.823 19205
1738 1 11 . 1 1 14 14 CYS H H 14 8.265 8.265 8.317 -0.052 19205
1739 1 11 . 1 1 15 15 SER N N 15 113.958 113.958 114.151 -0.193 19205
1740 1 11 . 1 1 15 15 SER HA H 15 4.531 4.531 4.669 -0.138 19205
1741 1 11 . 1 1 15 15 SER C C 15 173.205 173.205 173.805 -0.600 19205
1742 1 11 . 1 1 15 15 SER CA C 15 58.826 58.826 58.646 0.180 19205
1743 1 11 . 1 1 15 15 SER CB C 15 65.097 65.097 65.172 -0.075 19205
1744 1 11 . 1 1 15 15 SER H H 15 9.497 9.497 9.286 0.211 19205
1745 1 11 . 1 1 16 16 GLN N N 16 118.516 118.516 118.758 -0.242 19205
1746 1 11 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.706 0.038 19205
1747 1 11 . 1 1 16 16 GLN C C 16 176.335 176.335 174.559 1.776 19205
1748 1 11 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.632 -0.691 19205
1749 1 11 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.049 0.274 19205
1750 1 11 . 1 1 16 16 GLN H H 16 8.049 8.049 8.070 -0.021 19205
1751 1 11 . 1 1 17 17 ASP N N 17 124.190 124.190 121.985 2.205 19205
1752 1 11 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.538 -0.429 19205
1753 1 11 . 1 1 17 17 ASP C C 17 178.349 178.349 178.012 0.337 19205
1754 1 11 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.183 1.764 19205
1755 1 11 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.461 -0.938 19205
1756 1 11 . 1 1 17 17 ASP H H 17 9.208 9.208 8.830 0.378 19205
1757 1 11 . 1 1 18 18 SER N N 18 112.259 112.259 112.560 -0.301 19205
1758 1 11 . 1 1 18 18 SER HA H 18 4.228 4.228 4.249 -0.021 19205
1759 1 11 . 1 1 18 18 SER C C 18 175.037 175.037 175.305 -0.268 19205
1760 1 11 . 1 1 18 18 SER CA C 18 60.093 60.093 59.628 0.465 19205
1761 1 11 . 1 1 18 18 SER CB C 18 62.134 62.134 62.969 -0.836 19205
1762 1 11 . 1 1 18 18 SER H H 18 8.371 8.371 8.286 0.085 19205
1763 1 11 . 1 1 19 19 ASP N N 19 120.750 120.750 120.369 0.381 19205
1764 1 11 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.641 -0.050 19205
1765 1 11 . 1 1 19 19 ASP C C 19 175.958 175.958 176.375 -0.417 19205
1766 1 11 . 1 1 19 19 ASP CA C 19 55.885 55.885 55.092 0.793 19205
1767 1 11 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.096 0.926 19205
1768 1 11 . 1 1 19 19 ASP H H 19 7.697 7.697 7.697 0.000 19205
1769 1 11 . 1 1 20 20 CYS N N 20 118.125 118.125 116.446 1.679 19205
1770 1 11 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.662 0.315 19205
1771 1 11 . 1 1 20 20 CYS C C 20 174.152 174.152 174.999 -0.847 19205
1772 1 11 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.235 -6.254 19205
1773 1 11 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.600 10.374 19205
1774 1 11 . 1 1 20 20 CYS H H 20 7.947 7.947 7.615 0.332 19205
1775 1 11 . 1 1 21 21 LEU N N 21 121.658 121.658 121.312 0.346 19205
1776 1 11 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.338 -0.171 19205
1777 1 11 . 1 1 21 21 LEU C C 21 176.589 176.589 177.583 -0.994 19205
1778 1 11 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.550 0.336 19205
1779 1 11 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.573 0.350 19205
1780 1 11 . 1 1 21 21 LEU H H 21 8.522 8.522 8.412 0.110 19205
1781 1 11 . 1 1 22 22 ALA N N 22 121.907 121.907 123.040 -1.133 19205
1782 1 11 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.150 -0.078 19205
1783 1 11 . 1 1 22 22 ALA C C 22 178.382 178.382 178.560 -0.178 19205
1784 1 11 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.620 0.346 19205
1785 1 11 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.246 -0.302 19205
1786 1 11 . 1 1 22 22 ALA H H 22 8.104 8.104 8.439 -0.335 19205
1787 1 11 . 1 1 23 23 GLY N N 23 110.790 110.790 112.374 -1.584 19205
1788 1 11 . 1 1 23 23 GLY C C 23 174.553 174.553 174.822 -0.269 19205
1789 1 11 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.746 -0.125 19205
1790 1 11 . 1 1 23 23 GLY H H 23 8.644 8.644 8.732 -0.088 19205
1791 1 11 . 1 1 24 24 CYS N N 24 119.431 119.431 119.022 0.409 19205
1792 1 11 . 1 1 24 24 CYS HA H 24 4.850 4.850 4.835 0.015 19205
1793 1 11 . 1 1 24 24 CYS C C 24 172.768 172.768 174.375 -1.607 19205
1794 1 11 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.719 -3.817 19205
1795 1 11 . 1 1 24 24 CYS CB C 24 46.168 46.168 29.215 16.953 19205
1796 1 11 . 1 1 24 24 CYS H H 24 8.491 8.491 7.708 0.783 19205
1797 1 11 . 1 1 25 25 VAL N N 25 115.469 115.469 115.384 0.085 19205
1798 1 11 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.663 -0.296 19205
1799 1 11 . 1 1 25 25 VAL C C 25 175.161 175.161 173.948 1.213 19205
1800 1 11 . 1 1 25 25 VAL CA C 25 59.327 59.327 59.304 0.023 19205
1801 1 11 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.843 0.192 19205
1802 1 11 . 1 1 25 25 VAL H H 25 9.324 9.324 8.840 0.484 19205
1803 1 11 . 1 1 26 26 CYS N N 26 123.350 123.350 121.406 1.944 19205
1804 1 11 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.704 0.106 19205
1805 1 11 . 1 1 26 26 CYS C C 26 174.891 174.891 176.194 -1.303 19205
1806 1 11 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.898 -3.699 19205
1807 1 11 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.744 12.515 19205
1808 1 11 . 1 1 26 26 CYS H H 26 9.346 9.346 8.888 0.458 19205
1809 1 11 . 1 1 27 27 GLY N N 27 117.742 117.742 116.576 1.166 19205
1810 1 11 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.108 1.350 19205
1811 1 11 . 1 1 27 27 GLY H H 27 8.259 8.259 8.905 -0.646 19205
1812 1 11 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.426 -0.056 19205
1813 1 11 . 1 1 28 28 PRO C C 28 176.720 176.720 176.796 -0.076 19205
1814 1 11 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.438 0.049 19205
1815 1 11 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.675 -0.122 19205
1816 1 11 . 1 1 29 29 ASN N N 29 114.300 114.300 116.331 -2.031 19205
1817 1 11 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.688 -0.039 19205
1818 1 11 . 1 1 29 29 ASN C C 29 175.490 175.490 176.386 -0.896 19205
1819 1 11 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.895 -0.560 19205
1820 1 11 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.724 -0.158 19205
1821 1 11 . 1 1 29 29 ASN H H 29 8.061 8.061 8.232 -0.171 19205
1822 1 11 . 1 1 30 30 GLY N N 30 107.086 107.086 107.152 -0.066 19205
1823 1 11 . 1 1 30 30 GLY C C 30 173.758 173.758 172.873 0.885 19205
1824 1 11 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.050 1.262 19205
1825 1 11 . 1 1 30 30 GLY H H 30 8.294 8.294 7.911 0.383 19205
1826 1 11 . 1 1 31 31 PHE N N 31 115.129 115.129 118.761 -3.632 19205
1827 1 11 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.365 -0.015 19205
1828 1 11 . 1 1 31 31 PHE C C 31 176.773 176.773 175.526 1.247 19205
1829 1 11 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.113 0.297 19205
1830 1 11 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.438 0.036 19205
1831 1 11 . 1 1 31 31 PHE H H 31 7.167 7.167 8.313 -1.146 19205
1832 1 11 . 1 1 32 32 CYS N N 32 123.123 123.123 121.171 1.952 19205
1833 1 11 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.011 0.088 19205
1834 1 11 . 1 1 32 32 CYS C C 32 175.875 175.875 175.861 0.014 19205
1835 1 11 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.518 -4.088 19205
1836 1 11 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.434 15.653 19205
1837 1 11 . 1 1 32 32 CYS H H 32 8.708 8.708 8.977 -0.269 19205
1838 1 12 . 1 1 2 2 CYS N N 2 120.511 120.511 117.472 3.039 19205
1839 1 12 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.984 -0.111 19205
1840 1 12 . 1 1 2 2 CYS CA C 2 53.145 53.145 57.029 -3.884 19205
1841 1 12 . 1 1 2 2 CYS CB C 2 41.921 41.921 28.784 13.137 19205
1842 1 12 . 1 1 2 2 CYS H H 2 8.866 8.866 8.194 0.672 19205
1843 1 12 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.235 0.063 19205
1844 1 12 . 1 1 3 3 PRO C C 3 176.294 176.294 175.787 0.507 19205
1845 1 12 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.243 0.531 19205
1846 1 12 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.551 1.340 19205
1847 1 12 . 1 1 4 4 GLN N N 4 118.141 118.141 118.596 -0.455 19205
1848 1 12 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.675 -0.781 19205
1849 1 12 . 1 1 4 4 GLN C C 4 176.143 176.143 175.328 0.815 19205
1850 1 12 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.329 0.844 19205
1851 1 12 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.401 -0.834 19205
1852 1 12 . 1 1 4 4 GLN H H 4 7.648 7.648 8.187 -0.539 19205
1853 1 12 . 1 1 5 5 GLY N N 5 108.656 108.656 106.940 1.716 19205
1854 1 12 . 1 1 5 5 GLY C C 5 173.733 173.733 174.130 -0.397 19205
1855 1 12 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.158 0.098 19205
1856 1 12 . 1 1 5 5 GLY H H 5 7.759 7.759 8.008 -0.249 19205
1857 1 12 . 1 1 6 6 ARG N N 6 119.446 119.446 120.286 -0.840 19205
1858 1 12 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.570 -0.181 19205
1859 1 12 . 1 1 6 6 ARG C C 6 176.780 176.780 178.216 -1.436 19205
1860 1 12 . 1 1 6 6 ARG CA C 6 55.538 55.538 55.134 0.404 19205
1861 1 12 . 1 1 6 6 ARG CB C 6 31.543 31.543 31.346 0.197 19205
1862 1 12 . 1 1 6 6 ARG H H 6 7.865 7.865 7.602 0.263 19205
1863 1 12 . 1 1 7 7 GLY N N 7 109.318 109.318 109.630 -0.312 19205
1864 1 12 . 1 1 7 7 GLY C C 7 174.275 174.275 174.920 -0.645 19205
1865 1 12 . 1 1 7 7 GLY CA C 7 46.020 46.020 47.001 -0.981 19205
1866 1 12 . 1 1 7 7 GLY H H 7 8.529 8.529 8.673 -0.144 19205
1867 1 12 . 1 1 8 8 ASP N N 8 121.036 121.036 120.543 0.493 19205
1868 1 12 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.743 -0.188 19205
1869 1 12 . 1 1 8 8 ASP C C 8 175.562 175.562 174.859 0.703 19205
1870 1 12 . 1 1 8 8 ASP CA C 8 53.748 53.748 53.241 0.507 19205
1871 1 12 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.753 -0.694 19205
1872 1 12 . 1 1 8 8 ASP H H 8 8.414 8.414 8.636 -0.222 19205
1873 1 12 . 1 1 9 9 TRP N N 9 121.704 121.704 122.616 -0.912 19205
1874 1 12 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.788 -0.295 19205
1875 1 12 . 1 1 9 9 TRP C C 9 175.498 175.498 174.786 0.712 19205
1876 1 12 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.829 1.265 19205
1877 1 12 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.520 0.289 19205
1878 1 12 . 1 1 9 9 TRP H H 9 7.814 7.814 7.586 0.228 19205
1879 1 12 . 1 1 10 10 ALA N N 10 128.588 128.588 127.433 1.155 19205
1880 1 12 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.381 0.032 19205
1881 1 12 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.748 -0.478 19205
1882 1 12 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.491 -0.376 19205
1883 1 12 . 1 1 10 10 ALA H H 10 8.163 8.163 8.115 0.048 19205
1884 1 12 . 1 1 11 11 PRO HA H 11 4.331 4.331 5.023 -0.692 19205
1885 1 12 . 1 1 11 11 PRO C C 11 176.753 176.753 176.684 0.069 19205
1886 1 12 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.050 0.946 19205
1887 1 12 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.298 0.147 19205
1888 1 12 . 1 1 12 12 THR N N 12 119.798 119.798 117.516 2.282 19205
1889 1 12 . 1 1 12 12 THR HA H 12 4.512 4.512 4.747 -0.235 19205
1890 1 12 . 1 1 12 12 THR C C 12 173.572 173.572 174.517 -0.945 19205
1891 1 12 . 1 1 12 12 THR CA C 12 62.099 62.099 61.661 0.438 19205
1892 1 12 . 1 1 12 12 THR CB C 12 71.060 71.060 70.072 0.988 19205
1893 1 12 . 1 1 12 12 THR H H 12 9.006 9.006 8.403 0.603 19205
1894 1 12 . 1 1 13 13 SER N N 13 123.494 123.494 122.253 1.241 19205
1895 1 12 . 1 1 13 13 SER HA H 13 4.539 4.539 4.631 -0.092 19205
1896 1 12 . 1 1 13 13 SER C C 13 172.953 172.953 174.389 -1.436 19205
1897 1 12 . 1 1 13 13 SER CA C 13 58.421 58.421 58.453 -0.032 19205
1898 1 12 . 1 1 13 13 SER CB C 13 63.844 63.844 63.273 0.571 19205
1899 1 12 . 1 1 13 13 SER H H 13 8.805 8.805 8.775 0.030 19205
1900 1 12 . 1 1 14 14 CYS N N 14 116.548 116.548 119.534 -2.986 19205
1901 1 12 . 1 1 14 14 CYS HA H 14 4.940 4.940 5.004 -0.064 19205
1902 1 12 . 1 1 14 14 CYS C C 14 172.746 172.746 173.447 -0.701 19205
1903 1 12 . 1 1 14 14 CYS CA C 14 53.806 53.806 57.202 -3.396 19205
1904 1 12 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.370 16.235 19205
1905 1 12 . 1 1 14 14 CYS H H 14 8.265 8.265 8.714 -0.449 19205
1906 1 12 . 1 1 15 15 SER N N 15 113.958 113.958 114.064 -0.106 19205
1907 1 12 . 1 1 15 15 SER HA H 15 4.531 4.531 4.609 -0.078 19205
1908 1 12 . 1 1 15 15 SER C C 15 173.205 173.205 173.811 -0.606 19205
1909 1 12 . 1 1 15 15 SER CA C 15 58.826 58.826 58.455 0.371 19205
1910 1 12 . 1 1 15 15 SER CB C 15 65.097 65.097 64.734 0.363 19205
1911 1 12 . 1 1 15 15 SER H H 15 9.497 9.497 9.175 0.322 19205
1912 1 12 . 1 1 16 16 GLN N N 16 118.516 118.516 119.211 -0.695 19205
1913 1 12 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.722 0.022 19205
1914 1 12 . 1 1 16 16 GLN C C 16 176.335 176.335 174.537 1.798 19205
1915 1 12 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.667 -0.726 19205
1916 1 12 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.117 0.206 19205
1917 1 12 . 1 1 16 16 GLN H H 16 8.049 8.049 7.779 0.270 19205
1918 1 12 . 1 1 17 17 ASP N N 17 124.190 124.190 121.788 2.402 19205
1919 1 12 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.447 -0.338 19205
1920 1 12 . 1 1 17 17 ASP C C 17 178.349 178.349 177.906 0.443 19205
1921 1 12 . 1 1 17 17 ASP CA C 17 58.947 58.947 56.820 2.127 19205
1922 1 12 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.478 -0.955 19205
1923 1 12 . 1 1 17 17 ASP H H 17 9.208 9.208 8.859 0.349 19205
1924 1 12 . 1 1 18 18 SER N N 18 112.259 112.259 111.432 0.827 19205
1925 1 12 . 1 1 18 18 SER HA H 18 4.228 4.228 4.281 -0.053 19205
1926 1 12 . 1 1 18 18 SER C C 18 175.037 175.037 174.914 0.123 19205
1927 1 12 . 1 1 18 18 SER CA C 18 60.093 60.093 59.656 0.437 19205
1928 1 12 . 1 1 18 18 SER CB C 18 62.134 62.134 62.949 -0.815 19205
1929 1 12 . 1 1 18 18 SER H H 18 8.371 8.371 8.047 0.324 19205
1930 1 12 . 1 1 19 19 ASP N N 19 120.750 120.750 121.691 -0.941 19205
1931 1 12 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.700 -0.109 19205
1932 1 12 . 1 1 19 19 ASP C C 19 175.958 175.958 176.437 -0.479 19205
1933 1 12 . 1 1 19 19 ASP CA C 19 55.885 55.885 55.041 0.844 19205
1934 1 12 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.225 0.797 19205
1935 1 12 . 1 1 19 19 ASP H H 19 7.697 7.697 7.815 -0.118 19205
1936 1 12 . 1 1 20 20 CYS N N 20 118.125 118.125 116.500 1.625 19205
1937 1 12 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.693 0.284 19205
1938 1 12 . 1 1 20 20 CYS C C 20 174.152 174.152 174.829 -0.677 19205
1939 1 12 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.249 -6.268 19205
1940 1 12 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.816 10.158 19205
1941 1 12 . 1 1 20 20 CYS H H 20 7.947 7.947 7.547 0.400 19205
1942 1 12 . 1 1 21 21 LEU N N 21 121.658 121.658 120.968 0.690 19205
1943 1 12 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.384 -0.217 19205
1944 1 12 . 1 1 21 21 LEU C C 21 176.589 176.589 177.514 -0.925 19205
1945 1 12 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.454 0.432 19205
1946 1 12 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.733 0.191 19205
1947 1 12 . 1 1 21 21 LEU H H 21 8.522 8.522 8.493 0.029 19205
1948 1 12 . 1 1 22 22 ALA N N 22 121.907 121.907 123.248 -1.341 19205
1949 1 12 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.156 -0.084 19205
1950 1 12 . 1 1 22 22 ALA C C 22 178.382 178.382 178.453 -0.071 19205
1951 1 12 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.435 0.530 19205
1952 1 12 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.084 -0.140 19205
1953 1 12 . 1 1 22 22 ALA H H 22 8.104 8.104 8.473 -0.369 19205
1954 1 12 . 1 1 23 23 GLY N N 23 110.790 110.790 112.438 -1.648 19205
1955 1 12 . 1 1 23 23 GLY C C 23 174.553 174.553 174.578 -0.025 19205
1956 1 12 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.662 -0.041 19205
1957 1 12 . 1 1 23 23 GLY H H 23 8.644 8.644 8.789 -0.145 19205
1958 1 12 . 1 1 24 24 CYS N N 24 119.431 119.431 119.307 0.124 19205
1959 1 12 . 1 1 24 24 CYS HA H 24 4.850 4.850 5.025 -0.175 19205
1960 1 12 . 1 1 24 24 CYS C C 24 172.768 172.768 174.005 -1.237 19205
1961 1 12 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.098 -3.196 19205
1962 1 12 . 1 1 24 24 CYS CB C 24 46.168 46.168 29.741 16.427 19205
1963 1 12 . 1 1 24 24 CYS H H 24 8.491 8.491 7.817 0.674 19205
1964 1 12 . 1 1 25 25 VAL N N 25 115.469 115.469 115.808 -0.339 19205
1965 1 12 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.587 -0.220 19205
1966 1 12 . 1 1 25 25 VAL C C 25 175.161 175.161 174.003 1.158 19205
1967 1 12 . 1 1 25 25 VAL CA C 25 59.327 59.327 58.610 0.717 19205
1968 1 12 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.526 0.509 19205
