data_18766
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18766
_Entry.PDB_ID 2LZO
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 18766
_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 SER HA H 2 4.613 4.613 4.621 -0.008 18766
2 1 1 . 1 1 2 2 SER CA C 2 57.815 57.815 57.985 -0.170 18766
3 1 1 . 1 1 2 2 SER CB C 2 63.213 63.213 63.845 -0.632 18766
4 1 1 . 1 1 2 2 SER H H 2 8.641 8.641 8.192 0.449 18766
5 1 1 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.220 0.025 18766
6 1 1 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.936 -0.824 18766
7 1 1 . 1 1 3 3 ILE CB C 3 38.386 38.386 39.884 -1.498 18766
8 1 1 . 1 1 3 3 ILE H H 3 8.297 8.297 8.141 0.156 18766
9 1 1 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.682 0.224 18766
10 1 1 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.872 -1.081 18766
11 1 1 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.542 -1.216 18766
12 1 1 . 1 1 4 4 ASP H H 4 8.392 8.392 8.347 0.045 18766
13 1 1 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.562 0.133 18766
14 1 1 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.336 -1.228 18766
15 1 1 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.490 -0.010 18766
16 1 1 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.583 -0.247 18766
17 1 1 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.604 -0.947 18766
18 1 1 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.469 0.236 18766
19 1 1 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.489 11.598 18766
20 1 1 . 1 1 7 7 CYS H H 7 8.431 8.431 8.625 -0.194 18766
21 1 1 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.072 0.160 18766
22 1 1 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.349 -0.967 18766
23 1 1 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.439 0.207 18766
24 1 1 . 1 1 8 8 ARG H H 8 8.371 8.371 8.437 -0.066 18766
25 1 1 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.326 0.085 18766
26 1 1 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.590 -7.840 18766
27 1 1 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.734 -0.067 18766
28 1 1 . 1 1 9 9 PHE H H 9 8.304 8.304 8.389 -0.085 18766
29 1 1 . 1 1 10 10 CYS HA H 10 3.756 3.756 3.976 -0.220 18766
30 1 1 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.790 -0.731 18766
31 1 1 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.631 16.734 18766
32 1 1 . 1 1 10 10 CYS H H 10 8.564 8.564 8.661 -0.097 18766
33 1 1 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.125 -0.025 18766
34 1 1 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.749 0.110 18766
35 1 1 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.405 -1.774 18766
36 1 1 . 1 1 11 11 TYR H H 11 8.239 8.239 8.128 0.111 18766
37 1 1 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.798 0.235 18766
38 1 1 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.713 -1.099 18766
39 1 1 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.116 -1.404 18766
40 1 1 . 1 1 12 12 HIS H H 12 9.283 9.283 8.297 0.986 18766
41 1 1 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.280 0.506 18766
42 1 1 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.168 -1.887 18766
43 1 1 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.587 -0.485 18766
44 1 1 . 1 1 13 13 ARG H H 13 8.941 8.941 8.787 0.154 18766
45 1 1 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.827 0.034 18766
46 1 1 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.253 -1.840 18766
47 1 1 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.939 -1.116 18766
48 1 1 . 1 1 14 14 ASP H H 14 8.831 8.831 8.775 0.056 18766
49 1 1 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.173 -0.152 18766
50 1 1 . 1 1 15 15 GLY H H 15 8.668 8.668 8.522 0.146 18766
51 1 1 . 1 1 16 16 SER HA H 16 4.614 4.614 4.444 0.170 18766
52 1 1 . 1 1 16 16 SER CA C 16 57.346 57.346 58.946 -1.600 18766
53 1 1 . 1 1 16 16 SER CB C 16 63.633 63.633 64.168 -0.535 18766
54 1 1 . 1 1 16 16 SER H H 16 8.231 8.231 8.466 -0.235 18766
55 1 1 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.862 -0.296 18766
56 1 1 . 1 1 17 17 GLY H H 17 8.096 8.096 7.627 0.469 18766
57 1 1 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.080 -0.227 18766
58 1 1 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.205 -0.459 18766
59 1 1 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.958 -3.668 18766
60 1 1 . 1 1 18 18 ASN H H 18 8.317 8.317 8.797 -0.480 18766
61 1 1 . 1 1 19 19 CYS HA H 19 4.819 4.819 5.023 -0.204 18766
62 1 1 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.518 13.730 18766
63 1 1 . 1 1 19 19 CYS H H 19 8.872 8.872 8.567 0.305 18766
64 1 1 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.067 0.627 18766
65 1 1 . 1 1 20 20 VAL CB C 20 34.426 34.426 35.319 -0.893 18766
66 1 1 . 1 1 20 20 VAL H H 20 9.428 9.428 8.319 1.109 18766
67 1 1 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.818 -0.481 18766
68 1 1 . 1 1 21 21 TYR CA C 21 57.848 57.848 57.989 -0.141 18766
69 1 1 . 1 1 21 21 TYR CB C 21 38.105 38.105 38.191 -0.085 18766
70 1 1 . 1 1 21 21 TYR H H 21 8.524 8.524 7.652 0.872 18766
71 1 1 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.463 -0.230 18766
72 1 1 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.633 -1.442 18766
73 1 1 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.175 -2.130 18766
74 1 1 . 1 1 22 22 ASP H H 22 7.968 7.968 8.291 -0.323 18766
75 1 1 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.128 -0.340 18766
76 1 1 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.365 -0.944 18766
77 1 1 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.814 -0.731 18766
78 1 1 . 1 1 23 23 ALA H H 23 7.706 7.706 8.312 -0.606 18766
79 1 1 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.496 -0.055 18766
80 1 1 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.213 -0.922 18766
81 1 1 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.398 -1.419 18766
82 1 1 . 1 1 24 24 TYR H H 24 7.843 7.843 8.084 -0.241 18766
83 1 1 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.811 -0.243 18766
84 1 1 . 1 1 25 25 GLY H H 25 7.747 7.747 7.480 0.267 18766
85 1 1 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.736 -0.048 18766
86 1 1 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.567 13.717 18766
87 1 1 . 1 1 26 26 CYS H H 26 8.091 8.091 8.452 -0.361 18766
88 1 1 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.383 -0.629 18766
89 1 1 . 1 1 27 27 GLY H H 27 8.546 8.546 8.178 0.368 18766
90 1 1 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.426 -0.013 18766
91 1 1 . 1 1 28 28 ALA CA C 28 59.128 59.128 52.094 7.034 18766
92 1 1 . 1 1 28 28 ALA CB C 28 18.606 18.606 18.914 -0.308 18766
93 1 1 . 1 1 28 28 ALA H H 28 8.016 8.016 8.129 -0.113 18766
94 1 2 . 1 1 2 2 SER HA H 2 4.613 4.613 4.885 -0.272 18766
95 1 2 . 1 1 2 2 SER CA C 2 57.815 57.815 58.577 -0.762 18766
96 1 2 . 1 1 2 2 SER CB C 2 63.213 63.213 62.545 0.668 18766
97 1 2 . 1 1 2 2 SER H H 2 8.641 8.641 8.751 -0.110 18766
98 1 2 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.298 -0.053 18766
99 1 2 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.355 -0.243 18766
100 1 2 . 1 1 3 3 ILE CB C 3 38.386 38.386 41.178 -2.792 18766
101 1 2 . 1 1 3 3 ILE H H 3 8.297 8.297 7.538 0.759 18766
102 1 2 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.880 0.026 18766
103 1 2 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.502 -0.711 18766
104 1 2 . 1 1 4 4 ASP CB C 4 39.326 39.326 41.123 -1.797 18766
105 1 2 . 1 1 4 4 ASP H H 4 8.392 8.392 8.313 0.079 18766
106 1 2 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.656 0.039 18766
107 1 2 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.301 -1.193 18766
108 1 2 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.481 -0.001 18766
109 1 2 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.631 -0.295 18766
110 1 2 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.574 -0.917 18766
111 1 2 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.484 0.221 18766
112 1 2 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.487 11.600 18766
113 1 2 . 1 1 7 7 CYS H H 7 8.431 8.431 8.639 -0.208 18766
114 1 2 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.074 0.158 18766
115 1 2 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.401 -1.019 18766
116 1 2 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.437 0.209 18766
117 1 2 . 1 1 8 8 ARG H H 8 8.371 8.371 8.435 -0.064 18766
118 1 2 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.333 0.078 18766
119 1 2 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.297 -7.547 18766
120 1 2 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.699 -0.031 18766
121 1 2 . 1 1 9 9 PHE H H 9 8.304 8.304 8.383 -0.079 18766
122 1 2 . 1 1 10 10 CYS HA H 10 3.756 3.756 4.006 -0.250 18766