1969 1 12 . 1 1 25 25 VAL H H 25 9.324 9.324 9.009 0.315 19205
1970 1 12 . 1 1 26 26 CYS N N 26 123.350 123.350 121.030 2.320 19205
1971 1 12 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.866 -0.056 19205
1972 1 12 . 1 1 26 26 CYS C C 26 174.891 174.891 175.867 -0.976 19205
1973 1 12 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.745 -3.546 19205
1974 1 12 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.742 12.518 19205
1975 1 12 . 1 1 26 26 CYS H H 26 9.346 9.346 8.933 0.413 19205
1976 1 12 . 1 1 27 27 GLY N N 27 117.742 117.742 116.709 1.033 19205
1977 1 12 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.110 1.348 19205
1978 1 12 . 1 1 27 27 GLY H H 27 8.259 8.259 8.924 -0.665 19205
1979 1 12 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.431 -0.061 19205
1980 1 12 . 1 1 28 28 PRO C C 28 176.720 176.720 176.801 -0.081 19205
1981 1 12 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.417 0.069 19205
1982 1 12 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.655 -0.102 19205
1983 1 12 . 1 1 29 29 ASN N N 29 114.300 114.300 116.364 -2.064 19205
1984 1 12 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.662 -0.013 19205
1985 1 12 . 1 1 29 29 ASN C C 29 175.490 175.490 176.385 -0.895 19205
1986 1 12 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.885 -0.550 19205
1987 1 12 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.538 0.028 19205
1988 1 12 . 1 1 29 29 ASN H H 29 8.061 8.061 8.207 -0.146 19205
1989 1 12 . 1 1 30 30 GLY N N 30 107.086 107.086 107.039 0.047 19205
1990 1 12 . 1 1 30 30 GLY C C 30 173.758 173.758 172.865 0.893 19205
1991 1 12 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.176 1.136 19205
1992 1 12 . 1 1 30 30 GLY H H 30 8.294 8.294 7.944 0.350 19205
1993 1 12 . 1 1 31 31 PHE N N 31 115.129 115.129 118.650 -3.521 19205
1994 1 12 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.355 -0.005 19205
1995 1 12 . 1 1 31 31 PHE C C 31 176.773 176.773 175.354 1.419 19205
1996 1 12 . 1 1 31 31 PHE CA C 31 56.410 56.410 55.782 0.628 19205
1997 1 12 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.325 0.149 19205
1998 1 12 . 1 1 31 31 PHE H H 31 7.167 7.167 8.212 -1.045 19205
1999 1 12 . 1 1 32 32 CYS N N 32 123.123 123.123 120.777 2.346 19205
2000 1 12 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.138 -0.039 19205
2001 1 12 . 1 1 32 32 CYS C C 32 175.875 175.875 175.830 0.045 19205
2002 1 12 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.382 -3.952 19205
2003 1 12 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.659 15.428 19205
2004 1 12 . 1 1 32 32 CYS H H 32 8.708 8.708 9.012 -0.304 19205
2005 1 13 . 1 1 2 2 CYS N N 2 120.511 120.511 117.205 3.306 19205
2006 1 13 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.991 -0.118 19205
2007 1 13 . 1 1 2 2 CYS CA C 2 53.145 53.145 57.230 -4.085 19205
2008 1 13 . 1 1 2 2 CYS CB C 2 41.921 41.921 28.591 13.330 19205
2009 1 13 . 1 1 2 2 CYS H H 2 8.866 8.866 8.178 0.688 19205
2010 1 13 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.246 0.052 19205
2011 1 13 . 1 1 3 3 PRO C C 3 176.294 176.294 175.854 0.440 19205
2012 1 13 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.467 0.307 19205
2013 1 13 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.663 1.228 19205
2014 1 13 . 1 1 4 4 GLN N N 4 118.141 118.141 116.885 1.256 19205
2015 1 13 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.664 -0.770 19205
2016 1 13 . 1 1 4 4 GLN C C 4 176.143 176.143 175.450 0.693 19205
2017 1 13 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.301 0.872 19205
2018 1 13 . 1 1 4 4 GLN CB C 4 29.568 29.568 31.078 -1.510 19205
2019 1 13 . 1 1 4 4 GLN H H 4 7.648 7.648 8.195 -0.547 19205
2020 1 13 . 1 1 5 5 GLY N N 5 108.656 108.656 106.996 1.660 19205
2021 1 13 . 1 1 5 5 GLY C C 5 173.733 173.733 173.401 0.332 19205
2022 1 13 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.796 -0.539 19205
2023 1 13 . 1 1 5 5 GLY H H 5 7.759 7.759 7.560 0.199 19205
2024 1 13 . 1 1 6 6 ARG N N 6 119.446 119.446 120.011 -0.565 19205
2025 1 13 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.819 -0.430 19205
2026 1 13 . 1 1 6 6 ARG C C 6 176.780 176.780 177.374 -0.594 19205
2027 1 13 . 1 1 6 6 ARG CA C 6 55.538 55.538 54.399 1.139 19205
2028 1 13 . 1 1 6 6 ARG CB C 6 31.543 31.543 32.755 -1.212 19205
2029 1 13 . 1 1 6 6 ARG H H 6 7.865 7.865 8.248 -0.383 19205
2030 1 13 . 1 1 7 7 GLY N N 7 109.318 109.318 110.080 -0.762 19205
2031 1 13 . 1 1 7 7 GLY C C 7 174.275 174.275 174.792 -0.517 19205
2032 1 13 . 1 1 7 7 GLY CA C 7 46.020 46.020 47.494 -1.474 19205
2033 1 13 . 1 1 7 7 GLY H H 7 8.529 8.529 8.650 -0.121 19205
2034 1 13 . 1 1 8 8 ASP N N 8 121.036 121.036 120.559 0.477 19205
2035 1 13 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.792 -0.237 19205
2036 1 13 . 1 1 8 8 ASP C C 8 175.562 175.562 174.652 0.910 19205
2037 1 13 . 1 1 8 8 ASP CA C 8 53.748 53.748 53.289 0.459 19205
2038 1 13 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.714 -0.655 19205
2039 1 13 . 1 1 8 8 ASP H H 8 8.414 8.414 8.613 -0.199 19205
2040 1 13 . 1 1 9 9 TRP N N 9 121.704 121.704 122.714 -1.010 19205
2041 1 13 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.845 -0.352 19205
2042 1 13 . 1 1 9 9 TRP C C 9 175.498 175.498 174.788 0.710 19205
2043 1 13 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.922 1.172 19205
2044 1 13 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.760 0.049 19205
2045 1 13 . 1 1 9 9 TRP H H 9 7.814 7.814 8.393 -0.579 19205
2046 1 13 . 1 1 10 10 ALA N N 10 128.588 128.588 127.174 1.414 19205
2047 1 13 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.420 -0.007 19205
2048 1 13 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.615 -0.345 19205
2049 1 13 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.607 -0.492 19205
2050 1 13 . 1 1 10 10 ALA H H 10 8.163 8.163 8.188 -0.025 19205
2051 1 13 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.982 -0.651 19205
2052 1 13 . 1 1 11 11 PRO C C 11 176.753 176.753 176.805 -0.052 19205
2053 1 13 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.126 0.870 19205
2054 1 13 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.629 -0.184 19205
2055 1 13 . 1 1 12 12 THR N N 12 119.798 119.798 117.319 2.479 19205
2056 1 13 . 1 1 12 12 THR HA H 12 4.512 4.512 4.725 -0.213 19205
2057 1 13 . 1 1 12 12 THR C C 12 173.572 173.572 174.666 -1.094 19205
2058 1 13 . 1 1 12 12 THR CA C 12 62.099 62.099 61.974 0.125 19205
2059 1 13 . 1 1 12 12 THR CB C 12 71.060 71.060 70.479 0.581 19205
2060 1 13 . 1 1 12 12 THR H H 12 9.006 9.006 8.385 0.621 19205
2061 1 13 . 1 1 13 13 SER N N 13 123.494 123.494 122.159 1.335 19205
2062 1 13 . 1 1 13 13 SER HA H 13 4.539 4.539 4.462 0.077 19205
2063 1 13 . 1 1 13 13 SER C C 13 172.953 172.953 174.589 -1.636 19205
2064 1 13 . 1 1 13 13 SER CA C 13 58.421 58.421 58.402 0.019 19205
2065 1 13 . 1 1 13 13 SER CB C 13 63.844 63.844 62.835 1.009 19205
2066 1 13 . 1 1 13 13 SER H H 13 8.805 8.805 8.722 0.083 19205
2067 1 13 . 1 1 14 14 CYS N N 14 116.548 116.548 120.911 -4.363 19205
2068 1 13 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.933 0.007 19205
2069 1 13 . 1 1 14 14 CYS C C 14 172.746 172.746 173.702 -0.956 19205
2070 1 13 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.796 -2.990 19205
2071 1 13 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.626 15.979 19205
2072 1 13 . 1 1 14 14 CYS H H 14 8.265 8.265 8.539 -0.274 19205
2073 1 13 . 1 1 15 15 SER N N 15 113.958 113.958 113.913 0.045 19205
2074 1 13 . 1 1 15 15 SER HA H 15 4.531 4.531 4.603 -0.072 19205
2075 1 13 . 1 1 15 15 SER C C 15 173.205 173.205 173.772 -0.567 19205
2076 1 13 . 1 1 15 15 SER CA C 15 58.826 58.826 58.535 0.291 19205
2077 1 13 . 1 1 15 15 SER CB C 15 65.097 65.097 64.932 0.165 19205
2078 1 13 . 1 1 15 15 SER H H 15 9.497 9.497 9.123 0.374 19205
2079 1 13 . 1 1 16 16 GLN N N 16 118.516 118.516 119.324 -0.808 19205
2080 1 13 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.604 0.140 19205
2081 1 13 . 1 1 16 16 GLN C C 16 176.335 176.335 174.899 1.436 19205
2082 1 13 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.573 -0.632 19205
2083 1 13 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.624 -0.301 19205
2084 1 13 . 1 1 16 16 GLN H H 16 8.049 8.049 7.726 0.323 19205
2085 1 13 . 1 1 17 17 ASP N N 17 124.190 124.190 121.766 2.424 19205
2086 1 13 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.469 -0.360 19205
2087 1 13 . 1 1 17 17 ASP C C 17 178.349 178.349 177.854 0.495 19205
2088 1 13 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.153 1.794 19205
2089 1 13 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.414 -0.891 19205
2090 1 13 . 1 1 17 17 ASP H H 17 9.208 9.208 8.676 0.532 19205
2091 1 13 . 1 1 18 18 SER N N 18 112.259 112.259 112.135 0.124 19205
2092 1 13 . 1 1 18 18 SER HA H 18 4.228 4.228 4.281 -0.053 19205
2093 1 13 . 1 1 18 18 SER C C 18 175.037 175.037 175.187 -0.150 19205
2094 1 13 . 1 1 18 18 SER CA C 18 60.093 60.093 59.199 0.894 19205
2095 1 13 . 1 1 18 18 SER CB C 18 62.134 62.134 62.961 -0.827 19205
2096 1 13 . 1 1 18 18 SER H H 18 8.371 8.371 8.251 0.120 19205
2097 1 13 . 1 1 19 19 ASP N N 19 120.750 120.750 120.573 0.177 19205
2098 1 13 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.663 -0.072 19205
2099 1 13 . 1 1 19 19 ASP C C 19 175.958 175.958 176.238 -0.280 19205
2100 1 13 . 1 1 19 19 ASP CA C 19 55.885 55.885 54.998 0.887 19205
2101 1 13 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.148 0.874 19205
2102 1 13 . 1 1 19 19 ASP H H 19 7.697 7.697 7.736 -0.039 19205
2103 1 13 . 1 1 20 20 CYS N N 20 118.125 118.125 116.607 1.518 19205
2104 1 13 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.699 0.278 19205
2105 1 13 . 1 1 20 20 CYS C C 20 174.152 174.152 174.735 -0.583 19205
2106 1 13 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.061 -6.080 19205
2107 1 13 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.735 10.239 19205
2108 1 13 . 1 1 20 20 CYS H H 20 7.947 7.947 7.559 0.388 19205
2109 1 13 . 1 1 21 21 LEU N N 21 121.658 121.658 121.624 0.034 19205
2110 1 13 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.295 -0.128 19205
2111 1 13 . 1 1 21 21 LEU C C 21 176.589 176.589 177.562 -0.973 19205
2112 1 13 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.718 0.168 19205
2113 1 13 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.660 0.264 19205
2114 1 13 . 1 1 21 21 LEU H H 21 8.522 8.522 8.359 0.163 19205
2115 1 13 . 1 1 22 22 ALA N N 22 121.907 121.907 123.356 -1.449 19205
2116 1 13 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.146 -0.075 19205
2117 1 13 . 1 1 22 22 ALA C C 22 178.382 178.382 178.487 -0.105 19205
2118 1 13 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.493 0.472 19205
2119 1 13 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.111 -0.167 19205
2120 1 13 . 1 1 22 22 ALA H H 22 8.104 8.104 8.465 -0.361 19205
2121 1 13 . 1 1 23 23 GLY N N 23 110.790 110.790 112.558 -1.768 19205
2122 1 13 . 1 1 23 23 GLY C C 23 174.553 174.553 174.707 -0.154 19205
2123 1 13 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.685 -0.064 19205
2124 1 13 . 1 1 23 23 GLY H H 23 8.644 8.644 8.791 -0.147 19205
2125 1 13 . 1 1 24 24 CYS N N 24 119.431 119.431 119.224 0.207 19205
2126 1 13 . 1 1 24 24 CYS HA H 24 4.850 4.850 4.972 -0.122 19205
2127 1 13 . 1 1 24 24 CYS C C 24 172.768 172.768 174.203 -1.435 19205
2128 1 13 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.193 -3.291 19205
2129 1 13 . 1 1 24 24 CYS CB C 24 46.168 46.168 29.496 16.672 19205
2130 1 13 . 1 1 24 24 CYS H H 24 8.491 8.491 7.796 0.695 19205
2131 1 13 . 1 1 25 25 VAL N N 25 115.469 115.469 116.421 -0.952 19205
2132 1 13 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.582 -0.215 19205
2133 1 13 . 1 1 25 25 VAL C C 25 175.161 175.161 173.828 1.333 19205
2134 1 13 . 1 1 25 25 VAL CA C 25 59.327 59.327 58.776 0.551 19205
2135 1 13 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.322 0.713 19205
2136 1 13 . 1 1 25 25 VAL H H 25 9.324 9.324 8.813 0.511 19205
2137 1 13 . 1 1 26 26 CYS N N 26 123.350 123.350 120.452 2.898 19205
2138 1 13 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.785 0.025 19205
2139 1 13 . 1 1 26 26 CYS C C 26 174.891 174.891 175.882 -0.991 19205
2140 1 13 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.536 -3.337 19205
2141 1 13 . 1 1 26 26 CYS CB C 26 38.260 38.260 26.215 12.045 19205
2142 1 13 . 1 1 26 26 CYS H H 26 9.346 9.346 8.940 0.406 19205
2143 1 13 . 1 1 27 27 GLY N N 27 117.742 117.742 116.530 1.212 19205
2144 1 13 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.115 1.343 19205
2145 1 13 . 1 1 27 27 GLY H H 27 8.259 8.259 9.020 -0.761 19205
2146 1 13 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.405 -0.035 19205
2147 1 13 . 1 1 28 28 PRO C C 28 176.720 176.720 176.908 -0.188 19205
2148 1 13 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.530 -0.044 19205
2149 1 13 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.667 -0.114 19205
2150 1 13 . 1 1 29 29 ASN N N 29 114.300 114.300 116.279 -1.979 19205
2151 1 13 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.675 -0.026 19205
2152 1 13 . 1 1 29 29 ASN C C 29 175.490 175.490 176.366 -0.876 19205
2153 1 13 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.982 -0.647 19205
2154 1 13 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.605 -0.039 19205
2155 1 13 . 1 1 29 29 ASN H H 29 8.061 8.061 8.243 -0.182 19205
2156 1 13 . 1 1 30 30 GLY N N 30 107.086 107.086 106.810 0.276 19205
2157 1 13 . 1 1 30 30 GLY C C 30 173.758 173.758 172.818 0.940 19205
2158 1 13 . 1 1 30 30 GLY CA C 30 46.312 46.312 44.990 1.322 19205
2159 1 13 . 1 1 30 30 GLY H H 30 8.294 8.294 7.859 0.435 19205
2160 1 13 . 1 1 31 31 PHE N N 31 115.129 115.129 118.554 -3.425 19205
2161 1 13 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.403 -0.053 19205
2162 1 13 . 1 1 31 31 PHE C C 31 176.773 176.773 175.306 1.467 19205
2163 1 13 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.016 0.394 19205
2164 1 13 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.566 -0.092 19205
2165 1 13 . 1 1 31 31 PHE H H 31 7.167 7.167 8.300 -1.133 19205
2166 1 13 . 1 1 32 32 CYS N N 32 123.123 123.123 121.072 2.051 19205
2167 1 13 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.087 0.012 19205
2168 1 13 . 1 1 32 32 CYS C C 32 175.875 175.875 175.862 0.013 19205
2169 1 13 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.407 -3.977 19205
2170 1 13 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.237 15.850 19205
2171 1 13 . 1 1 32 32 CYS H H 32 8.708 8.708 8.967 -0.259 19205
2172 1 14 . 1 1 2 2 CYS N N 2 120.511 120.511 118.338 2.173 19205
2173 1 14 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.983 -0.110 19205
2174 1 14 . 1 1 2 2 CYS CA C 2 53.145 53.145 54.810 -1.665 19205
2175 1 14 . 1 1 2 2 CYS CB C 2 41.921 41.921 27.514 14.407 19205
2176 1 14 . 1 1 2 2 CYS H H 2 8.866 8.866 8.635 0.231 19205
2177 1 14 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.212 0.086 19205
2178 1 14 . 1 1 3 3 PRO C C 3 176.294 176.294 175.626 0.668 19205
2179 1 14 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.207 0.567 19205
2180 1 14 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.371 1.520 19205
2181 1 14 . 1 1 4 4 GLN N N 4 118.141 118.141 118.073 0.068 19205
2182 1 14 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.647 -0.753 19205
2183 1 14 . 1 1 4 4 GLN C C 4 176.143 176.143 175.467 0.676 19205
2184 1 14 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.584 0.589 19205
2185 1 14 . 1 1 4 4 GLN CB C 4 29.568 29.568 31.255 -1.687 19205
2186 1 14 . 1 1 4 4 GLN H H 4 7.648 7.648 8.280 -0.632 19205
2187 1 14 . 1 1 5 5 GLY N N 5 108.656 108.656 106.873 1.783 19205
2188 1 14 . 1 1 5 5 GLY C C 5 173.733 173.733 173.354 0.379 19205
2189 1 14 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.744 -0.487 19205
2190 1 14 . 1 1 5 5 GLY H H 5 7.759 7.759 7.668 0.091 19205
2191 1 14 . 1 1 6 6 ARG N N 6 119.446 119.446 120.158 -0.712 19205
2192 1 14 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.810 -0.421 19205
2193 1 14 . 1 1 6 6 ARG C C 6 176.780 176.780 177.311 -0.531 19205
2194 1 14 . 1 1 6 6 ARG CA C 6 55.538 55.538 54.526 1.012 19205
2195 1 14 . 1 1 6 6 ARG CB C 6 31.543 31.543 33.073 -1.530 19205
2196 1 14 . 1 1 6 6 ARG H H 6 7.865 7.865 8.119 -0.254 19205
2197 1 14 . 1 1 7 7 GLY N N 7 109.318 109.318 110.634 -1.316 19205
2198 1 14 . 1 1 7 7 GLY C C 7 174.275 174.275 174.435 -0.160 19205
2199 1 14 . 1 1 7 7 GLY CA C 7 46.020 46.020 47.177 -1.157 19205