123 1 2 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.814 -0.755 18766
124 1 2 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.623 16.742 18766
125 1 2 . 1 1 10 10 CYS H H 10 8.564 8.564 8.742 -0.178 18766
126 1 2 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.120 -0.020 18766
127 1 2 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.746 0.113 18766
128 1 2 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.407 -1.776 18766
129 1 2 . 1 1 11 11 TYR H H 11 8.239 8.239 8.149 0.090 18766
130 1 2 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.795 0.238 18766
131 1 2 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.709 -1.095 18766
132 1 2 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.186 -1.474 18766
133 1 2 . 1 1 12 12 HIS H H 12 9.283 9.283 8.307 0.976 18766
134 1 2 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.276 0.510 18766
135 1 2 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.150 -1.869 18766
136 1 2 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.490 -0.388 18766
137 1 2 . 1 1 13 13 ARG H H 13 8.941 8.941 8.798 0.143 18766
138 1 2 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.850 0.011 18766
139 1 2 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.128 -1.715 18766
140 1 2 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.786 -0.963 18766
141 1 2 . 1 1 14 14 ASP H H 14 8.831 8.831 8.832 -0.001 18766
142 1 2 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.399 -0.378 18766
143 1 2 . 1 1 15 15 GLY H H 15 8.668 8.668 8.513 0.155 18766
144 1 2 . 1 1 16 16 SER HA H 16 4.614 4.614 4.384 0.230 18766
145 1 2 . 1 1 16 16 SER CA C 16 57.346 57.346 58.727 -1.381 18766
146 1 2 . 1 1 16 16 SER CB C 16 63.633 63.633 64.128 -0.495 18766
147 1 2 . 1 1 16 16 SER H H 16 8.231 8.231 8.217 0.014 18766
148 1 2 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.890 -0.324 18766
149 1 2 . 1 1 17 17 GLY H H 17 8.096 8.096 7.750 0.346 18766
150 1 2 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.070 -0.217 18766
151 1 2 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.232 -0.486 18766
152 1 2 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.966 -3.676 18766
153 1 2 . 1 1 18 18 ASN H H 18 8.317 8.317 8.798 -0.481 18766
154 1 2 . 1 1 19 19 CYS HA H 19 4.819 4.819 4.982 -0.163 18766
155 1 2 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.660 13.588 18766
156 1 2 . 1 1 19 19 CYS H H 19 8.872 8.872 8.615 0.257 18766
157 1 2 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.066 0.628 18766
158 1 2 . 1 1 20 20 VAL CB C 20 34.426 34.426 34.925 -0.499 18766
159 1 2 . 1 1 20 20 VAL H H 20 9.428 9.428 8.464 0.964 18766
160 1 2 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.785 -0.448 18766
161 1 2 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.159 -0.311 18766
162 1 2 . 1 1 21 21 TYR CB C 21 38.105 38.105 38.005 0.099 18766
163 1 2 . 1 1 21 21 TYR H H 21 8.524 8.524 7.625 0.899 18766
164 1 2 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.473 -0.240 18766
165 1 2 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.634 -1.443 18766
166 1 2 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.184 -2.139 18766
167 1 2 . 1 1 22 22 ASP H H 22 7.968 7.968 8.288 -0.320 18766
168 1 2 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.166 -0.378 18766
169 1 2 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.101 -0.680 18766
170 1 2 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.755 -0.672 18766
171 1 2 . 1 1 23 23 ALA H H 23 7.706 7.706 8.030 -0.324 18766
172 1 2 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.365 0.076 18766
173 1 2 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.139 -0.848 18766
174 1 2 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.754 -1.775 18766
175 1 2 . 1 1 24 24 TYR H H 24 7.843 7.843 7.791 0.052 18766
176 1 2 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.793 -0.225 18766
177 1 2 . 1 1 25 25 GLY H H 25 7.747 7.747 7.470 0.277 18766
178 1 2 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.746 -0.058 18766
179 1 2 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.514 13.770 18766
180 1 2 . 1 1 26 26 CYS H H 26 8.091 8.091 8.444 -0.353 18766
181 1 2 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.301 -0.547 18766
182 1 2 . 1 1 27 27 GLY H H 27 8.546 8.546 8.527 0.019 18766
183 1 2 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.500 -0.087 18766