2200 1 14 . 1 1 7 7 GLY H H 7 8.529 8.529 8.761 -0.232 19205
2201 1 14 . 1 1 8 8 ASP N N 8 121.036 121.036 119.315 1.721 19205
2202 1 14 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.712 -0.157 19205
2203 1 14 . 1 1 8 8 ASP C C 8 175.562 175.562 174.836 0.726 19205
2204 1 14 . 1 1 8 8 ASP CA C 8 53.748 53.748 53.968 -0.220 19205
2205 1 14 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.703 -0.644 19205
2206 1 14 . 1 1 8 8 ASP H H 8 8.414 8.414 8.608 -0.194 19205
2207 1 14 . 1 1 9 9 TRP N N 9 121.704 121.704 122.634 -0.930 19205
2208 1 14 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.818 -0.325 19205
2209 1 14 . 1 1 9 9 TRP C C 9 175.498 175.498 174.652 0.846 19205
2210 1 14 . 1 1 9 9 TRP CA C 9 57.094 57.094 56.005 1.089 19205
2211 1 14 . 1 1 9 9 TRP CB C 9 29.809 29.809 30.057 -0.248 19205
2212 1 14 . 1 1 9 9 TRP H H 9 7.814 7.814 8.335 -0.521 19205
2213 1 14 . 1 1 10 10 ALA N N 10 128.588 128.588 127.507 1.081 19205
2214 1 14 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.410 0.003 19205
2215 1 14 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.640 -0.370 19205
2216 1 14 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.509 -0.393 19205
2217 1 14 . 1 1 10 10 ALA H H 10 8.163 8.163 8.286 -0.123 19205
2218 1 14 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.897 -0.566 19205
2219 1 14 . 1 1 11 11 PRO C C 11 176.753 176.753 176.733 0.020 19205
2220 1 14 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.101 0.895 19205
2221 1 14 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.550 -0.105 19205
2222 1 14 . 1 1 12 12 THR N N 12 119.798 119.798 117.987 1.811 19205
2223 1 14 . 1 1 12 12 THR HA H 12 4.512 4.512 4.736 -0.224 19205
2224 1 14 . 1 1 12 12 THR C C 12 173.572 173.572 174.608 -1.036 19205
2225 1 14 . 1 1 12 12 THR CA C 12 62.099 62.099 62.143 -0.044 19205
2226 1 14 . 1 1 12 12 THR CB C 12 71.060 71.060 70.268 0.792 19205
2227 1 14 . 1 1 12 12 THR H H 12 9.006 9.006 9.083 -0.077 19205
2228 1 14 . 1 1 13 13 SER N N 13 123.494 123.494 122.399 1.095 19205
2229 1 14 . 1 1 13 13 SER HA H 13 4.539 4.539 4.443 0.096 19205
2230 1 14 . 1 1 13 13 SER C C 13 172.953 172.953 174.546 -1.593 19205
2231 1 14 . 1 1 13 13 SER CA C 13 58.421 58.421 58.622 -0.201 19205
2232 1 14 . 1 1 13 13 SER CB C 13 63.844 63.844 62.919 0.925 19205
2233 1 14 . 1 1 13 13 SER H H 13 8.805 8.805 8.813 -0.008 19205
2234 1 14 . 1 1 14 14 CYS N N 14 116.548 116.548 120.933 -4.385 19205
2235 1 14 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.809 0.131 19205
2236 1 14 . 1 1 14 14 CYS C C 14 172.746 172.746 173.750 -1.004 19205
2237 1 14 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.674 -2.868 19205
2238 1 14 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.760 15.845 19205
2239 1 14 . 1 1 14 14 CYS H H 14 8.265 8.265 8.136 0.129 19205
2240 1 14 . 1 1 15 15 SER N N 15 113.958 113.958 114.476 -0.518 19205
2241 1 14 . 1 1 15 15 SER HA H 15 4.531 4.531 4.653 -0.122 19205
2242 1 14 . 1 1 15 15 SER C C 15 173.205 173.205 173.956 -0.751 19205
2243 1 14 . 1 1 15 15 SER CA C 15 58.826 58.826 58.897 -0.071 19205
2244 1 14 . 1 1 15 15 SER CB C 15 65.097 65.097 65.051 0.046 19205
2245 1 14 . 1 1 15 15 SER H H 15 9.497 9.497 9.194 0.303 19205
2246 1 14 . 1 1 16 16 GLN N N 16 118.516 118.516 119.089 -0.573 19205
2247 1 14 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.607 0.137 19205
2248 1 14 . 1 1 16 16 GLN C C 16 176.335 176.335 174.750 1.585 19205
2249 1 14 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.601 -0.660 19205
2250 1 14 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.154 0.169 19205
2251 1 14 . 1 1 16 16 GLN H H 16 8.049 8.049 7.908 0.141 19205
2252 1 14 . 1 1 17 17 ASP N N 17 124.190 124.190 121.249 2.941 19205
2253 1 14 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.442 -0.333 19205
2254 1 14 . 1 1 17 17 ASP C C 17 178.349 178.349 177.903 0.446 19205
2255 1 14 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.300 1.647 19205
2256 1 14 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.264 -0.741 19205
2257 1 14 . 1 1 17 17 ASP H H 17 9.208 9.208 8.708 0.500 19205
2258 1 14 . 1 1 18 18 SER N N 18 112.259 112.259 112.329 -0.070 19205
2259 1 14 . 1 1 18 18 SER HA H 18 4.228 4.228 4.262 -0.034 19205
2260 1 14 . 1 1 18 18 SER C C 18 175.037 175.037 175.457 -0.420 19205
2261 1 14 . 1 1 18 18 SER CA C 18 60.093 60.093 59.880 0.213 19205
2262 1 14 . 1 1 18 18 SER CB C 18 62.134 62.134 63.106 -0.972 19205
2263 1 14 . 1 1 18 18 SER H H 18 8.371 8.371 8.382 -0.011 19205
2264 1 14 . 1 1 19 19 ASP N N 19 120.750 120.750 120.548 0.202 19205
2265 1 14 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.636 -0.045 19205
2266 1 14 . 1 1 19 19 ASP C C 19 175.958 175.958 176.431 -0.473 19205
2267 1 14 . 1 1 19 19 ASP CA C 19 55.885 55.885 55.108 0.777 19205
2268 1 14 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.166 0.855 19205
2269 1 14 . 1 1 19 19 ASP H H 19 7.697 7.697 7.827 -0.130 19205
2270 1 14 . 1 1 20 20 CYS N N 20 118.125 118.125 116.674 1.451 19205
2271 1 14 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.700 0.277 19205
2272 1 14 . 1 1 20 20 CYS C C 20 174.152 174.152 174.967 -0.815 19205
2273 1 14 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.395 -6.414 19205
2274 1 14 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.763 10.211 19205
2275 1 14 . 1 1 20 20 CYS H H 20 7.947 7.947 7.754 0.193 19205
2276 1 14 . 1 1 21 21 LEU N N 21 121.658 121.658 121.531 0.127 19205
2277 1 14 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.334 -0.167 19205
2278 1 14 . 1 1 21 21 LEU C C 21 176.589 176.589 177.434 -0.845 19205
2279 1 14 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.568 0.318 19205
2280 1 14 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.767 0.156 19205
2281 1 14 . 1 1 21 21 LEU H H 21 8.522 8.522 8.520 0.002 19205
2282 1 14 . 1 1 22 22 ALA N N 22 121.907 121.907 123.413 -1.506 19205
2283 1 14 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.144 -0.072 19205
2284 1 14 . 1 1 22 22 ALA C C 22 178.382 178.382 178.516 -0.134 19205
2285 1 14 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.510 0.455 19205
2286 1 14 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.211 -0.267 19205
2287 1 14 . 1 1 22 22 ALA H H 22 8.104 8.104 8.446 -0.342 19205
2288 1 14 . 1 1 23 23 GLY N N 23 110.790 110.790 112.391 -1.601 19205
2289 1 14 . 1 1 23 23 GLY C C 23 174.553 174.553 174.549 0.004 19205
2290 1 14 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.740 -0.119 19205
2291 1 14 . 1 1 23 23 GLY H H 23 8.644 8.644 8.809 -0.165 19205
2292 1 14 . 1 1 24 24 CYS N N 24 119.431 119.431 118.426 1.005 19205
2293 1 14 . 1 1 24 24 CYS HA H 24 4.850 4.850 4.958 -0.108 19205
2294 1 14 . 1 1 24 24 CYS C C 24 172.768 172.768 173.905 -1.137 19205
2295 1 14 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.078 -3.176 19205
2296 1 14 . 1 1 24 24 CYS CB C 24 46.168 46.168 30.029 16.139 19205
2297 1 14 . 1 1 24 24 CYS H H 24 8.491 8.491 7.678 0.813 19205
2298 1 14 . 1 1 25 25 VAL N N 25 115.469 115.469 115.796 -0.327 19205
2299 1 14 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.684 -0.317 19205
2300 1 14 . 1 1 25 25 VAL C C 25 175.161 175.161 173.796 1.365 19205
2301 1 14 . 1 1 25 25 VAL CA C 25 59.327 59.327 59.306 0.021 19205
2302 1 14 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.737 0.298 19205
2303 1 14 . 1 1 25 25 VAL H H 25 9.324 9.324 9.009 0.315 19205
2304 1 14 . 1 1 26 26 CYS N N 26 123.350 123.350 121.252 2.098 19205
2305 1 14 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.805 0.005 19205
2306 1 14 . 1 1 26 26 CYS C C 26 174.891 174.891 176.152 -1.261 19205
2307 1 14 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.517 -3.318 19205
2308 1 14 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.456 12.804 19205
2309 1 14 . 1 1 26 26 CYS H H 26 9.346 9.346 8.857 0.489 19205
2310 1 14 . 1 1 27 27 GLY N N 27 117.742 117.742 116.736 1.006 19205
2311 1 14 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.103 1.355 19205
2312 1 14 . 1 1 27 27 GLY H H 27 8.259 8.259 8.836 -0.577 19205
2313 1 14 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.432 -0.062 19205
2314 1 14 . 1 1 28 28 PRO C C 28 176.720 176.720 176.756 -0.036 19205
2315 1 14 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.321 0.165 19205
2316 1 14 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.614 -0.062 19205
2317 1 14 . 1 1 29 29 ASN N N 29 114.300 114.300 116.487 -2.187 19205
2318 1 14 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.686 -0.037 19205
2319 1 14 . 1 1 29 29 ASN C C 29 175.490 175.490 176.514 -1.024 19205
2320 1 14 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.948 -0.613 19205
2321 1 14 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.671 -0.105 19205
2322 1 14 . 1 1 29 29 ASN H H 29 8.061 8.061 8.215 -0.154 19205
2323 1 14 . 1 1 30 30 GLY N N 30 107.086 107.086 107.240 -0.154 19205
2324 1 14 . 1 1 30 30 GLY C C 30 173.758 173.758 172.906 0.852 19205
2325 1 14 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.154 1.158 19205
2326 1 14 . 1 1 30 30 GLY H H 30 8.294 8.294 8.004 0.290 19205
2327 1 14 . 1 1 31 31 PHE N N 31 115.129 115.129 118.179 -3.050 19205
2328 1 14 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.289 0.061 19205
2329 1 14 . 1 1 31 31 PHE C C 31 176.773 176.773 175.220 1.553 19205
2330 1 14 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.189 0.221 19205
2331 1 14 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.705 -0.231 19205
2332 1 14 . 1 1 31 31 PHE H H 31 7.167 7.167 8.350 -1.183 19205
2333 1 14 . 1 1 32 32 CYS N N 32 123.123 123.123 120.636 2.487 19205
2334 1 14 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.169 -0.070 19205
2335 1 14 . 1 1 32 32 CYS C C 32 175.875 175.875 175.957 -0.082 19205
2336 1 14 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.390 -3.960 19205
2337 1 14 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.428 15.659 19205
2338 1 14 . 1 1 32 32 CYS H H 32 8.708 8.708 8.889 -0.181 19205
2339 1 15 . 1 1 2 2 CYS N N 2 120.511 120.511 119.277 1.234 19205
2340 1 15 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.827 0.046 19205
2341 1 15 . 1 1 2 2 CYS CA C 2 53.145 53.145 55.727 -2.582 19205
2342 1 15 . 1 1 2 2 CYS CB C 2 41.921 41.921 26.573 15.348 19205
2343 1 15 . 1 1 2 2 CYS H H 2 8.866 8.866 8.690 0.176 19205
2344 1 15 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.226 0.072 19205
2345 1 15 . 1 1 3 3 PRO C C 3 176.294 176.294 175.683 0.611 19205
2346 1 15 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.135 0.639 19205
2347 1 15 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.234 1.657 19205
2348 1 15 . 1 1 4 4 GLN N N 4 118.141 118.141 119.191 -1.050 19205
2349 1 15 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.680 -0.786 19205
2350 1 15 . 1 1 4 4 GLN C C 4 176.143 176.143 175.057 1.086 19205
2351 1 15 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.216 0.957 19205
2352 1 15 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.317 -0.749 19205
2353 1 15 . 1 1 4 4 GLN H H 4 7.648 7.648 8.271 -0.623 19205
2354 1 15 . 1 1 5 5 GLY N N 5 108.656 108.656 107.016 1.640 19205
2355 1 15 . 1 1 5 5 GLY C C 5 173.733 173.733 174.224 -0.491 19205
2356 1 15 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.089 0.168 19205
2357 1 15 . 1 1 5 5 GLY H H 5 7.759 7.759 7.838 -0.079 19205
2358 1 15 . 1 1 6 6 ARG N N 6 119.446 119.446 120.826 -1.380 19205
2359 1 15 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.684 -0.295 19205
2360 1 15 . 1 1 6 6 ARG C C 6 176.780 176.780 176.734 0.046 19205
2361 1 15 . 1 1 6 6 ARG CA C 6 55.538 55.538 55.008 0.530 19205
2362 1 15 . 1 1 6 6 ARG CB C 6 31.543 31.543 31.483 0.060 19205
2363 1 15 . 1 1 6 6 ARG H H 6 7.865 7.865 7.784 0.081 19205
2364 1 15 . 1 1 7 7 GLY N N 7 109.318 109.318 109.090 0.228 19205
2365 1 15 . 1 1 7 7 GLY C C 7 174.275 174.275 174.883 -0.608 19205
2366 1 15 . 1 1 7 7 GLY CA C 7 46.020 46.020 46.577 -0.557 19205
2367 1 15 . 1 1 7 7 GLY H H 7 8.529 8.529 8.595 -0.066 19205
2368 1 15 . 1 1 8 8 ASP N N 8 121.036 121.036 119.343 1.693 19205
2369 1 15 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.746 -0.191 19205
2370 1 15 . 1 1 8 8 ASP C C 8 175.562 175.562 175.873 -0.311 19205
2371 1 15 . 1 1 8 8 ASP CA C 8 53.748 53.748 54.136 -0.388 19205
2372 1 15 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.553 -0.494 19205
2373 1 15 . 1 1 8 8 ASP H H 8 8.414 8.414 8.614 -0.200 19205
2374 1 15 . 1 1 9 9 TRP N N 9 121.704 121.704 122.068 -0.364 19205
2375 1 15 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.813 -0.320 19205
2376 1 15 . 1 1 9 9 TRP C C 9 175.498 175.498 175.082 0.416 19205
2377 1 15 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.843 1.251 19205
2378 1 15 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.281 0.528 19205
2379 1 15 . 1 1 9 9 TRP H H 9 7.814 7.814 7.360 0.454 19205
2380 1 15 . 1 1 10 10 ALA N N 10 128.588 128.588 128.035 0.553 19205
2381 1 15 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.430 -0.017 19205
2382 1 15 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.720 -0.450 19205
2383 1 15 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.515 -0.400 19205
2384 1 15 . 1 1 10 10 ALA H H 10 8.163 8.163 7.986 0.177 19205
2385 1 15 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.946 -0.615 19205
2386 1 15 . 1 1 11 11 PRO C C 11 176.753 176.753 176.813 -0.060 19205
2387 1 15 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.133 0.863 19205
2388 1 15 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.496 -0.051 19205
2389 1 15 . 1 1 12 12 THR N N 12 119.798 119.798 117.342 2.456 19205
2390 1 15 . 1 1 12 12 THR HA H 12 4.512 4.512 4.723 -0.211 19205
2391 1 15 . 1 1 12 12 THR C C 12 173.572 173.572 174.735 -1.163 19205
2392 1 15 . 1 1 12 12 THR CA C 12 62.099 62.099 62.144 -0.045 19205
2393 1 15 . 1 1 12 12 THR CB C 12 71.060 71.060 70.019 1.041 19205
2394 1 15 . 1 1 12 12 THR H H 12 9.006 9.006 8.561 0.445 19205
2395 1 15 . 1 1 13 13 SER N N 13 123.494 123.494 121.779 1.715 19205
2396 1 15 . 1 1 13 13 SER HA H 13 4.539 4.539 4.194 0.345 19205
2397 1 15 . 1 1 13 13 SER C C 13 172.953 172.953 174.386 -1.433 19205
2398 1 15 . 1 1 13 13 SER CA C 13 58.421 58.421 58.237 0.184 19205
2399 1 15 . 1 1 13 13 SER CB C 13 63.844 63.844 62.953 0.891 19205
2400 1 15 . 1 1 13 13 SER H H 13 8.805 8.805 8.743 0.062 19205
2401 1 15 . 1 1 14 14 CYS N N 14 116.548 116.548 120.882 -4.334 19205
2402 1 15 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.817 0.123 19205
2403 1 15 . 1 1 14 14 CYS C C 14 172.746 172.746 173.553 -0.807 19205
2404 1 15 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.806 -3.000 19205
2405 1 15 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.612 15.993 19205
2406 1 15 . 1 1 14 14 CYS H H 14 8.265 8.265 8.243 0.022 19205
2407 1 15 . 1 1 15 15 SER N N 15 113.958 113.958 114.080 -0.122 19205
2408 1 15 . 1 1 15 15 SER HA H 15 4.531 4.531 4.582 -0.051 19205
2409 1 15 . 1 1 15 15 SER C C 15 173.205 173.205 173.756 -0.551 19205
2410 1 15 . 1 1 15 15 SER CA C 15 58.826 58.826 58.936 -0.110 19205
2411 1 15 . 1 1 15 15 SER CB C 15 65.097 65.097 64.886 0.211 19205
2412 1 15 . 1 1 15 15 SER H H 15 9.497 9.497 9.067 0.430 19205
2413 1 15 . 1 1 16 16 GLN N N 16 118.516 118.516 119.122 -0.606 19205
2414 1 15 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.616 0.128 19205
2415 1 15 . 1 1 16 16 GLN C C 16 176.335 176.335 174.611 1.724 19205
2416 1 15 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.746 -0.805 19205
2417 1 15 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.128 0.195 19205
2418 1 15 . 1 1 16 16 GLN H H 16 8.049 8.049 7.770 0.279 19205
2419 1 15 . 1 1 17 17 ASP N N 17 124.190 124.190 122.565 1.625 19205
2420 1 15 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.394 -0.285 19205
2421 1 15 . 1 1 17 17 ASP C C 17 178.349 178.349 178.164 0.185 19205
2422 1 15 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.219 1.728 19205
2423 1 15 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.385 -0.862 19205
2424 1 15 . 1 1 17 17 ASP H H 17 9.208 9.208 8.727 0.481 19205
2425 1 15 . 1 1 18 18 SER N N 18 112.259 112.259 112.294 -0.035 19205
2426 1 15 . 1 1 18 18 SER HA H 18 4.228 4.228 4.256 -0.028 19205
2427 1 15 . 1 1 18 18 SER C C 18 175.037 175.037 175.020 0.017 19205
2428 1 15 . 1 1 18 18 SER CA C 18 60.093 60.093 59.597 0.496 19205
2429 1 15 . 1 1 18 18 SER CB C 18 62.134 62.134 62.937 -0.803 19205
2430 1 15 . 1 1 18 18 SER H H 18 8.371 8.371 8.122 0.249 19205
2431 1 15 . 1 1 19 19 ASP N N 19 120.750 120.750 120.419 0.331 19205
2432 1 15 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.688 -0.097 19205
2433 1 15 . 1 1 19 19 ASP C C 19 175.958 175.958 176.233 -0.275 19205
2434 1 15 . 1 1 19 19 ASP CA C 19 55.885 55.885 54.822 1.063 19205
2435 1 15 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.108 0.914 19205
2436 1 15 . 1 1 19 19 ASP H H 19 7.697 7.697 7.746 -0.049 19205
2437 1 15 . 1 1 20 20 CYS N N 20 118.125 118.125 116.651 1.474 19205
2438 1 15 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.697 0.280 19205
2439 1 15 . 1 1 20 20 CYS C C 20 174.152 174.152 174.477 -0.325 19205
2440 1 15 . 1 1 20 20 CYS CA C 20 51.981 51.981 57.939 -5.958 19205
2441 1 15 . 1 1 20 20 CYS CB C 20 39.974 39.974 30.011 9.963 19205
2442 1 15 . 1 1 20 20 CYS H H 20 7.947 7.947 7.671 0.276 19205
2443 1 15 . 1 1 21 21 LEU N N 21 121.658 121.658 121.470 0.188 19205
2444 1 15 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.379 -0.212 19205
2445 1 15 . 1 1 21 21 LEU C C 21 176.589 176.589 177.362 -0.773 19205
2446 1 15 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.406 0.480 19205
2447 1 15 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.757 0.166 19205
2448 1 15 . 1 1 21 21 LEU H H 21 8.522 8.522 8.317 0.205 19205
2449 1 15 . 1 1 22 22 ALA N N 22 121.907 121.907 122.930 -1.023 19205
2450 1 15 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.191 -0.119 19205
2451 1 15 . 1 1 22 22 ALA C C 22 178.382 178.382 178.572 -0.190 19205
2452 1 15 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.549 0.416 19205
2453 1 15 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.515 -0.571 19205
2454 1 15 . 1 1 22 22 ALA H H 22 8.104 8.104 8.443 -0.339 19205
2455 1 15 . 1 1 23 23 GLY N N 23 110.790 110.790 111.527 -0.737 19205
2456 1 15 . 1 1 23 23 GLY C C 23 174.553 174.553 174.753 -0.200 19205
2457 1 15 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.808 -0.187 19205
2458 1 15 . 1 1 23 23 GLY H H 23 8.644 8.644 8.706 -0.062 19205
2459 1 15 . 1 1 24 24 CYS N N 24 119.431 119.431 120.062 -0.631 19205
2460 1 15 . 1 1 24 24 CYS HA H 24 4.850 4.850 5.182 -0.332 19205
2461 1 15 . 1 1 24 24 CYS C C 24 172.768 172.768 174.157 -1.389 19205
2462 1 15 . 1 1 24 24 CYS CA C 24 54.902 54.902 59.126 -4.224 19205
2463 1 15 . 1 1 24 24 CYS CB C 24 46.168 46.168 29.858 16.310 19205
2464 1 15 . 1 1 24 24 CYS H H 24 8.491 8.491 7.708 0.783 19205
2465 1 15 . 1 1 25 25 VAL N N 25 115.469 115.469 117.237 -1.768 19205
2466 1 15 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.684 -0.317 19205
2467 1 15 . 1 1 25 25 VAL C C 25 175.161 175.161 173.820 1.341 19205
2468 1 15 . 1 1 25 25 VAL CA C 25 59.327 59.327 59.283 0.044 19205
2469 1 15 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.928 0.107 19205
2470 1 15 . 1 1 25 25 VAL H H 25 9.324 9.324 9.196 0.128 19205
2471 1 15 . 1 1 26 26 CYS N N 26 123.350 123.350 121.696 1.654 19205
2472 1 15 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.816 -0.006 19205
2473 1 15 . 1 1 26 26 CYS C C 26 174.891 174.891 176.251 -1.360 19205
2474 1 15 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.899 -3.700 19205
2475 1 15 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.420 12.840 19205
2476 1 15 . 1 1 26 26 CYS H H 26 9.346 9.346 8.876 0.470 19205
2477 1 15 . 1 1 27 27 GLY N N 27 117.742 117.742 116.838 0.904 19205
2478 1 15 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.216 1.242 19205
2479 1 15 . 1 1 27 27 GLY H H 27 8.259 8.259 9.044 -0.785 19205
2480 1 15 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.429 -0.059 19205
2481 1 15 . 1 1 28 28 PRO C C 28 176.720 176.720 176.847 -0.127 19205
2482 1 15 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.379 0.107 19205
2483 1 15 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.659 -0.106 19205
2484 1 15 . 1 1 29 29 ASN N N 29 114.300 114.300 116.409 -2.109 19205
2485 1 15 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.692 -0.043 19205
2486 1 15 . 1 1 29 29 ASN C C 29 175.490 175.490 176.393 -0.903 19205
2487 1 15 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.953 -0.618 19205
2488 1 15 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.608 -0.042 19205
2489 1 15 . 1 1 29 29 ASN H H 29 8.061 8.061 8.234 -0.173 19205
2490 1 15 . 1 1 30 30 GLY N N 30 107.086 107.086 107.345 -0.259 19205
2491 1 15 . 1 1 30 30 GLY C C 30 173.758 173.758 172.917 0.841 19205
2492 1 15 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.133 1.179 19205
2493 1 15 . 1 1 30 30 GLY H H 30 8.294 8.294 7.953 0.341 19205
2494 1 15 . 1 1 31 31 PHE N N 31 115.129 115.129 118.012 -2.883 19205
2495 1 15 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.307 0.043 19205
2496 1 15 . 1 1 31 31 PHE C C 31 176.773 176.773 175.069 1.704 19205
2497 1 15 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.251 0.159 19205
2498 1 15 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.955 -0.481 19205
2499 1 15 . 1 1 31 31 PHE H H 31 7.167 7.167 8.239 -1.072 19205
2500 1 15 . 1 1 32 32 CYS N N 32 123.123 123.123 120.498 2.625 19205
2501 1 15 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.151 -0.052 19205
2502 1 15 . 1 1 32 32 CYS C C 32 175.875 175.875 175.863 0.012 19205
2503 1 15 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.373 -3.943 19205
2504 1 15 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.192 15.895 19205
2505 1 15 . 1 1 32 32 CYS H H 32 8.708 8.708 8.880 -0.172 19205
2506 1 16 . 1 1 2 2 CYS N N 2 120.511 120.511 118.156 2.355 19205
2507 1 16 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.789 0.084 19205
2508 1 16 . 1 1 2 2 CYS CA C 2 53.145 53.145 55.875 -2.730 19205
2509 1 16 . 1 1 2 2 CYS CB C 2 41.921 41.921 27.671 14.250 19205
2510 1 16 . 1 1 2 2 CYS H H 2 8.866 8.866 8.164 0.702 19205
2511 1 16 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.124 0.174 19205
2512 1 16 . 1 1 3 3 PRO C C 3 176.294 176.294 175.440 0.854 19205
2513 1 16 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.098 0.676 19205
2514 1 16 . 1 1 3 3 PRO CB C 3 31.891 31.891 29.913 1.978 19205
2515 1 16 . 1 1 4 4 GLN N N 4 118.141 118.141 117.358 0.783 19205
2516 1 16 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.624 -0.730 19205
2517 1 16 . 1 1 4 4 GLN C C 4 176.143 176.143 175.028 1.115 19205
2518 1 16 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.101 1.072 19205
2519 1 16 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.585 -1.017 19205
2520 1 16 . 1 1 4 4 GLN H H 4 7.648 7.648 8.170 -0.522 19205
2521 1 16 . 1 1 5 5 GLY N N 5 108.656 108.656 106.678 1.978 19205
2522 1 16 . 1 1 5 5 GLY C C 5 173.733 173.733 173.179 0.554 19205
2523 1 16 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.748 -0.491 19205
2524 1 16 . 1 1 5 5 GLY H H 5 7.759 7.759 7.532 0.227 19205
2525 1 16 . 1 1 6 6 ARG N N 6 119.446 119.446 120.639 -1.193 19205
2526 1 16 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.816 -0.427 19205
2527 1 16 . 1 1 6 6 ARG C C 6 176.780 176.780 177.262 -0.482 19205
2528 1 16 . 1 1 6 6 ARG CA C 6 55.538 55.538 54.576 0.962 19205
2529 1 16 . 1 1 6 6 ARG CB C 6 31.543 31.543 33.288 -1.744 19205
2530 1 16 . 1 1 6 6 ARG H H 6 7.865 7.865 8.349 -0.484 19205
2531 1 16 . 1 1 7 7 GLY N N 7 109.318 109.318 110.904 -1.586 19205
2532 1 16 . 1 1 7 7 GLY C C 7 174.275 174.275 174.398 -0.123 19205
2533 1 16 . 1 1 7 7 GLY CA C 7 46.020 46.020 47.206 -1.186 19205
2534 1 16 . 1 1 7 7 GLY H H 7 8.529 8.529 8.767 -0.238 19205
2535 1 16 . 1 1 8 8 ASP N N 8 121.036 121.036 119.734 1.302 19205
2536 1 16 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.681 -0.126 19205
2537 1 16 . 1 1 8 8 ASP C C 8 175.562 175.562 174.968 0.594 19205
2538 1 16 . 1 1 8 8 ASP CA C 8 53.748 53.748 54.123 -0.375 19205
2539 1 16 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.503 -0.444 19205
2540 1 16 . 1 1 8 8 ASP H H 8 8.414 8.414 8.673 -0.259 19205
2541 1 16 . 1 1 9 9 TRP N N 9 121.704 121.704 122.730 -1.026 19205
2542 1 16 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.803 -0.310 19205
2543 1 16 . 1 1 9 9 TRP C C 9 175.498 175.498 174.625 0.873 19205
2544 1 16 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.928 1.166 19205
2545 1 16 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.627 0.182 19205
2546 1 16 . 1 1 9 9 TRP H H 9 7.814 7.814 8.274 -0.460 19205
2547 1 16 . 1 1 10 10 ALA N N 10 128.588 128.588 128.018 0.570 19205
2548 1 16 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.421 -0.008 19205
2549 1 16 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.660 -0.390 19205
2550 1 16 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.563 -0.448 19205
2551 1 16 . 1 1 10 10 ALA H H 10 8.163 8.163 8.405 -0.242 19205
2552 1 16 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.939 -0.608 19205
2553 1 16 . 1 1 11 11 PRO C C 11 176.753 176.753 176.690 0.063 19205
2554 1 16 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.072 0.924 19205
2555 1 16 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.588 -0.143 19205
2556 1 16 . 1 1 12 12 THR N N 12 119.798 119.798 116.226 3.572 19205
2557 1 16 . 1 1 12 12 THR HA H 12 4.512 4.512 4.709 -0.197 19205
2558 1 16 . 1 1 12 12 THR C C 12 173.572 173.572 174.283 -0.711 19205
2559 1 16 . 1 1 12 12 THR CA C 12 62.099 62.099 61.780 0.319 19205
2560 1 16 . 1 1 12 12 THR CB C 12 71.060 71.060 70.674 0.386 19205
2561 1 16 . 1 1 12 12 THR H H 12 9.006 9.006 8.295 0.711 19205
2562 1 16 . 1 1 13 13 SER N N 13 123.494 123.494 121.209 2.285 19205
2563 1 16 . 1 1 13 13 SER HA H 13 4.539 4.539 4.360 0.179 19205
2564 1 16 . 1 1 13 13 SER C C 13 172.953 172.953 174.362 -1.409 19205
2565 1 16 . 1 1 13 13 SER CA C 13 58.421 58.421 59.513 -1.092 19205
2566 1 16 . 1 1 13 13 SER CB C 13 63.844 63.844 63.469 0.375 19205
2567 1 16 . 1 1 13 13 SER H H 13 8.805 8.805 8.816 -0.011 19205
2568 1 16 . 1 1 14 14 CYS N N 14 116.548 116.548 121.838 -5.290 19205
2569 1 16 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.987 -0.047 19205
2570 1 16 . 1 1 14 14 CYS C C 14 172.746 172.746 173.358 -0.612 19205
2571 1 16 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.479 -2.673 19205
2572 1 16 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.343 16.262 19205
2573 1 16 . 1 1 14 14 CYS H H 14 8.265 8.265 8.768 -0.503 19205
2574 1 16 . 1 1 15 15 SER N N 15 113.958 113.958 114.147 -0.189 19205
2575 1 16 . 1 1 15 15 SER HA H 15 4.531 4.531 4.658 -0.127 19205
2576 1 16 . 1 1 15 15 SER C C 15 173.205 173.205 173.695 -0.490 19205
2577 1 16 . 1 1 15 15 SER CA C 15 58.826 58.826 58.798 0.028 19205
2578 1 16 . 1 1 15 15 SER CB C 15 65.097 65.097 65.060 0.037 19205
2579 1 16 . 1 1 15 15 SER H H 15 9.497 9.497 9.106 0.391 19205
2580 1 16 . 1 1 16 16 GLN N N 16 118.516 118.516 119.325 -0.809 19205
2581 1 16 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.707 0.037 19205
2582 1 16 . 1 1 16 16 GLN C C 16 176.335 176.335 174.397 1.938 19205
2583 1 16 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.818 -0.877 19205
2584 1 16 . 1 1 16 16 GLN CB C 16 31.323 31.323 30.800 0.522 19205
2585 1 16 . 1 1 16 16 GLN H H 16 8.049 8.049 7.646 0.403 19205
2586 1 16 . 1 1 17 17 ASP N N 17 124.190 124.190 121.869 2.321 19205
2587 1 16 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.437 -0.328 19205
2588 1 16 . 1 1 17 17 ASP C C 17 178.349 178.349 178.291 0.058 19205
2589 1 16 . 1 1 17 17 ASP CA C 17 58.947 58.947 56.950 1.997 19205
2590 1 16 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.446 -0.923 19205
2591 1 16 . 1 1 17 17 ASP H H 17 9.208 9.208 8.869 0.339 19205
2592 1 16 . 1 1 18 18 SER N N 18 112.259 112.259 112.653 -0.394 19205
2593 1 16 . 1 1 18 18 SER HA H 18 4.228 4.228 4.254 -0.026 19205
2594 1 16 . 1 1 18 18 SER C C 18 175.037 175.037 175.034 0.003 19205
2595 1 16 . 1 1 18 18 SER CA C 18 60.093 60.093 59.579 0.514 19205
2596 1 16 . 1 1 18 18 SER CB C 18 62.134 62.134 62.949 -0.815 19205
2597 1 16 . 1 1 18 18 SER H H 18 8.371 8.371 8.104 0.267 19205
2598 1 16 . 1 1 19 19 ASP N N 19 120.750 120.750 120.452 0.298 19205
2599 1 16 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.646 -0.055 19205
2600 1 16 . 1 1 19 19 ASP C C 19 175.958 175.958 176.219 -0.261 19205
2601 1 16 . 1 1 19 19 ASP CA C 19 55.885 55.885 54.992 0.893 19205
2602 1 16 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.047 0.975 19205
2603 1 16 . 1 1 19 19 ASP H H 19 7.697 7.697 7.688 0.009 19205
2604 1 16 . 1 1 20 20 CYS N N 20 118.125 118.125 116.288 1.837 19205
2605 1 16 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.709 0.268 19205
2606 1 16 . 1 1 20 20 CYS C C 20 174.152 174.152 174.685 -0.533 19205
2607 1 16 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.052 -6.071 19205
2608 1 16 . 1 1 20 20 CYS CB C 20 39.974 39.974 30.034 9.940 19205
2609 1 16 . 1 1 20 20 CYS H H 20 7.947 7.947 7.639 0.308 19205
2610 1 16 . 1 1 21 21 LEU N N 21 121.658 121.658 121.192 0.466 19205
2611 1 16 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.360 -0.193 19205
2612 1 16 . 1 1 21 21 LEU C C 21 176.589 176.589 177.566 -0.977 19205
2613 1 16 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.497 0.389 19205
2614 1 16 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.778 0.145 19205
2615 1 16 . 1 1 21 21 LEU H H 21 8.522 8.522 8.447 0.076 19205
2616 1 16 . 1 1 22 22 ALA N N 22 121.907 121.907 123.085 -1.178 19205
2617 1 16 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.159 -0.087 19205
2618 1 16 . 1 1 22 22 ALA C C 22 178.382 178.382 178.454 -0.072 19205
2619 1 16 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.492 0.473 19205
2620 1 16 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.158 -0.214 19205
2621 1 16 . 1 1 22 22 ALA H H 22 8.104 8.104 8.458 -0.354 19205
2622 1 16 . 1 1 23 23 GLY N N 23 110.790 110.790 111.571 -0.781 19205
2623 1 16 . 1 1 23 23 GLY C C 23 174.553 174.553 174.660 -0.107 19205
2624 1 16 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.806 -0.185 19205
2625 1 16 . 1 1 23 23 GLY H H 23 8.644 8.644 8.660 -0.016 19205
2626 1 16 . 1 1 24 24 CYS N N 24 119.431 119.431 119.883 -0.452 19205
2627 1 16 . 1 1 24 24 CYS HA H 24 4.850 4.850 4.935 -0.085 19205
2628 1 16 . 1 1 24 24 CYS C C 24 172.768 172.768 174.249 -1.481 19205
2629 1 16 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.824 -3.922 19205
2630 1 16 . 1 1 24 24 CYS CB C 24 46.168 46.168 29.646 16.522 19205
2631 1 16 . 1 1 24 24 CYS H H 24 8.491 8.491 7.591 0.900 19205
2632 1 16 . 1 1 25 25 VAL N N 25 115.469 115.469 116.284 -0.815 19205
2633 1 16 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.616 -0.249 19205
2634 1 16 . 1 1 25 25 VAL C C 25 175.161 175.161 173.755 1.406 19205
2635 1 16 . 1 1 25 25 VAL CA C 25 59.327 59.327 59.399 -0.072 19205
2636 1 16 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.433 0.602 19205
2637 1 16 . 1 1 25 25 VAL H H 25 9.324 9.324 9.087 0.237 19205
2638 1 16 . 1 1 26 26 CYS N N 26 123.350 123.350 121.356 1.994 19205
2639 1 16 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.964 -0.154 19205
2640 1 16 . 1 1 26 26 CYS C C 26 174.891 174.891 176.136 -1.245 19205
2641 1 16 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.585 -3.386 19205
2642 1 16 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.734 12.526 19205
2643 1 16 . 1 1 26 26 CYS H H 26 9.346 9.346 8.878 0.468 19205
2644 1 16 . 1 1 27 27 GLY N N 27 117.742 117.742 116.592 1.150 19205
2645 1 16 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.252 1.206 19205
2646 1 16 . 1 1 27 27 GLY H H 27 8.259 8.259 9.051 -0.792 19205
2647 1 16 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.431 -0.061 19205
2648 1 16 . 1 1 28 28 PRO C C 28 176.720 176.720 176.800 -0.080 19205
2649 1 16 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.397 0.089 19205
2650 1 16 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.668 -0.115 19205
2651 1 16 . 1 1 29 29 ASN N N 29 114.300 114.300 116.256 -1.956 19205
2652 1 16 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.671 -0.022 19205
2653 1 16 . 1 1 29 29 ASN C C 29 175.490 175.490 176.348 -0.858 19205
2654 1 16 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.876 -0.541 19205
2655 1 16 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.558 0.008 19205
2656 1 16 . 1 1 29 29 ASN H H 29 8.061 8.061 8.204 -0.143 19205
2657 1 16 . 1 1 30 30 GLY N N 30 107.086 107.086 107.192 -0.106 19205
2658 1 16 . 1 1 30 30 GLY C C 30 173.758 173.758 172.852 0.906 19205
2659 1 16 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.157 1.155 19205
2660 1 16 . 1 1 30 30 GLY H H 30 8.294 8.294 7.968 0.326 19205
2661 1 16 . 1 1 31 31 PHE N N 31 115.129 115.129 118.803 -3.674 19205
2662 1 16 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.320 0.030 19205
2663 1 16 . 1 1 31 31 PHE C C 31 176.773 176.773 175.400 1.373 19205
2664 1 16 . 1 1 31 31 PHE CA C 31 56.410 56.410 55.938 0.472 19205
2665 1 16 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.296 0.178 19205
2666 1 16 . 1 1 31 31 PHE H H 31 7.167 7.167 8.181 -1.014 19205
2667 1 16 . 1 1 32 32 CYS N N 32 123.123 123.123 120.876 2.247 19205
2668 1 16 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.208 -0.109 19205
2669 1 16 . 1 1 32 32 CYS C C 32 175.875 175.875 175.847 0.028 19205
2670 1 16 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.343 -3.913 19205
2671 1 16 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.641 15.446 19205
2672 1 16 . 1 1 32 32 CYS H H 32 8.708 8.708 8.931 -0.223 19205
2673 1 17 . 1 1 2 2 CYS N N 2 120.511 120.511 120.734 -0.223 19205
2674 1 17 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.827 0.046 19205
2675 1 17 . 1 1 2 2 CYS CA C 2 53.145 53.145 55.071 -1.926 19205
2676 1 17 . 1 1 2 2 CYS CB C 2 41.921 41.921 27.137 14.784 19205
2677 1 17 . 1 1 2 2 CYS H H 2 8.866 8.866 8.360 0.506 19205
2678 1 17 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.230 0.068 19205
2679 1 17 . 1 1 3 3 PRO C C 3 176.294 176.294 175.584 0.710 19205
2680 1 17 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.025 0.749 19205
2681 1 17 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.306 1.585 19205
2682 1 17 . 1 1 4 4 GLN N N 4 118.141 118.141 118.716 -0.575 19205
2683 1 17 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.671 -0.777 19205
2684 1 17 . 1 1 4 4 GLN C C 4 176.143 176.143 174.738 1.405 19205
2685 1 17 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.167 1.006 19205
2686 1 17 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.353 -0.785 19205
2687 1 17 . 1 1 4 4 GLN H H 4 7.648 7.648 8.319 -0.671 19205
2688 1 17 . 1 1 5 5 GLY N N 5 108.656 108.656 106.397 2.259 19205
2689 1 17 . 1 1 5 5 GLY C C 5 173.733 173.733 173.663 0.070 19205
2690 1 17 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.312 -0.055 19205
2691 1 17 . 1 1 5 5 GLY H H 5 7.759 7.759 8.001 -0.242 19205
2692 1 17 . 1 1 6 6 ARG N N 6 119.446 119.446 120.381 -0.935 19205
2693 1 17 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.839 -0.450 19205
2694 1 17 . 1 1 6 6 ARG C C 6 176.780 176.780 176.860 -0.080 19205
2695 1 17 . 1 1 6 6 ARG CA C 6 55.538 55.538 54.259 1.279 19205
2696 1 17 . 1 1 6 6 ARG CB C 6 31.543 31.543 32.114 -0.571 19205
2697 1 17 . 1 1 6 6 ARG H H 6 7.865 7.865 8.011 -0.146 19205
2698 1 17 . 1 1 7 7 GLY N N 7 109.318 109.318 109.237 0.081 19205
2699 1 17 . 1 1 7 7 GLY C C 7 174.275 174.275 174.851 -0.576 19205
2700 1 17 . 1 1 7 7 GLY CA C 7 46.020 46.020 46.709 -0.689 19205
2701 1 17 . 1 1 7 7 GLY H H 7 8.529 8.529 8.494 0.035 19205
2702 1 17 . 1 1 8 8 ASP N N 8 121.036 121.036 118.483 2.553 19205
2703 1 17 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.717 -0.162 19205
2704 1 17 . 1 1 8 8 ASP C C 8 175.562 175.562 175.684 -0.122 19205
2705 1 17 . 1 1 8 8 ASP CA C 8 53.748 53.748 54.136 -0.388 19205
2706 1 17 . 1 1 8 8 ASP CB C 8 40.059 40.059 41.277 -1.218 19205
2707 1 17 . 1 1 8 8 ASP H H 8 8.414 8.414 8.634 -0.220 19205
2708 1 17 . 1 1 9 9 TRP N N 9 121.704 121.704 122.248 -0.544 19205
2709 1 17 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.636 -0.143 19205
2710 1 17 . 1 1 9 9 TRP C C 9 175.498 175.498 175.215 0.283 19205
2711 1 17 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.827 1.268 19205
2712 1 17 . 1 1 9 9 TRP CB C 9 29.809 29.809 28.210 1.599 19205
2713 1 17 . 1 1 9 9 TRP H H 9 7.814 7.814 8.111 -0.297 19205
2714 1 17 . 1 1 10 10 ALA N N 10 128.588 128.588 128.330 0.258 19205
2715 1 17 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.432 -0.019 19205
2716 1 17 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.613 -0.343 19205
2717 1 17 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.606 -0.491 19205
2718 1 17 . 1 1 10 10 ALA H H 10 8.163 8.163 7.766 0.397 19205
2719 1 17 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.833 -0.502 19205
2720 1 17 . 1 1 11 11 PRO C C 11 176.753 176.753 176.840 -0.087 19205
2721 1 17 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.197 0.799 19205
2722 1 17 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.313 0.132 19205
2723 1 17 . 1 1 12 12 THR N N 12 119.798 119.798 117.162 2.636 19205
2724 1 17 . 1 1 12 12 THR HA H 12 4.512 4.512 4.646 -0.134 19205
2725 1 17 . 1 1 12 12 THR C C 12 173.572 173.572 174.408 -0.836 19205
2726 1 17 . 1 1 12 12 THR CA C 12 62.099 62.099 62.183 -0.084 19205
2727 1 17 . 1 1 12 12 THR CB C 12 71.060 71.060 70.020 1.040 19205
2728 1 17 . 1 1 12 12 THR H H 12 9.006 9.006 8.487 0.519 19205
2729 1 17 . 1 1 13 13 SER N N 13 123.494 123.494 121.801 1.693 19205
2730 1 17 . 1 1 13 13 SER HA H 13 4.539 4.539 4.387 0.152 19205
2731 1 17 . 1 1 13 13 SER C C 13 172.953 172.953 174.380 -1.427 19205
2732 1 17 . 1 1 13 13 SER CA C 13 58.421 58.421 59.204 -0.783 19205
2733 1 17 . 1 1 13 13 SER CB C 13 63.844 63.844 63.411 0.433 19205
2734 1 17 . 1 1 13 13 SER H H 13 8.805 8.805 8.823 -0.018 19205
2735 1 17 . 1 1 14 14 CYS N N 14 116.548 116.548 122.181 -5.633 19205
2736 1 17 . 1 1 14 14 CYS HA H 14 4.940 4.940 5.145 -0.205 19205
2737 1 17 . 1 1 14 14 CYS C C 14 172.746 172.746 173.751 -1.005 19205
2738 1 17 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.303 -2.497 19205
2739 1 17 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.192 16.413 19205
2740 1 17 . 1 1 14 14 CYS H H 14 8.265 8.265 8.462 -0.197 19205
2741 1 17 . 1 1 15 15 SER N N 15 113.958 113.958 113.942 0.016 19205
2742 1 17 . 1 1 15 15 SER HA H 15 4.531 4.531 4.591 -0.060 19205
2743 1 17 . 1 1 15 15 SER C C 15 173.205 173.205 173.882 -0.677 19205
2744 1 17 . 1 1 15 15 SER CA C 15 58.826 58.826 58.636 0.190 19205
2745 1 17 . 1 1 15 15 SER CB C 15 65.097 65.097 64.814 0.283 19205
2746 1 17 . 1 1 15 15 SER H H 15 9.497 9.497 9.235 0.262 19205
2747 1 17 . 1 1 16 16 GLN N N 16 118.516 118.516 119.428 -0.912 19205
2748 1 17 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.766 -0.022 19205
2749 1 17 . 1 1 16 16 GLN C C 16 176.335 176.335 174.714 1.621 19205
2750 1 17 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.386 -0.445 19205
2751 1 17 . 1 1 16 16 GLN CB C 16 31.323 31.323 30.786 0.537 19205
2752 1 17 . 1 1 16 16 GLN H H 16 8.049 8.049 8.152 -0.103 19205
2753 1 17 . 1 1 17 17 ASP N N 17 124.190 124.190 121.638 2.552 19205
2754 1 17 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.511 -0.402 19205
2755 1 17 . 1 1 17 17 ASP C C 17 178.349 178.349 178.292 0.057 19205
2756 1 17 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.150 1.797 19205
2757 1 17 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.319 -0.796 19205
2758 1 17 . 1 1 17 17 ASP H H 17 9.208 9.208 8.881 0.327 19205
2759 1 17 . 1 1 18 18 SER N N 18 112.259 112.259 112.792 -0.533 19205
2760 1 17 . 1 1 18 18 SER HA H 18 4.228 4.228 4.267 -0.039 19205
2761 1 17 . 1 1 18 18 SER C C 18 175.037 175.037 175.183 -0.146 19205
2762 1 17 . 1 1 18 18 SER CA C 18 60.093 60.093 59.880 0.213 19205
2763 1 17 . 1 1 18 18 SER CB C 18 62.134 62.134 63.045 -0.911 19205
2764 1 17 . 1 1 18 18 SER H H 18 8.371 8.371 8.147 0.224 19205
2765 1 17 . 1 1 19 19 ASP N N 19 120.750 120.750 120.727 0.023 19205
2766 1 17 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.626 -0.035 19205
2767 1 17 . 1 1 19 19 ASP C C 19 175.958 175.958 176.435 -0.477 19205
2768 1 17 . 1 1 19 19 ASP CA C 19 55.885 55.885 55.276 0.609 19205
2769 1 17 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.219 0.803 19205
2770 1 17 . 1 1 19 19 ASP H H 19 7.697 7.697 7.723 -0.026 19205
2771 1 17 . 1 1 20 20 CYS N N 20 118.125 118.125 116.561 1.564 19205
2772 1 17 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.673 0.304 19205
2773 1 17 . 1 1 20 20 CYS C C 20 174.152 174.152 174.747 -0.595 19205
2774 1 17 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.200 -6.219 19205
2775 1 17 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.647 10.327 19205
2776 1 17 . 1 1 20 20 CYS H H 20 7.947 7.947 7.666 0.281 19205
2777 1 17 . 1 1 21 21 LEU N N 21 121.658 121.658 121.236 0.422 19205
2778 1 17 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.363 -0.196 19205
2779 1 17 . 1 1 21 21 LEU C C 21 176.589 176.589 177.526 -0.937 19205
2780 1 17 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.485 0.401 19205
2781 1 17 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.763 0.161 19205
2782 1 17 . 1 1 21 21 LEU H H 21 8.522 8.522 8.384 0.138 19205
2783 1 17 . 1 1 22 22 ALA N N 22 121.907 121.907 122.831 -0.924 19205
2784 1 17 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.200 -0.128 19205
2785 1 17 . 1 1 22 22 ALA C C 22 178.382 178.382 178.533 -0.151 19205
2786 1 17 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.457 0.508 19205
2787 1 17 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.380 -0.436 19205
2788 1 17 . 1 1 22 22 ALA H H 22 8.104 8.104 8.434 -0.330 19205
2789 1 17 . 1 1 23 23 GLY N N 23 110.790 110.790 112.171 -1.381 19205
2790 1 17 . 1 1 23 23 GLY C C 23 174.553 174.553 174.678 -0.125 19205
2791 1 17 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.696 -0.075 19205
2792 1 17 . 1 1 23 23 GLY H H 23 8.644 8.644 8.800 -0.156 19205
2793 1 17 . 1 1 24 24 CYS N N 24 119.431 119.431 119.286 0.145 19205
2794 1 17 . 1 1 24 24 CYS HA H 24 4.850 4.850 5.070 -0.220 19205
2795 1 17 . 1 1 24 24 CYS C C 24 172.768 172.768 173.999 -1.231 19205
2796 1 17 . 1 1 24 24 CYS CA C 24 54.902 54.902 57.936 -3.034 19205
2797 1 17 . 1 1 24 24 CYS CB C 24 46.168 46.168 29.915 16.253 19205
2798 1 17 . 1 1 24 24 CYS H H 24 8.491 8.491 7.703 0.788 19205
2799 1 17 . 1 1 25 25 VAL N N 25 115.469 115.469 116.585 -1.116 19205
2800 1 17 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.666 -0.299 19205
2801 1 17 . 1 1 25 25 VAL C C 25 175.161 175.161 173.771 1.390 19205
2802 1 17 . 1 1 25 25 VAL CA C 25 59.327 59.327 58.871 0.456 19205
2803 1 17 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.401 0.634 19205
2804 1 17 . 1 1 25 25 VAL H H 25 9.324 9.324 9.128 0.196 19205
2805 1 17 . 1 1 26 26 CYS N N 26 123.350 123.350 121.254 2.096 19205
2806 1 17 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.693 0.117 19205
2807 1 17 . 1 1 26 26 CYS C C 26 174.891 174.891 175.798 -0.907 19205
2808 1 17 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.848 -3.649 19205
2809 1 17 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.858 12.402 19205
2810 1 17 . 1 1 26 26 CYS H H 26 9.346 9.346 8.940 0.406 19205
2811 1 17 . 1 1 27 27 GLY N N 27 117.742 117.742 116.615 1.127 19205
2812 1 17 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.022 1.436 19205
2813 1 17 . 1 1 27 27 GLY H H 27 8.259 8.259 8.966 -0.707 19205
2814 1 17 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.448 -0.078 19205
2815 1 17 . 1 1 28 28 PRO C C 28 176.720 176.720 176.812 -0.092 19205
2816 1 17 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.376 0.110 19205
2817 1 17 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.676 -0.123 19205
2818 1 17 . 1 1 29 29 ASN N N 29 114.300 114.300 116.516 -2.216 19205
2819 1 17 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.669 -0.020 19205
2820 1 17 . 1 1 29 29 ASN C C 29 175.490 175.490 176.381 -0.891 19205
2821 1 17 . 1 1 29 29 ASN CA C 29 52.335 52.335 53.024 -0.689 19205
2822 1 17 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.652 -0.086 19205
2823 1 17 . 1 1 29 29 ASN H H 29 8.061 8.061 8.264 -0.203 19205
2824 1 17 . 1 1 30 30 GLY N N 30 107.086 107.086 106.886 0.200 19205
2825 1 17 . 1 1 30 30 GLY C C 30 173.758 173.758 172.808 0.950 19205
2826 1 17 . 1 1 30 30 GLY CA C 30 46.312 46.312 44.939 1.373 19205
2827 1 17 . 1 1 30 30 GLY H H 30 8.294 8.294 7.878 0.416 19205
2828 1 17 . 1 1 31 31 PHE N N 31 115.129 115.129 118.547 -3.418 19205
2829 1 17 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.346 0.004 19205
2830 1 17 . 1 1 31 31 PHE C C 31 176.773 176.773 175.339 1.434 19205
2831 1 17 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.043 0.367 19205
2832 1 17 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.579 -0.105 19205
2833 1 17 . 1 1 31 31 PHE H H 31 7.167 7.167 8.347 -1.180 19205
2834 1 17 . 1 1 32 32 CYS N N 32 123.123 123.123 120.630 2.493 19205
2835 1 17 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.098 0.001 19205
2836 1 17 . 1 1 32 32 CYS C C 32 175.875 175.875 175.824 0.051 19205
2837 1 17 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.414 -3.984 19205
2838 1 17 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.393 15.694 19205
2839 1 17 . 1 1 32 32 CYS H H 32 8.708 8.708 8.970 -0.262 19205
2840 1 18 . 1 1 2 2 CYS N N 2 120.511 120.511 117.972 2.539 19205
2841 1 18 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.855 0.018 19205
2842 1 18 . 1 1 2 2 CYS CA C 2 53.145 53.145 55.112 -1.967 19205
2843 1 18 . 1 1 2 2 CYS CB C 2 41.921 41.921 26.948 14.973 19205
2844 1 18 . 1 1 2 2 CYS H H 2 8.866 8.866 8.630 0.236 19205
2845 1 18 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.180 0.118 19205
2846 1 18 . 1 1 3 3 PRO C C 3 176.294 176.294 175.510 0.784 19205
2847 1 18 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.016 0.758 19205
2848 1 18 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.019 1.872 19205
2849 1 18 . 1 1 4 4 GLN N N 4 118.141 118.141 118.259 -0.118 19205
2850 1 18 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.660 -0.766 19205
2851 1 18 . 1 1 4 4 GLN C C 4 176.143 176.143 174.793 1.350 19205
2852 1 18 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.087 1.086 19205
2853 1 18 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.091 -0.523 19205
2854 1 18 . 1 1 4 4 GLN H H 4 7.648 7.648 8.249 -0.601 19205
2855 1 18 . 1 1 5 5 GLY N N 5 108.656 108.656 106.660 1.996 19205
2856 1 18 . 1 1 5 5 GLY C C 5 173.733 173.733 173.516 0.217 19205
2857 1 18 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.409 -0.152 19205
2858 1 18 . 1 1 5 5 GLY H H 5 7.759 7.759 7.934 -0.175 19205
2859 1 18 . 1 1 6 6 ARG N N 6 119.446 119.446 120.272 -0.826 19205
2860 1 18 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.891 -0.502 19205
2861 1 18 . 1 1 6 6 ARG C C 6 176.780 176.780 177.802 -1.022 19205
2862 1 18 . 1 1 6 6 ARG CA C 6 55.538 55.538 53.647 1.891 19205
2863 1 18 . 1 1 6 6 ARG CB C 6 31.543 31.543 32.035 -0.492 19205
2864 1 18 . 1 1 6 6 ARG H H 6 7.865 7.865 8.347 -0.482 19205
2865 1 18 . 1 1 7 7 GLY N N 7 109.318 109.318 109.848 -0.530 19205
2866 1 18 . 1 1 7 7 GLY C C 7 174.275 174.275 174.824 -0.549 19205
2867 1 18 . 1 1 7 7 GLY CA C 7 46.020 46.020 47.419 -1.399 19205
2868 1 18 . 1 1 7 7 GLY H H 7 8.529 8.529 8.621 -0.092 19205
2869 1 18 . 1 1 8 8 ASP N N 8 121.036 121.036 119.886 1.150 19205
2870 1 18 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.747 -0.192 19205
2871 1 18 . 1 1 8 8 ASP C C 8 175.562 175.562 174.659 0.903 19205
2872 1 18 . 1 1 8 8 ASP CA C 8 53.748 53.748 53.367 0.381 19205
2873 1 18 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.806 -0.747 19205
2874 1 18 . 1 1 8 8 ASP H H 8 8.414 8.414 8.619 -0.205 19205
2875 1 18 . 1 1 9 9 TRP N N 9 121.704 121.704 122.714 -1.010 19205
2876 1 18 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.823 -0.330 19205
2877 1 18 . 1 1 9 9 TRP C C 9 175.498 175.498 174.780 0.718 19205
2878 1 18 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.884 1.210 19205
2879 1 18 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.572 0.237 19205
2880 1 18 . 1 1 9 9 TRP H H 9 7.814 7.814 7.966 -0.152 19205
2881 1 18 . 1 1 10 10 ALA N N 10 128.588 128.588 127.777 0.811 19205
2882 1 18 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.444 -0.031 19205
2883 1 18 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.538 -0.267 19205
2884 1 18 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.630 -0.515 19205
2885 1 18 . 1 1 10 10 ALA H H 10 8.163 8.163 8.250 -0.087 19205
2886 1 18 . 1 1 11 11 PRO HA H 11 4.331 4.331 5.011 -0.680 19205
2887 1 18 . 1 1 11 11 PRO C C 11 176.753 176.753 176.715 0.038 19205
2888 1 18 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.069 0.927 19205
2889 1 18 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.493 -0.048 19205
2890 1 18 . 1 1 12 12 THR N N 12 119.798 119.798 117.427 2.371 19205
2891 1 18 . 1 1 12 12 THR HA H 12 4.512 4.512 4.697 -0.185 19205
2892 1 18 . 1 1 12 12 THR C C 12 173.572 173.572 174.515 -0.943 19205
2893 1 18 . 1 1 12 12 THR CA C 12 62.099 62.099 62.101 -0.002 19205
2894 1 18 . 1 1 12 12 THR CB C 12 71.060 71.060 70.115 0.944 19205
2895 1 18 . 1 1 12 12 THR H H 12 9.006 9.006 8.664 0.342 19205
2896 1 18 . 1 1 13 13 SER N N 13 123.494 123.494 122.167 1.327 19205
2897 1 18 . 1 1 13 13 SER HA H 13 4.539 4.539 4.424 0.115 19205
2898 1 18 . 1 1 13 13 SER C C 13 172.953 172.953 174.541 -1.588 19205
2899 1 18 . 1 1 13 13 SER CA C 13 58.421 58.421 59.874 -1.453 19205
2900 1 18 . 1 1 13 13 SER CB C 13 63.844 63.844 63.527 0.317 19205
2901 1 18 . 1 1 13 13 SER H H 13 8.805 8.805 8.827 -0.022 19205
2902 1 18 . 1 1 14 14 CYS N N 14 116.548 116.548 122.277 -5.729 19205
2903 1 18 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.847 0.093 19205
2904 1 18 . 1 1 14 14 CYS C C 14 172.746 172.746 173.238 -0.492 19205
2905 1 18 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.185 -2.379 19205
2906 1 18 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.138 16.467 19205
2907 1 18 . 1 1 14 14 CYS H H 14 8.265 8.265 8.521 -0.256 19205
2908 1 18 . 1 1 15 15 SER N N 15 113.958 113.958 113.880 0.078 19205
2909 1 18 . 1 1 15 15 SER HA H 15 4.531 4.531 4.614 -0.083 19205
2910 1 18 . 1 1 15 15 SER C C 15 173.205 173.205 173.784 -0.579 19205
2911 1 18 . 1 1 15 15 SER CA C 15 58.826 58.826 58.841 -0.015 19205
2912 1 18 . 1 1 15 15 SER CB C 15 65.097 65.097 65.318 -0.221 19205
2913 1 18 . 1 1 15 15 SER H H 15 9.497 9.497 9.241 0.256 19205
2914 1 18 . 1 1 16 16 GLN N N 16 118.516 118.516 118.892 -0.376 19205
2915 1 18 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.696 0.048 19205
2916 1 18 . 1 1 16 16 GLN C C 16 176.335 176.335 174.592 1.743 19205
2917 1 18 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.544 -0.602 19205
2918 1 18 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.148 0.175 19205
2919 1 18 . 1 1 16 16 GLN H H 16 8.049 8.049 8.036 0.013 19205
2920 1 18 . 1 1 17 17 ASP N N 17 124.190 124.190 121.720 2.470 19205
2921 1 18 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.450 -0.341 19205
2922 1 18 . 1 1 17 17 ASP C C 17 178.349 178.349 177.943 0.406 19205
2923 1 18 . 1 1 17 17 ASP CA C 17 58.947 58.947 56.994 1.953 19205
2924 1 18 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.426 -0.903 19205
2925 1 18 . 1 1 17 17 ASP H H 17 9.208 9.208 8.861 0.347 19205
2926 1 18 . 1 1 18 18 SER N N 18 112.259 112.259 111.664 0.595 19205
2927 1 18 . 1 1 18 18 SER HA H 18 4.228 4.228 4.281 -0.053 19205
2928 1 18 . 1 1 18 18 SER C C 18 175.037 175.037 175.051 -0.014 19205
2929 1 18 . 1 1 18 18 SER CA C 18 60.093 60.093 59.784 0.309 19205
2930 1 18 . 1 1 18 18 SER CB C 18 62.134 62.134 63.115 -0.981 19205
2931 1 18 . 1 1 18 18 SER H H 18 8.371 8.371 8.045 0.326 19205
2932 1 18 . 1 1 19 19 ASP N N 19 120.750 120.750 121.474 -0.724 19205
2933 1 18 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.669 -0.078 19205
2934 1 18 . 1 1 19 19 ASP C C 19 175.958 175.958 176.564 -0.606 19205
2935 1 18 . 1 1 19 19 ASP CA C 19 55.885 55.885 55.154 0.730 19205
2936 1 18 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.170 0.852 19205
2937 1 18 . 1 1 19 19 ASP H H 19 7.697 7.697 7.894 -0.197 19205
2938 1 18 . 1 1 20 20 CYS N N 20 118.125 118.125 116.599 1.526 19205
2939 1 18 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.686 0.291 19205
2940 1 18 . 1 1 20 20 CYS C C 20 174.152 174.152 174.816 -0.664 19205
2941 1 18 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.274 -6.293 19205
2942 1 18 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.663 10.311 19205
2943 1 18 . 1 1 20 20 CYS H H 20 7.947 7.947 7.620 0.327 19205
2944 1 18 . 1 1 21 21 LEU N N 21 121.658 121.658 121.229 0.429 19205
2945 1 18 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.356 -0.189 19205
2946 1 18 . 1 1 21 21 LEU C C 21 176.589 176.589 177.588 -0.999 19205
2947 1 18 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.549 0.337 19205
2948 1 18 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.629 0.294 19205
2949 1 18 . 1 1 21 21 LEU H H 21 8.522 8.522 8.464 0.058 19205
2950 1 18 . 1 1 22 22 ALA N N 22 121.907 121.907 123.033 -1.126 19205
2951 1 18 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.141 -0.069 19205
2952 1 18 . 1 1 22 22 ALA C C 22 178.382 178.382 178.548 -0.166 19205
2953 1 18 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.627 0.338 19205
2954 1 18 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.220 -0.276 19205
2955 1 18 . 1 1 22 22 ALA H H 22 8.104 8.104 8.441 -0.337 19205
2956 1 18 . 1 1 23 23 GLY N N 23 110.790 110.790 111.609 -0.819 19205
2957 1 18 . 1 1 23 23 GLY C C 23 174.553 174.553 174.625 -0.072 19205
2958 1 18 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.858 -0.237 19205
2959 1 18 . 1 1 23 23 GLY H H 23 8.644 8.644 8.636 0.008 19205
2960 1 18 . 1 1 24 24 CYS N N 24 119.431 119.431 119.905 -0.474 19205
2961 1 18 . 1 1 24 24 CYS HA H 24 4.850 4.850 4.727 0.123 19205
2962 1 18 . 1 1 24 24 CYS C C 24 172.768 172.768 174.106 -1.338 19205
2963 1 18 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.784 -3.882 19205
2964 1 18 . 1 1 24 24 CYS CB C 24 46.168 46.168 29.489 16.679 19205
2965 1 18 . 1 1 24 24 CYS H H 24 8.491 8.491 7.620 0.871 19205
2966 1 18 . 1 1 25 25 VAL N N 25 115.469 115.469 117.077 -1.608 19205
2967 1 18 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.621 -0.254 19205
2968 1 18 . 1 1 25 25 VAL C C 25 175.161 175.161 173.927 1.234 19205
2969 1 18 . 1 1 25 25 VAL CA C 25 59.327 59.327 59.258 0.069 19205
2970 1 18 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.392 0.643 19205
2971 1 18 . 1 1 25 25 VAL H H 25 9.324 9.324 9.048 0.276 19205
2972 1 18 . 1 1 26 26 CYS N N 26 123.350 123.350 121.515 1.835 19205
2973 1 18 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.773 0.037 19205
2974 1 18 . 1 1 26 26 CYS C C 26 174.891 174.891 176.062 -1.171 19205
2975 1 18 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.818 -3.619 19205
2976 1 18 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.461 12.799 19205
2977 1 18 . 1 1 26 26 CYS H H 26 9.346 9.346 8.831 0.515 19205
2978 1 18 . 1 1 27 27 GLY N N 27 117.742 117.742 116.747 0.995 19205
2979 1 18 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.161 1.297 19205
2980 1 18 . 1 1 27 27 GLY H H 27 8.259 8.259 8.877 -0.618 19205
2981 1 18 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.434 -0.065 19205
2982 1 18 . 1 1 28 28 PRO C C 28 176.720 176.720 176.750 -0.030 19205
2983 1 18 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.430 0.056 19205
2984 1 18 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.654 -0.101 19205
2985 1 18 . 1 1 29 29 ASN N N 29 114.300 114.300 116.251 -1.951 19205
2986 1 18 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.706 -0.057 19205
2987 1 18 . 1 1 29 29 ASN C C 29 175.490 175.490 176.391 -0.901 19205
2988 1 18 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.812 -0.477 19205
2989 1 18 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.648 -0.082 19205
2990 1 18 . 1 1 29 29 ASN H H 29 8.061 8.061 8.207 -0.146 19205
2991 1 18 . 1 1 30 30 GLY N N 30 107.086 107.086 107.369 -0.283 19205
2992 1 18 . 1 1 30 30 GLY C C 30 173.758 173.758 172.906 0.852 19205
2993 1 18 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.269 1.043 19205
2994 1 18 . 1 1 30 30 GLY H H 30 8.294 8.294 7.967 0.327 19205
2995 1 18 . 1 1 31 31 PHE N N 31 115.129 115.129 118.250 -3.121 19205
2996 1 18 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.395 -0.045 19205
2997 1 18 . 1 1 31 31 PHE C C 31 176.773 176.773 175.455 1.318 19205
2998 1 18 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.002 0.408 19205
2999 1 18 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.586 -0.112 19205
3000 1 18 . 1 1 31 31 PHE H H 31 7.167 7.167 8.214 -1.047 19205
3001 1 18 . 1 1 32 32 CYS N N 32 123.123 123.123 120.851 2.272 19205
3002 1 18 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.137 -0.038 19205
3003 1 18 . 1 1 32 32 CYS C C 32 175.875 175.875 175.853 0.022 19205
3004 1 18 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.390 -3.960 19205
3005 1 18 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.532 15.555 19205
3006 1 18 . 1 1 32 32 CYS H H 32 8.708 8.708 8.883 -0.175 19205
3007 1 19 . 1 1 2 2 CYS N N 2 120.511 120.511 119.466 1.045 19205
3008 1 19 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.976 -0.103 19205
3009 1 19 . 1 1 2 2 CYS CA C 2 53.145 53.145 55.995 -2.850 19205
3010 1 19 . 1 1 2 2 CYS CB C 2 41.921 41.921 30.029 11.892 19205
3011 1 19 . 1 1 2 2 CYS H H 2 8.866 8.866 8.361 0.505 19205
3012 1 19 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.201 0.097 19205
3013 1 19 . 1 1 3 3 PRO C C 3 176.294 176.294 175.589 0.705 19205
3014 1 19 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.086 0.688 19205
3015 1 19 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.244 1.647 19205
3016 1 19 . 1 1 4 4 GLN N N 4 118.141 118.141 117.503 0.638 19205
3017 1 19 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.652 -0.758 19205
3018 1 19 . 1 1 4 4 GLN C C 4 176.143 176.143 175.469 0.674 19205
3019 1 19 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.196 0.977 19205
3020 1 19 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.804 -1.236 19205
3021 1 19 . 1 1 4 4 GLN H H 4 7.648 7.648 8.296 -0.648 19205
3022 1 19 . 1 1 5 5 GLY N N 5 108.656 108.656 106.732 1.924 19205
3023 1 19 . 1 1 5 5 GLY C C 5 173.733 173.733 173.983 -0.250 19205
3024 1 19 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.618 -0.361 19205
3025 1 19 . 1 1 5 5 GLY H H 5 7.759 7.759 7.574 0.185 19205
3026 1 19 . 1 1 6 6 ARG N N 6 119.446 119.446 120.490 -1.044 19205
3027 1 19 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.798 -0.409 19205
3028 1 19 . 1 1 6 6 ARG C C 6 176.780 176.780 177.018 -0.238 19205
3029 1 19 . 1 1 6 6 ARG CA C 6 55.538 55.538 53.733 1.805 19205
3030 1 19 . 1 1 6 6 ARG CB C 6 31.543 31.543 31.529 0.014 19205
3031 1 19 . 1 1 6 6 ARG H H 6 7.865 7.865 7.736 0.129 19205
3032 1 19 . 1 1 7 7 GLY N N 7 109.318 109.318 109.011 0.307 19205
3033 1 19 . 1 1 7 7 GLY C C 7 174.275 174.275 174.935 -0.660 19205
3034 1 19 . 1 1 7 7 GLY CA C 7 46.020 46.020 46.586 -0.565 19205
3035 1 19 . 1 1 7 7 GLY H H 7 8.529 8.529 8.570 -0.041 19205
3036 1 19 . 1 1 8 8 ASP N N 8 121.036 121.036 119.194 1.842 19205
3037 1 19 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.770 -0.215 19205
3038 1 19 . 1 1 8 8 ASP C C 8 175.562 175.562 175.984 -0.422 19205
3039 1 19 . 1 1 8 8 ASP CA C 8 53.748 53.748 54.148 -0.400 19205
3040 1 19 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.845 -0.786 19205
3041 1 19 . 1 1 8 8 ASP H H 8 8.414 8.414 8.568 -0.154 19205
3042 1 19 . 1 1 9 9 TRP N N 9 121.704 121.704 122.344 -0.640 19205
3043 1 19 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.748 -0.255 19205
3044 1 19 . 1 1 9 9 TRP C C 9 175.498 175.498 174.914 0.584 19205
3045 1 19 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.941 1.153 19205
3046 1 19 . 1 1 9 9 TRP CB C 9 29.809 29.809 28.773 1.036 19205
3047 1 19 . 1 1 9 9 TRP H H 9 7.814 7.814 7.387 0.427 19205
3048 1 19 . 1 1 10 10 ALA N N 10 128.588 128.588 128.555 0.033 19205
3049 1 19 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.417 -0.004 19205
3050 1 19 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.654 -0.384 19205
3051 1 19 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.615 -0.500 19205
3052 1 19 . 1 1 10 10 ALA H H 10 8.163 8.163 8.003 0.160 19205
3053 1 19 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.826 -0.495 19205
3054 1 19 . 1 1 11 11 PRO C C 11 176.753 176.753 176.794 -0.041 19205
3055 1 19 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.221 0.775 19205
3056 1 19 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.465 -0.020 19205
3057 1 19 . 1 1 12 12 THR N N 12 119.798 119.798 117.051 2.747 19205
3058 1 19 . 1 1 12 12 THR HA H 12 4.512 4.512 4.761 -0.249 19205
3059 1 19 . 1 1 12 12 THR C C 12 173.572 173.572 174.703 -1.131 19205
3060 1 19 . 1 1 12 12 THR CA C 12 62.099 62.099 61.988 0.111 19205
3061 1 19 . 1 1 12 12 THR CB C 12 71.060 71.060 70.196 0.864 19205
3062 1 19 . 1 1 12 12 THR H H 12 9.006 9.006 8.697 0.309 19205
3063 1 19 . 1 1 13 13 SER N N 13 123.494 123.494 121.967 1.527 19205
3064 1 19 . 1 1 13 13 SER HA H 13 4.539 4.539 4.455 0.084 19205
3065 1 19 . 1 1 13 13 SER C C 13 172.953 172.953 174.484 -1.531 19205
3066 1 19 . 1 1 13 13 SER CA C 13 58.421 58.421 58.342 0.079 19205
3067 1 19 . 1 1 13 13 SER CB C 13 63.844 63.844 63.043 0.801 19205
3068 1 19 . 1 1 13 13 SER H H 13 8.805 8.805 8.766 0.039 19205
3069 1 19 . 1 1 14 14 CYS N N 14 116.548 116.548 120.283 -3.735 19205
3070 1 19 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.797 0.143 19205
3071 1 19 . 1 1 14 14 CYS C C 14 172.746 172.746 173.442 -0.696 19205
3072 1 19 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.752 -2.946 19205
3073 1 19 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.636 15.969 19205
3074 1 19 . 1 1 14 14 CYS H H 14 8.265 8.265 8.472 -0.207 19205
3075 1 19 . 1 1 15 15 SER N N 15 113.958 113.958 113.728 0.230 19205
3076 1 19 . 1 1 15 15 SER HA H 15 4.531 4.531 4.660 -0.129 19205
3077 1 19 . 1 1 15 15 SER C C 15 173.205 173.205 173.688 -0.483 19205
3078 1 19 . 1 1 15 15 SER CA C 15 58.826 58.826 58.465 0.361 19205
3079 1 19 . 1 1 15 15 SER CB C 15 65.097 65.097 65.139 -0.042 19205
3080 1 19 . 1 1 15 15 SER H H 15 9.497 9.497 9.124 0.373 19205
3081 1 19 . 1 1 16 16 GLN N N 16 118.516 118.516 118.799 -0.283 19205
3082 1 19 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.576 0.168 19205
3083 1 19 . 1 1 16 16 GLN C C 16 176.335 176.335 174.695 1.640 19205
3084 1 19 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.501 -0.560 19205
3085 1 19 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.573 -0.250 19205
3086 1 19 . 1 1 16 16 GLN H H 16 8.049 8.049 7.776 0.273 19205
3087 1 19 . 1 1 17 17 ASP N N 17 124.190 124.190 122.258 1.932 19205
3088 1 19 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.426 -0.317 19205
3089 1 19 . 1 1 17 17 ASP C C 17 178.349 178.349 177.941 0.408 19205
3090 1 19 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.023 1.924 19205
3091 1 19 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.175 -0.652 19205
3092 1 19 . 1 1 17 17 ASP H H 17 9.208 9.208 8.749 0.459 19205
3093 1 19 . 1 1 18 18 SER N N 18 112.259 112.259 112.183 0.076 19205
3094 1 19 . 1 1 18 18 SER HA H 18 4.228 4.228 4.293 -0.065 19205
3095 1 19 . 1 1 18 18 SER C C 18 175.037 175.037 174.997 0.040 19205
3096 1 19 . 1 1 18 18 SER CA C 18 60.093 60.093 59.711 0.382 19205
3097 1 19 . 1 1 18 18 SER CB C 18 62.134 62.134 62.933 -0.799 19205
3098 1 19 . 1 1 18 18 SER H H 18 8.371 8.371 8.175 0.196 19205
3099 1 19 . 1 1 19 19 ASP N N 19 120.750 120.750 120.551 0.199 19205
3100 1 19 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.680 -0.089 19205
3101 1 19 . 1 1 19 19 ASP C C 19 175.958 175.958 176.250 -0.292 19205
3102 1 19 . 1 1 19 19 ASP CA C 19 55.885 55.885 54.743 1.142 19205
3103 1 19 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.054 0.968 19205
3104 1 19 . 1 1 19 19 ASP H H 19 7.697 7.697 7.731 -0.034 19205
3105 1 19 . 1 1 20 20 CYS N N 20 118.125 118.125 116.604 1.521 19205
3106 1 19 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.710 0.267 19205
3107 1 19 . 1 1 20 20 CYS C C 20 174.152 174.152 174.889 -0.737 19205
3108 1 19 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.143 -6.162 19205
3109 1 19 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.965 10.009 19205
3110 1 19 . 1 1 20 20 CYS H H 20 7.947 7.947 7.635 0.312 19205
3111 1 19 . 1 1 21 21 LEU N N 21 121.658 121.658 121.580 0.078 19205
3112 1 19 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.337 -0.170 19205
3113 1 19 . 1 1 21 21 LEU C C 21 176.589 176.589 177.509 -0.920 19205
3114 1 19 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.579 0.307 19205
3115 1 19 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.588 0.335 19205
3116 1 19 . 1 1 21 21 LEU H H 21 8.522 8.522 8.418 0.104 19205
3117 1 19 . 1 1 22 22 ALA N N 22 121.907 121.907 123.006 -1.099 19205
3118 1 19 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.161 -0.089 19205
3119 1 19 . 1 1 22 22 ALA C C 22 178.382 178.382 178.499 -0.117 19205
3120 1 19 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.489 0.476 19205
3121 1 19 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.247 -0.303 19205
3122 1 19 . 1 1 22 22 ALA H H 22 8.104 8.104 8.433 -0.329 19205
3123 1 19 . 1 1 23 23 GLY N N 23 110.790 110.790 112.428 -1.638 19205
3124 1 19 . 1 1 23 23 GLY C C 23 174.553 174.553 174.850 -0.297 19205
3125 1 19 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.725 -0.104 19205
3126 1 19 . 1 1 23 23 GLY H H 23 8.644 8.644 8.791 -0.147 19205
3127 1 19 . 1 1 24 24 CYS N N 24 119.431 119.431 119.611 -0.180 19205
3128 1 19 . 1 1 24 24 CYS HA H 24 4.850 4.850 5.012 -0.162 19205
3129 1 19 . 1 1 24 24 CYS C C 24 172.768 172.768 174.547 -1.779 19205
3130 1 19 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.423 -3.521 19205
3131 1 19 . 1 1 24 24 CYS CB C 24 46.168 46.168 28.940 17.228 19205
3132 1 19 . 1 1 24 24 CYS H H 24 8.491 8.491 7.754 0.737 19205
3133 1 19 . 1 1 25 25 VAL N N 25 115.469 115.469 116.604 -1.135 19205
3134 1 19 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.582 -0.215 19205
3135 1 19 . 1 1 25 25 VAL C C 25 175.161 175.161 173.783 1.378 19205
3136 1 19 . 1 1 25 25 VAL CA C 25 59.327 59.327 58.789 0.538 19205
3137 1 19 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.199 0.836 19205
3138 1 19 . 1 1 25 25 VAL H H 25 9.324 9.324 9.013 0.311 19205
3139 1 19 . 1 1 26 26 CYS N N 26 123.350 123.350 120.308 3.042 19205
3140 1 19 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.905 -0.095 19205
3141 1 19 . 1 1 26 26 CYS C C 26 174.891 174.891 175.807 -0.916 19205
3142 1 19 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.527 -3.328 19205
3143 1 19 . 1 1 26 26 CYS CB C 26 38.260 38.260 26.270 11.991 19205
3144 1 19 . 1 1 26 26 CYS H H 26 9.346 9.346 8.852 0.494 19205
3145 1 19 . 1 1 27 27 GLY N N 27 117.742 117.742 116.225 1.517 19205
3146 1 19 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.043 1.415 19205
3147 1 19 . 1 1 27 27 GLY H H 27 8.259 8.259 9.089 -0.830 19205
3148 1 19 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.469 -0.099 19205
3149 1 19 . 1 1 28 28 PRO C C 28 176.720 176.720 176.689 0.031 19205
3150 1 19 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.353 0.133 19205
3151 1 19 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.635 -0.082 19205
3152 1 19 . 1 1 29 29 ASN N N 29 114.300 114.300 116.369 -2.069 19205
3153 1 19 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.699 -0.050 19205
3154 1 19 . 1 1 29 29 ASN C C 29 175.490 175.490 176.402 -0.912 19205
3155 1 19 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.873 -0.538 19205
3156 1 19 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.658 -0.092 19205
3157 1 19 . 1 1 29 29 ASN H H 29 8.061 8.061 8.193 -0.132 19205
3158 1 19 . 1 1 30 30 GLY N N 30 107.086 107.086 107.157 -0.071 19205
3159 1 19 . 1 1 30 30 GLY C C 30 173.758 173.758 172.911 0.847 19205
3160 1 19 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.150 1.162 19205
3161 1 19 . 1 1 30 30 GLY H H 30 8.294 8.294 7.951 0.343 19205
3162 1 19 . 1 1 31 31 PHE N N 31 115.129 115.129 118.408 -3.279 19205
3163 1 19 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.387 -0.037 19205
3164 1 19 . 1 1 31 31 PHE C C 31 176.773 176.773 175.385 1.388 19205
3165 1 19 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.067 0.343 19205
3166 1 19 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.601 -0.127 19205
3167 1 19 . 1 1 31 31 PHE H H 31 7.167 7.167 8.264 -1.097 19205
3168 1 19 . 1 1 32 32 CYS N N 32 123.123 123.123 120.735 2.388 19205
3169 1 19 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.247 -0.148 19205
3170 1 19 . 1 1 32 32 CYS C C 32 175.875 175.875 176.060 -0.185 19205
3171 1 19 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.347 -3.917 19205
3172 1 19 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.673 15.414 19205
3173 1 19 . 1 1 32 32 CYS H H 32 8.708 8.708 8.813 -0.105 19205
3174 1 20 . 1 1 2 2 CYS N N 2 120.511 120.511 117.452 3.059 19205
3175 1 20 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.998 -0.125 19205
3176 1 20 . 1 1 2 2 CYS CA C 2 53.145 53.145 57.055 -3.910 19205
3177 1 20 . 1 1 2 2 CYS CB C 2 41.921 41.921 28.811 13.110 19205
3178 1 20 . 1 1 2 2 CYS H H 2 8.866 8.866 8.158 0.708 19205
3179 1 20 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.232 0.066 19205
3180 1 20 . 1 1 3 3 PRO C C 3 176.294 176.294 175.825 0.469 19205
3181 1 20 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.416 0.358 19205
3182 1 20 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.389 1.502 19205
3183 1 20 . 1 1 4 4 GLN N N 4 118.141 118.141 117.380 0.761 19205
3184 1 20 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.643 -0.749 19205
3185 1 20 . 1 1 4 4 GLN C C 4 176.143 176.143 175.309 0.834 19205
3186 1 20 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.507 0.666 19205
3187 1 20 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.909 -1.341 19205
3188 1 20 . 1 1 4 4 GLN H H 4 7.648 7.648 8.355 -0.707 19205
3189 1 20 . 1 1 5 5 GLY N N 5 108.656 108.656 107.253 1.403 19205
3190 1 20 . 1 1 5 5 GLY C C 5 173.733 173.733 174.119 -0.386 19205
3191 1 20 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.406 -0.149 19205
3192 1 20 . 1 1 5 5 GLY H H 5 7.759 7.759 7.573 0.186 19205
3193 1 20 . 1 1 6 6 ARG N N 6 119.446 119.446 120.561 -1.115 19205
3194 1 20 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.611 -0.222 19205
3195 1 20 . 1 1 6 6 ARG C C 6 176.780 176.780 178.117 -1.337 19205
3196 1 20 . 1 1 6 6 ARG CA C 6 55.538 55.538 54.296 1.242 19205
3197 1 20 . 1 1 6 6 ARG CB C 6 31.543 31.543 30.983 0.560 19205
3198 1 20 . 1 1 6 6 ARG H H 6 7.865 7.865 7.643 0.222 19205
3199 1 20 . 1 1 7 7 GLY N N 7 109.318 109.318 110.389 -1.071 19205
3200 1 20 . 1 1 7 7 GLY C C 7 174.275 174.275 174.751 -0.476 19205
3201 1 20 . 1 1 7 7 GLY CA C 7 46.020 46.020 47.194 -1.174 19205
3202 1 20 . 1 1 7 7 GLY H H 7 8.529 8.529 8.823 -0.294 19205
3203 1 20 . 1 1 8 8 ASP N N 8 121.036 121.036 119.440 1.596 19205
3204 1 20 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.743 -0.188 19205
3205 1 20 . 1 1 8 8 ASP C C 8 175.562 175.562 175.753 -0.191 19205
3206 1 20 . 1 1 8 8 ASP CA C 8 53.748 53.748 54.127 -0.379 19205
3207 1 20 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.504 -0.445 19205
3208 1 20 . 1 1 8 8 ASP H H 8 8.414 8.414 8.558 -0.144 19205
3209 1 20 . 1 1 9 9 TRP N N 9 121.704 121.704 122.772 -1.068 19205
3210 1 20 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.773 -0.280 19205
3211 1 20 . 1 1 9 9 TRP C C 9 175.498 175.498 174.713 0.785 19205
3212 1 20 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.846 1.248 19205
3213 1 20 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.326 0.483 19205
3214 1 20 . 1 1 9 9 TRP H H 9 7.814 7.814 8.133 -0.319 19205
3215 1 20 . 1 1 10 10 ALA N N 10 128.588 128.588 128.280 0.308 19205
3216 1 20 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.404 0.009 19205
3217 1 20 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.703 -0.433 19205
3218 1 20 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.439 -0.324 19205
3219 1 20 . 1 1 10 10 ALA H H 10 8.163 8.163 8.053 0.110 19205
3220 1 20 . 1 1 11 11 PRO HA H 11 4.331 4.331 5.015 -0.684 19205
3221 1 20 . 1 1 11 11 PRO C C 11 176.753 176.753 176.722 0.031 19205
3222 1 20 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.024 0.972 19205
3223 1 20 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.512 -0.067 19205
3224 1 20 . 1 1 12 12 THR N N 12 119.798 119.798 116.821 2.977 19205
3225 1 20 . 1 1 12 12 THR HA H 12 4.512 4.512 4.816 -0.304 19205
3226 1 20 . 1 1 12 12 THR C C 12 173.572 173.572 174.648 -1.076 19205
3227 1 20 . 1 1 12 12 THR CA C 12 62.099 62.099 61.863 0.236 19205
3228 1 20 . 1 1 12 12 THR CB C 12 71.060 71.060 70.546 0.514 19205
3229 1 20 . 1 1 12 12 THR H H 12 9.006 9.006 8.517 0.489 19205
3230 1 20 . 1 1 13 13 SER N N 13 123.494 123.494 121.500 1.994 19205
3231 1 20 . 1 1 13 13 SER HA H 13 4.539 4.539 4.550 -0.011 19205
3232 1 20 . 1 1 13 13 SER C C 13 172.953 172.953 174.498 -1.545 19205
3233 1 20 . 1 1 13 13 SER CA C 13 58.421 58.421 58.282 0.139 19205
3234 1 20 . 1 1 13 13 SER CB C 13 63.844 63.844 63.227 0.617 19205
3235 1 20 . 1 1 13 13 SER H H 13 8.805 8.805 8.754 0.051 19205
3236 1 20 . 1 1 14 14 CYS N N 14 116.548 116.548 119.843 -3.295 19205
3237 1 20 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.994 -0.054 19205
3238 1 20 . 1 1 14 14 CYS C C 14 172.746 172.746 173.437 -0.691 19205
3239 1 20 . 1 1 14 14 CYS CA C 14 53.806 53.806 57.065 -3.259 19205
3240 1 20 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.399 16.206 19205
3241 1 20 . 1 1 14 14 CYS H H 14 8.265 8.265 8.142 0.123 19205
3242 1 20 . 1 1 15 15 SER N N 15 113.958 113.958 114.341 -0.383 19205
3243 1 20 . 1 1 15 15 SER HA H 15 4.531 4.531 4.613 -0.082 19205
3244 1 20 . 1 1 15 15 SER C C 15 173.205 173.205 173.712 -0.507 19205
3245 1 20 . 1 1 15 15 SER CA C 15 58.826 58.826 58.460 0.366 19205
3246 1 20 . 1 1 15 15 SER CB C 15 65.097 65.097 64.711 0.386 19205
3247 1 20 . 1 1 15 15 SER H H 15 9.497 9.497 8.933 0.564 19205
3248 1 20 . 1 1 16 16 GLN N N 16 118.516 118.516 119.097 -0.581 19205
3249 1 20 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.700 0.044 19205
3250 1 20 . 1 1 16 16 GLN C C 16 176.335 176.335 174.588 1.747 19205
3251 1 20 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.668 -0.727 19205
3252 1 20 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.009 0.314 19205
3253 1 20 . 1 1 16 16 GLN H H 16 8.049 8.049 7.692 0.357 19205
3254 1 20 . 1 1 17 17 ASP N N 17 124.190 124.190 122.126 2.064 19205
3255 1 20 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.419 -0.310 19205
3256 1 20 . 1 1 17 17 ASP C C 17 178.349 178.349 178.315 0.034 19205
3257 1 20 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.036 1.911 19205
3258 1 20 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.451 -0.928 19205
3259 1 20 . 1 1 17 17 ASP H H 17 9.208 9.208 8.874 0.334 19205
3260 1 20 . 1 1 18 18 SER N N 18 112.259 112.259 112.960 -0.701 19205
3261 1 20 . 1 1 18 18 SER HA H 18 4.228 4.228 4.235 -0.007 19205
3262 1 20 . 1 1 18 18 SER C C 18 175.037 175.037 175.080 -0.043 19205
3263 1 20 . 1 1 18 18 SER CA C 18 60.093 60.093 59.807 0.286 19205
3264 1 20 . 1 1 18 18 SER CB C 18 62.134 62.134 62.966 -0.832 19205
3265 1 20 . 1 1 18 18 SER H H 18 8.371 8.371 8.146 0.225 19205
3266 1 20 . 1 1 19 19 ASP N N 19 120.750 120.750 120.321 0.429 19205
3267 1 20 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.663 -0.072 19205
3268 1 20 . 1 1 19 19 ASP C C 19 175.958 175.958 176.266 -0.308 19205
3269 1 20 . 1 1 19 19 ASP CA C 19 55.885 55.885 54.879 1.006 19205
3270 1 20 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.014 1.008 19205
3271 1 20 . 1 1 19 19 ASP H H 19 7.697 7.697 7.713 -0.016 19205
3272 1 20 . 1 1 20 20 CYS N N 20 118.125 118.125 116.426 1.699 19205
3273 1 20 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.705 0.273 19205
3274 1 20 . 1 1 20 20 CYS C C 20 174.152 174.152 174.720 -0.568 19205
3275 1 20 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.280 -6.299 19205
3276 1 20 . 1 1 20 20 CYS CB C 20 39.974 39.974 30.039 9.935 19205
3277 1 20 . 1 1 20 20 CYS H H 20 7.947 7.947 7.662 0.285 19205
3278 1 20 . 1 1 21 21 LEU N N 21 121.658 121.658 120.811 0.847 19205
3279 1 20 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.430 -0.263 19205
3280 1 20 . 1 1 21 21 LEU C C 21 176.589 176.589 177.380 -0.791 19205
3281 1 20 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.322 0.564 19205
3282 1 20 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.962 -0.038 19205
3283 1 20 . 1 1 21 21 LEU H H 21 8.522 8.522 8.547 -0.025 19205
3284 1 20 . 1 1 22 22 ALA N N 22 121.907 121.907 122.880 -0.973 19205
3285 1 20 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.214 -0.142 19205
3286 1 20 . 1 1 22 22 ALA C C 22 178.382 178.382 178.515 -0.133 19205
3287 1 20 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.295 0.670 19205
3288 1 20 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.473 -0.529 19205
3289 1 20 . 1 1 22 22 ALA H H 22 8.104 8.104 8.421 -0.317 19205
3290 1 20 . 1 1 23 23 GLY N N 23 110.790 110.790 111.680 -0.890 19205
3291 1 20 . 1 1 23 23 GLY C C 23 174.553 174.553 174.316 0.237 19205
3292 1 20 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.846 -0.225 19205
3293 1 20 . 1 1 23 23 GLY H H 23 8.644 8.644 8.805 -0.161 19205
3294 1 20 . 1 1 24 24 CYS N N 24 119.431 119.431 118.180 1.251 19205
3295 1 20 . 1 1 24 24 CYS HA H 24 4.850 4.850 4.865 -0.015 19205
3296 1 20 . 1 1 24 24 CYS C C 24 172.768 172.768 173.507 -0.739 19205
3297 1 20 . 1 1 24 24 CYS CA C 24 54.902 54.902 57.850 -2.948 19205
3298 1 20 . 1 1 24 24 CYS CB C 24 46.168 46.168 30.246 15.922 19205
3299 1 20 . 1 1 24 24 CYS H H 24 8.491 8.491 7.606 0.885 19205
3300 1 20 . 1 1 25 25 VAL N N 25 115.469 115.469 116.764 -1.295 19205
3301 1 20 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.632 -0.265 19205
3302 1 20 . 1 1 25 25 VAL C C 25 175.161 175.161 173.818 1.343 19205
3303 1 20 . 1 1 25 25 VAL CA C 25 59.327 59.327 59.362 -0.035 19205
3304 1 20 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.449 0.586 19205
3305 1 20 . 1 1 25 25 VAL H H 25 9.324 9.324 9.152 0.173 19205
3306 1 20 . 1 1 26 26 CYS N N 26 123.350 123.350 121.691 1.659 19205
3307 1 20 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.782 0.028 19205
3308 1 20 . 1 1 26 26 CYS C C 26 174.891 174.891 176.002 -1.111 19205
3309 1 20 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.855 -3.656 19205
3310 1 20 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.352 12.908 19205
3311 1 20 . 1 1 26 26 CYS H H 26 9.346 9.346 8.846 0.500 19205
3312 1 20 . 1 1 27 27 GLY N N 27 117.742 117.742 116.869 0.873 19205
3313 1 20 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.026 1.432 19205
3314 1 20 . 1 1 27 27 GLY H H 27 8.259 8.259 8.871 -0.612 19205
3315 1 20 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.404 -0.034 19205
3316 1 20 . 1 1 28 28 PRO C C 28 176.720 176.720 177.173 -0.453 19205
3317 1 20 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.390 0.096 19205
3318 1 20 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.720 -0.167 19205
3319 1 20 . 1 1 29 29 ASN N N 29 114.300 114.300 117.311 -3.011 19205
3320 1 20 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.691 -0.042 19205
3321 1 20 . 1 1 29 29 ASN C C 29 175.490 175.490 176.421 -0.931 19205
3322 1 20 . 1 1 29 29 ASN CA C 29 52.335 52.335 53.061 -0.726 19205
3323 1 20 . 1 1 29 29 ASN CB C 29 37.566 37.566 38.727 -1.161 19205
3324 1 20 . 1 1 29 29 ASN H H 29 8.061 8.061 8.252 -0.191 19205
3325 1 20 . 1 1 30 30 GLY N N 30 107.086 107.086 105.712 1.374 19205
3326 1 20 . 1 1 30 30 GLY C C 30 173.758 173.758 173.193 0.565 19205
3327 1 20 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.197 1.115 19205
3328 1 20 . 1 1 30 30 GLY H H 30 8.294 8.294 8.024 0.270 19205
3329 1 20 . 1 1 31 31 PHE N N 31 115.129 115.129 118.167 -3.038 19205
3330 1 20 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.251 0.099 19205
3331 1 20 . 1 1 31 31 PHE C C 31 176.773 176.773 175.180 1.593 19205
3332 1 20 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.089 0.321 19205
3333 1 20 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.579 -0.105 19205
3334 1 20 . 1 1 31 31 PHE H H 31 7.167 7.167 7.417 -0.250 19205
3335 1 20 . 1 1 32 32 CYS N N 32 123.123 123.123 120.562 2.561 19205
3336 1 20 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.008 0.091 19205
3337 1 20 . 1 1 32 32 CYS C C 32 175.875 175.875 175.844 0.031 19205
3338 1 20 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.442 -4.012 19205
3339 1 20 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.600 15.487 19205
3340 1 20 . 1 1 32 32 CYS H H 32 8.708 8.708 8.969 -0.261 19205
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 28 1.579 -0.035 1.607 19205
2 1 1 "Average Difference" HA 36 0.275 0.085 0.266 19205
3 1 1 "Average Difference" C 28 0.944 0.121 0.954 19205
4 1 1 "Average Difference" CA 31 1.828 0.430 1.806 19205
5 1 1 "Average Difference" CB 26 6.952 -3.345 6.214 19205
6 1 1 "Average Difference" HN 28 0.392 -0.009 0.400 19205
7 1 2 "Average Difference" N 28 1.633 -0.322 1.630 19205
8 1 2 "Average Difference" HA 36 0.270 0.098 0.255 19205
9 1 2 "Average Difference" C 28 0.851 0.099 0.861 19205
10 1 2 "Average Difference" CA 31 2.010 0.439 1.994 19205
11 1 2 "Average Difference" CB 26 6.745 -3.299 6.000 19205
12 1 2 "Average Difference" HN 28 0.422 -0.031 0.429 19205
13 1 3 "Average Difference" N 28 1.543 -0.202 1.558 19205
14 1 3 "Average Difference" HA 36 0.274 0.076 0.267 19205
15 1 3 "Average Difference" C 28 0.864 0.075 0.877 19205
16 1 3 "Average Difference" CA 31 1.887 0.409 1.872 19205
17 1 3 "Average Difference" CB 26 6.941 -3.275 6.241 19205
18 1 3 "Average Difference" HN 28 0.387 -0.038 0.392 19205
19 1 4 "Average Difference" N 28 1.580 -0.138 1.603 19205
20 1 4 "Average Difference" HA 36 0.282 0.090 0.271 19205
21 1 4 "Average Difference" C 28 0.858 0.073 0.871 19205
22 1 4 "Average Difference" CA 31 1.888 0.420 1.871 19205
23 1 4 "Average Difference" CB 26 7.038 -3.356 6.308 19205
24 1 4 "Average Difference" HN 28 0.426 0.005 0.434 19205
25 1 5 "Average Difference" N 28 1.751 -0.257 1.764 19205
26 1 5 "Average Difference" HA 36 0.288 0.090 0.278 19205
27 1 5 "Average Difference" C 28 0.850 0.098 0.860 19205
28 1 5 "Average Difference" CA 31 1.914 0.457 1.889 19205
29 1 5 "Average Difference" CB 26 6.799 -3.219 6.107 19205
30 1 5 "Average Difference" HN 28 0.412 -0.041 0.418 19205
31 1 6 "Average Difference" N 28 1.797 -0.272 1.809 19205
32 1 6 "Average Difference" HA 36 0.266 0.072 0.260 19205
33 1 6 "Average Difference" C 28 0.869 0.074 0.881 19205
34 1 6 "Average Difference" CA 31 1.891 0.430 1.872 19205
35 1 6 "Average Difference" CB 26 7.083 -3.371 6.353 19205
36 1 6 "Average Difference" HN 28 0.415 0.021 0.422 19205
37 1 7 "Average Difference" N 28 1.985 -0.346 1.991 19205
38 1 7 "Average Difference" HA 36 0.278 0.095 0.264 19205
39 1 7 "Average Difference" C 28 0.818 0.124 0.824 19205
40 1 7 "Average Difference" CA 31 1.893 0.445 1.870 19205
41 1 7 "Average Difference" CB 26 6.769 -3.274 6.042 19205
42 1 7 "Average Difference" HN 28 0.405 -0.043 0.410 19205
43 1 8 "Average Difference" N 28 1.753 -0.068 1.784 19205
44 1 8 "Average Difference" HA 36 0.276 0.085 0.266 19205
45 1 8 "Average Difference" C 28 0.873 0.144 0.877 19205
46 1 8 "Average Difference" CA 31 2.000 0.501 1.968 19205
47 1 8 "Average Difference" CB 26 6.870 -3.302 6.144 19205
48 1 8 "Average Difference" HN 28 0.436 -0.057 0.440 19205
49 1 9 "Average Difference" N 28 1.596 -0.110 1.621 19205
50 1 9 "Average Difference" HA 36 0.286 0.070 0.281 19205
51 1 9 "Average Difference" C 28 0.895 0.175 0.894 19205
52 1 9 "Average Difference" CA 31 1.943 0.488 1.912 19205
53 1 9 "Average Difference" CB 26 6.830 -3.273 6.113 19205
54 1 9 "Average Difference" HN 28 0.414 -0.043 0.420 19205
55 1 10 "Average Difference" N 28 1.882 -0.070 1.915 19205
56 1 10 "Average Difference" HA 36 0.301 0.074 0.295 19205
57 1 10 "Average Difference" C 28 0.930 0.097 0.942 19205
58 1 10 "Average Difference" CA 31 2.005 0.454 1.985 19205
59 1 10 "Average Difference" CB 26 6.902 -3.280 6.194 19205
60 1 10 "Average Difference" HN 28 0.404 -0.044 0.409 19205
61 1 11 "Average Difference" N 28 1.628 -0.178 1.648 19205
62 1 11 "Average Difference" HA 36 0.267 0.067 0.262 19205
63 1 11 "Average Difference" C 28 0.910 0.107 0.920 19205
64 1 11 "Average Difference" CA 31 1.976 0.492 1.946 19205
65 1 11 "Average Difference" CB 26 6.782 -3.202 6.097 19205
66 1 11 "Average Difference" HN 28 0.414 0.003 0.421 19205
67 1 12 "Average Difference" N 28 1.642 -0.185 1.661 19205
68 1 12 "Average Difference" HA 36 0.277 0.098 0.262 19205
69 1 12 "Average Difference" C 28 0.862 0.102 0.872 19205
70 1 12 "Average Difference" CA 31 1.972 0.431 1.956 19205
71 1 12 "Average Difference" CB 26 6.825 -3.298 6.094 19205
72 1 12 "Average Difference" HN 28 0.414 -0.032 0.420 19205
73 1 13 "Average Difference" N 28 1.805 -0.208 1.826 19205
74 1 13 "Average Difference" HA 36 0.274 0.083 0.265 19205
75 1 13 "Average Difference" C 28 0.850 0.085 0.861 19205
76 1 13 "Average Difference" CA 31 1.946 0.465 1.921 19205
77 1 13 "Average Difference" CB 26 6.857 -3.174 6.199 19205
78 1 13 "Average Difference" HN 28 0.453 -0.019 0.461 19205
79 1 14 "Average Difference" N 28 1.710 -0.133 1.737 19205
80 1 14 "Average Difference" HA 36 0.272 0.074 0.265 19205
81 1 14 "Average Difference" C 28 0.871 0.078 0.883 19205
82 1 14 "Average Difference" CA 31 1.815 0.479 1.780 19205
83 1 14 "Average Difference" CB 26 6.919 -3.186 6.263 19205
84 1 14 "Average Difference" HN 28 0.395 0.046 0.399 19205
85 1 15 "Average Difference" N 28 1.604 -0.036 1.633 19205
86 1 15 "Average Difference" HA 36 0.281 0.078 0.274 19205
87 1 15 "Average Difference" C 28 0.859 0.107 0.868 19205
88 1 15 "Average Difference" CA 31 1.898 0.486 1.865 19205
89 1 15 "Average Difference" CB 26 7.024 -3.368 6.287 19205
90 1 15 "Average Difference" HN 28 0.401 -0.051 0.405 19205
91 1 16 "Average Difference" N 28 1.923 -0.132 1.953 19205
92 1 16 "Average Difference" HA 36 0.270 0.074 0.264 19205
93 1 16 "Average Difference" C 28 0.866 -0.012 0.882 19205
94 1 16 "Average Difference" CA 31 1.893 0.502 1.856 19205
95 1 16 "Average Difference" CB 26 6.925 -3.249 6.236 19205
96 1 16 "Average Difference" HN 28 0.457 -0.004 0.465 19205
97 1 17 "Average Difference" N 28 1.867 -0.061 1.900 19205
98 1 17 "Average Difference" HA 36 0.264 0.082 0.255 19205
99 1 17 "Average Difference" C 28 0.830 0.085 0.841 19205
100 1 17 "Average Difference" CA 31 1.822 0.397 1.808 19205
101 1 17 "Average Difference" CB 26 6.992 -3.368 6.249 19205
102 1 17 "Average Difference" HN 28 0.416 0.009 0.424 19205
103 1 18 "Average Difference" N 28 1.814 -0.061 1.846 19205
104 1 18 "Average Difference" HA 36 0.281 0.070 0.276 19205
105 1 18 "Average Difference" C 28 0.889 0.055 0.904 19205
106 1 18 "Average Difference" CA 31 1.911 0.449 1.888 19205
107 1 18 "Average Difference" CB 26 7.057 -3.351 6.334 19205
108 1 18 "Average Difference" HN 28 0.389 0.025 0.395 19205
109 1 19 "Average Difference" N 28 1.666 -0.210 1.683 19205
110 1 19 "Average Difference" HA 36 0.264 0.096 0.249 19205
111 1 19 "Average Difference" C 28 0.850 0.140 0.854 19205
112 1 19 "Average Difference" CA 31 1.892 0.383 1.884 19205
113 1 19 "Average Difference" CB 26 6.752 -3.235 6.044 19205
114 1 19 "Average Difference" HN 28 0.411 -0.058 0.414 19205
115 1 20 "Average Difference" N 28 1.753 -0.265 1.764 19205
116 1 20 "Average Difference" HA 36 0.277 0.088 0.266 19205
117 1 20 "Average Difference" C 28 0.839 0.129 0.844 19205
118 1 20 "Average Difference" CA 31 1.970 0.494 1.939 19205
119 1 20 "Average Difference" CB 26 6.804 -3.215 6.115 19205
120 1 20 "Average Difference" HN 28 0.381 -0.078 0.379 19205
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 19205
_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 CYS N N 2 120.511 120.511 118.027 2.484 19205
2 1 . 1 1 2 2 CYS HA H 2 4.873 4.873 4.924 -0.051 19205
3 1 . 1 1 2 2 CYS CA C 2 53.145 53.145 56.074 -2.929 19205
4 1 . 1 1 2 2 CYS CB C 2 41.921 41.921 28.239 13.682 19205
5 1 . 1 1 2 2 CYS H H 2 8.866 8.866 8.408 0.458 19205
6 1 . 1 1 3 3 PRO HA H 3 4.298 4.298 4.218 0.080 19205
7 1 . 1 1 3 3 PRO C C 3 176.294 176.294 175.659 0.635 19205
8 1 . 1 1 3 3 PRO CA C 3 63.774 63.774 63.211 0.563 19205
9 1 . 1 1 3 3 PRO CB C 3 31.891 31.891 30.325 1.566 19205
10 1 . 1 1 4 4 GLN N N 4 118.141 118.141 117.785 0.356 19205
11 1 . 1 1 4 4 GLN HA H 4 3.894 3.894 4.658 -0.764 19205
12 1 . 1 1 4 4 GLN C C 4 176.143 176.143 175.240 0.903 19205
13 1 . 1 1 4 4 GLN CA C 4 56.173 56.173 55.283 0.890 19205
14 1 . 1 1 4 4 GLN CB C 4 29.568 29.568 30.670 -1.102 19205
15 1 . 1 1 4 4 GLN H H 4 7.648 7.648 8.233 -0.585 19205
16 1 . 1 1 5 5 GLY N N 5 108.656 108.656 106.949 1.707 19205
17 1 . 1 1 5 5 GLY C C 5 173.733 173.733 173.729 0.004 19205
18 1 . 1 1 5 5 GLY CA C 5 45.257 45.257 45.523 -0.266 19205
19 1 . 1 1 5 5 GLY H H 5 7.759 7.759 7.754 0.005 19205
20 1 . 1 1 6 6 ARG N N 6 119.446 119.446 120.410 -0.964 19205
21 1 . 1 1 6 6 ARG HA H 6 4.389 4.389 4.781 -0.392 19205
22 1 . 1 1 6 6 ARG C C 6 176.780 176.780 177.593 -0.813 19205
23 1 . 1 1 6 6 ARG CA C 6 55.538 55.538 54.246 1.292 19205
24 1 . 1 1 6 6 ARG CB C 6 31.543 31.543 31.845 -0.302 19205
25 1 . 1 1 6 6 ARG H H 6 7.865 7.865 8.006 -0.141 19205
26 1 . 1 1 7 7 GLY N N 7 109.318 109.318 110.004 -0.686 19205
27 1 . 1 1 7 7 GLY C C 7 174.275 174.275 174.736 -0.461 19205
28 1 . 1 1 7 7 GLY CA C 7 46.020 46.020 46.990 -0.970 19205
29 1 . 1 1 7 7 GLY H H 7 8.529 8.529 8.648 -0.119 19205
30 1 . 1 1 8 8 ASP N N 8 121.036 121.036 119.683 1.353 19205
31 1 . 1 1 8 8 ASP HA H 8 4.555 4.555 4.717 -0.162 19205
32 1 . 1 1 8 8 ASP C C 8 175.562 175.562 175.300 0.262 19205
33 1 . 1 1 8 8 ASP CA C 8 53.748 53.748 53.871 -0.123 19205
34 1 . 1 1 8 8 ASP CB C 8 40.059 40.059 40.646 -0.587 19205
35 1 . 1 1 8 8 ASP H H 8 8.414 8.414 8.657 -0.243 19205
36 1 . 1 1 9 9 TRP N N 9 121.704 121.704 122.531 -0.827 19205
37 1 . 1 1 9 9 TRP HA H 9 4.493 4.493 4.774 -0.281 19205
38 1 . 1 1 9 9 TRP C C 9 175.498 175.498 174.866 0.632 19205
39 1 . 1 1 9 9 TRP CA C 9 57.094 57.094 55.910 1.184 19205
40 1 . 1 1 9 9 TRP CB C 9 29.809 29.809 29.258 0.551 19205
41 1 . 1 1 9 9 TRP H H 9 7.814 7.814 7.825 -0.011 19205
42 1 . 1 1 10 10 ALA N N 10 128.588 128.588 127.901 0.687 19205
43 1 . 1 1 10 10 ALA HA H 10 4.413 4.413 4.419 -0.006 19205
44 1 . 1 1 10 10 ALA CA C 10 50.270 50.270 50.665 -0.395 19205
45 1 . 1 1 10 10 ALA CB C 10 18.115 18.115 18.574 -0.459 19205
46 1 . 1 1 10 10 ALA H H 10 8.163 8.163 8.101 0.062 19205
47 1 . 1 1 11 11 PRO HA H 11 4.331 4.331 4.941 -0.610 19205
48 1 . 1 1 11 11 PRO C C 11 176.753 176.753 176.718 0.035 19205
49 1 . 1 1 11 11 PRO CA C 11 62.996 62.996 62.092 0.904 19205
50 1 . 1 1 11 11 PRO CB C 11 32.445 32.445 32.508 -0.063 19205
51 1 . 1 1 12 12 THR N N 12 119.798 119.798 117.258 2.540 19205
52 1 . 1 1 12 12 THR HA H 12 4.512 4.512 4.736 -0.224 19205
53 1 . 1 1 12 12 THR C C 12 173.572 173.572 174.563 -0.991 19205
54 1 . 1 1 12 12 THR CA C 12 62.099 62.099 61.910 0.189 19205
55 1 . 1 1 12 12 THR CB C 12 71.060 71.060 70.282 0.778 19205
56 1 . 1 1 12 12 THR H H 12 9.006 9.006 8.547 0.459 19205
57 1 . 1 1 13 13 SER N N 13 123.494 123.494 122.005 1.489 19205
58 1 . 1 1 13 13 SER HA H 13 4.539 4.539 4.414 0.125 19205
59 1 . 1 1 13 13 SER C C 13 172.953 172.953 174.482 -1.529 19205
60 1 . 1 1 13 13 SER CA C 13 58.421 58.421 58.483 -0.062 19205
61 1 . 1 1 13 13 SER CB C 13 63.844 63.844 63.125 0.719 19205
62 1 . 1 1 13 13 SER H H 13 8.805 8.805 8.743 0.062 19205
63 1 . 1 1 14 14 CYS N N 14 116.548 116.548 120.502 -3.954 19205
64 1 . 1 1 14 14 CYS HA H 14 4.940 4.940 4.887 0.053 19205
65 1 . 1 1 14 14 CYS C C 14 172.746 172.746 173.568 -0.822 19205
66 1 . 1 1 14 14 CYS CA C 14 53.806 53.806 56.771 -2.965 19205
67 1 . 1 1 14 14 CYS CB C 14 47.605 47.605 31.525 16.080 19205
68 1 . 1 1 14 14 CYS H H 14 8.265 8.265 8.404 -0.139 19205
69 1 . 1 1 15 15 SER N N 15 113.958 113.958 114.123 -0.165 19205
70 1 . 1 1 15 15 SER HA H 15 4.531 4.531 4.636 -0.105 19205
71 1 . 1 1 15 15 SER C C 15 173.205 173.205 173.779 -0.574 19205
72 1 . 1 1 15 15 SER CA C 15 58.826 58.826 58.662 0.164 19205
73 1 . 1 1 15 15 SER CB C 15 65.097 65.097 64.990 0.107 19205
74 1 . 1 1 15 15 SER H H 15 9.497 9.497 9.151 0.346 19205
75 1 . 1 1 16 16 GLN N N 16 118.516 118.516 119.011 -0.495 19205
76 1 . 1 1 16 16 GLN HA H 16 4.744 4.744 4.669 0.075 19205
77 1 . 1 1 16 16 GLN C C 16 176.335 176.335 174.622 1.713 19205
78 1 . 1 1 16 16 GLN CA C 16 53.941 53.941 54.644 -0.703 19205
79 1 . 1 1 16 16 GLN CB C 16 31.323 31.323 31.108 0.215 19205
80 1 . 1 1 16 16 GLN H H 16 8.049 8.049 7.845 0.204 19205
81 1 . 1 1 17 17 ASP N N 17 124.190 124.190 121.869 2.321 19205
82 1 . 1 1 17 17 ASP HA H 17 4.109 4.109 4.447 -0.339 19205
83 1 . 1 1 17 17 ASP C C 17 178.349 178.349 178.033 0.316 19205
84 1 . 1 1 17 17 ASP CA C 17 58.947 58.947 57.080 1.867 19205
85 1 . 1 1 17 17 ASP CB C 17 39.523 39.523 40.375 -0.852 19205
86 1 . 1 1 17 17 ASP H H 17 9.208 9.208 8.827 0.380 19205
87 1 . 1 1 18 18 SER N N 18 112.259 112.259 112.296 -0.037 19205
88 1 . 1 1 18 18 SER HA H 18 4.228 4.228 4.263 -0.035 19205
89 1 . 1 1 18 18 SER C C 18 175.037 175.037 175.077 -0.040 19205
90 1 . 1 1 18 18 SER CA C 18 60.093 60.093 59.740 0.353 19205
91 1 . 1 1 18 18 SER CB C 18 62.134 62.134 62.941 -0.807 19205
92 1 . 1 1 18 18 SER H H 18 8.371 8.371 8.178 0.193 19205
93 1 . 1 1 19 19 ASP N N 19 120.750 120.750 120.747 0.003 19205
94 1 . 1 1 19 19 ASP HA H 19 4.591 4.591 4.676 -0.084 19205
95 1 . 1 1 19 19 ASP C C 19 175.958 175.958 176.348 -0.390 19205
96 1 . 1 1 19 19 ASP CA C 19 55.885 55.885 54.958 0.927 19205
97 1 . 1 1 19 19 ASP CB C 19 42.022 42.022 41.133 0.889 19205
98 1 . 1 1 19 19 ASP H H 19 7.697 7.697 7.762 -0.065 19205
99 1 . 1 1 20 20 CYS N N 20 118.125 118.125 116.597 1.528 19205
100 1 . 1 1 20 20 CYS HA H 20 4.977 4.977 4.677 0.300 19205
101 1 . 1 1 20 20 CYS C C 20 174.152 174.152 174.801 -0.649 19205
102 1 . 1 1 20 20 CYS CA C 20 51.981 51.981 58.174 -6.193 19205
103 1 . 1 1 20 20 CYS CB C 20 39.974 39.974 29.733 10.241 19205
104 1 . 1 1 20 20 CYS H H 20 7.947 7.947 7.648 0.299 19205
105 1 . 1 1 21 21 LEU N N 21 121.658 121.658 121.288 0.369 19205
106 1 . 1 1 21 21 LEU HA H 21 4.167 4.167 4.363 -0.196 19205
107 1 . 1 1 21 21 LEU C C 21 176.589 176.589 177.489 -0.900 19205
108 1 . 1 1 21 21 LEU CA C 21 54.886 54.886 54.466 0.420 19205
109 1 . 1 1 21 21 LEU CB C 21 42.923 42.923 42.728 0.195 19205
110 1 . 1 1 21 21 LEU H H 21 8.522 8.522 8.429 0.093 19205
111 1 . 1 1 22 22 ALA N N 22 121.907 121.907 123.040 -1.133 19205
112 1 . 1 1 22 22 ALA HA H 22 4.072 4.072 4.168 -0.096 19205
113 1 . 1 1 22 22 ALA C C 22 178.382 178.382 178.516 -0.134 19205
114 1 . 1 1 22 22 ALA CA C 22 53.965 53.965 53.510 0.455 19205
115 1 . 1 1 22 22 ALA CB C 22 17.944 17.944 18.276 -0.332 19205
116 1 . 1 1 22 22 ALA H H 22 8.104 8.104 8.446 -0.342 19205
117 1 . 1 1 23 23 GLY N N 23 110.790 110.790 111.999 -1.209 19205
118 1 . 1 1 23 23 GLY C C 23 174.553 174.553 174.610 -0.057 19205
119 1 . 1 1 23 23 GLY CA C 23 44.621 44.621 44.777 -0.156 19205
120 1 . 1 1 23 23 GLY H H 23 8.644 8.644 8.731 -0.087 19205
121 1 . 1 1 24 24 CYS N N 24 119.431 119.431 119.310 0.121 19205
122 1 . 1 1 24 24 CYS HA H 24 4.850 4.850 4.992 -0.142 19205
123 1 . 1 1 24 24 CYS C C 24 172.768 172.768 174.125 -1.357 19205
124 1 . 1 1 24 24 CYS CA C 24 54.902 54.902 58.469 -3.567 19205
125 1 . 1 1 24 24 CYS CB C 24 46.168 46.168 29.661 16.507 19205
126 1 . 1 1 24 24 CYS H H 24 8.491 8.491 7.694 0.797 19205
127 1 . 1 1 25 25 VAL N N 25 115.469 115.469 116.553 -1.084 19205
128 1 . 1 1 25 25 VAL HA H 25 4.367 4.367 4.649 -0.282 19205
129 1 . 1 1 25 25 VAL C C 25 175.161 175.161 173.845 1.316 19205
130 1 . 1 1 25 25 VAL CA C 25 59.327 59.327 59.037 0.290 19205
131 1 . 1 1 25 25 VAL CB C 25 35.035 35.035 34.509 0.526 19205
132 1 . 1 1 25 25 VAL H H 25 9.324 9.324 9.021 0.303 19205
133 1 . 1 1 26 26 CYS N N 26 123.350 123.350 121.180 2.170 19205
134 1 . 1 1 26 26 CYS HA H 26 4.810 4.810 4.799 0.011 19205
135 1 . 1 1 26 26 CYS C C 26 174.891 174.891 176.024 -1.133 19205
136 1 . 1 1 26 26 CYS CA C 26 55.199 55.199 58.731 -3.532 19205
137 1 . 1 1 26 26 CYS CB C 26 38.260 38.260 25.704 12.556 19205
138 1 . 1 1 26 26 CYS H H 26 9.346 9.346 8.866 0.480 19205
139 1 . 1 1 27 27 GLY N N 27 117.742 117.742 116.662 1.080 19205
140 1 . 1 1 27 27 GLY CA C 27 45.458 45.458 44.118 1.340 19205
141 1 . 1 1 27 27 GLY H H 27 8.259 8.259 8.951 -0.692 19205
142 1 . 1 1 28 28 PRO HA H 28 4.370 4.370 4.431 -0.061 19205
143 1 . 1 1 28 28 PRO C C 28 176.720 176.720 176.829 -0.109 19205
144 1 . 1 1 28 28 PRO CA C 28 64.486 64.486 64.405 0.081 19205
145 1 . 1 1 28 28 PRO CB C 28 31.553 31.553 31.659 -0.106 19205
146 1 . 1 1 29 29 ASN N N 29 114.300 114.300 116.452 -2.152 19205
147 1 . 1 1 29 29 ASN HA H 29 4.649 4.649 4.683 -0.034 19205
148 1 . 1 1 29 29 ASN C C 29 175.490 175.490 176.424 -0.934 19205
149 1 . 1 1 29 29 ASN CA C 29 52.335 52.335 52.950 -0.615 19205
150 1 . 1 1 29 29 ASN CB C 29 37.566 37.566 37.679 -0.113 19205
151 1 . 1 1 29 29 ASN H H 29 8.061 8.061 8.229 -0.167 19205
152 1 . 1 1 30 30 GLY N N 30 107.086 107.086 107.085 0.001 19205
153 1 . 1 1 30 30 GLY C C 30 173.758 173.758 172.909 0.849 19205
154 1 . 1 1 30 30 GLY CA C 30 46.312 46.312 45.132 1.180 19205
155 1 . 1 1 30 30 GLY H H 30 8.294 8.294 7.952 0.342 19205
156 1 . 1 1 31 31 PHE N N 31 115.129 115.129 118.416 -3.287 19205
157 1 . 1 1 31 31 PHE HA H 31 5.350 5.350 5.328 0.022 19205
158 1 . 1 1 31 31 PHE C C 31 176.773 176.773 175.287 1.486 19205
159 1 . 1 1 31 31 PHE CA C 31 56.410 56.410 56.112 0.298 19205
160 1 . 1 1 31 31 PHE CB C 31 42.474 42.474 42.628 -0.154 19205
161 1 . 1 1 31 31 PHE H H 31 7.167 7.167 8.237 -1.070 19205
162 1 . 1 1 32 32 CYS N N 32 123.123 123.123 120.732 2.391 19205
163 1 . 1 1 32 32 CYS HA H 32 5.099 5.099 5.149 -0.050 19205
164 1 . 1 1 32 32 CYS C C 32 175.875 175.875 175.871 0.004 19205
165 1 . 1 1 32 32 CYS CA C 32 55.430 55.430 59.381 -3.951 19205
166 1 . 1 1 32 32 CYS CB C 32 42.087 42.087 26.491 15.596 19205
167 1 . 1 1 32 32 CYS H H 32 8.708 8.708 8.915 -0.207 19205
stop_
save_