184 1 2 . 1 1 28 28 ALA CA C 28 59.128 59.128 51.783 7.345 18766
185 1 2 . 1 1 28 28 ALA CB C 28 18.606 18.606 20.176 -1.570 18766
186 1 2 . 1 1 28 28 ALA H H 28 8.016 8.016 7.804 0.212 18766
187 1 3 . 1 1 2 2 SER HA H 2 4.613 4.613 4.769 -0.156 18766
188 1 3 . 1 1 2 2 SER CA C 2 57.815 57.815 57.824 -0.009 18766
189 1 3 . 1 1 2 2 SER CB C 2 63.213 63.213 65.115 -1.902 18766
190 1 3 . 1 1 2 2 SER H H 2 8.641 8.641 8.039 0.602 18766
191 1 3 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.252 -0.007 18766
192 1 3 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.785 -0.673 18766
193 1 3 . 1 1 3 3 ILE CB C 3 38.386 38.386 38.466 -0.080 18766
194 1 3 . 1 1 3 3 ILE H H 3 8.297 8.297 8.332 -0.035 18766
195 1 3 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.664 0.242 18766
196 1 3 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.878 -1.087 18766
197 1 3 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.536 -1.210 18766
198 1 3 . 1 1 4 4 ASP H H 4 8.392 8.392 8.362 0.030 18766
199 1 3 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.563 0.132 18766
200 1 3 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.335 -1.227 18766
201 1 3 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.496 -0.016 18766
202 1 3 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.592 -0.256 18766
203 1 3 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.613 -0.956 18766
204 1 3 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.478 0.227 18766
205 1 3 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.505 11.582 18766
206 1 3 . 1 1 7 7 CYS H H 7 8.431 8.431 8.635 -0.204 18766
207 1 3 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.073 0.159 18766
208 1 3 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.324 -0.942 18766
209 1 3 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.427 0.219 18766
210 1 3 . 1 1 8 8 ARG H H 8 8.371 8.371 8.442 -0.071 18766
211 1 3 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.334 0.077 18766
212 1 3 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.165 -7.415 18766
213 1 3 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.633 0.035 18766
214 1 3 . 1 1 9 9 PHE H H 9 8.304 8.304 8.400 -0.096 18766
215 1 3 . 1 1 10 10 CYS HA H 10 3.756 3.756 4.028 -0.272 18766
216 1 3 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.834 -0.775 18766
217 1 3 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.634 16.731 18766
218 1 3 . 1 1 10 10 CYS H H 10 8.564 8.564 8.791 -0.227 18766
219 1 3 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.124 -0.024 18766
220 1 3 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.759 0.100 18766
221 1 3 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.418 -1.787 18766
222 1 3 . 1 1 11 11 TYR H H 11 8.239 8.239 8.160 0.079 18766
223 1 3 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.812 0.221 18766
224 1 3 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.729 -1.115 18766
225 1 3 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.132 -1.420 18766
226 1 3 . 1 1 12 12 HIS H H 12 9.283 9.283 8.318 0.965 18766
227 1 3 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.277 0.509 18766
228 1 3 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.179 -1.898 18766
229 1 3 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.560 -0.458 18766
230 1 3 . 1 1 13 13 ARG H H 13 8.941 8.941 8.801 0.140 18766
231 1 3 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.878 -0.017 18766
232 1 3 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.227 -1.814 18766
233 1 3 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.712 -0.889 18766
234 1 3 . 1 1 14 14 ASP H H 14 8.831 8.831 8.845 -0.014 18766
235 1 3 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.248 -0.227 18766
236 1 3 . 1 1 15 15 GLY H H 15 8.668 8.668 8.701 -0.033 18766
237 1 3 . 1 1 16 16 SER HA H 16 4.614 4.614 4.355 0.259 18766
238 1 3 . 1 1 16 16 SER CA C 16 57.346 57.346 58.666 -1.321 18766
239 1 3 . 1 1 16 16 SER CB C 16 63.633 63.633 63.949 -0.316 18766
240 1 3 . 1 1 16 16 SER H H 16 8.231 8.231 8.450 -0.219 18766
241 1 3 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.770 -0.204 18766
242 1 3 . 1 1 17 17 GLY H H 17 8.096 8.096 7.805 0.291 18766
243 1 3 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.029 -0.176 18766
244 1 3 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.349 -0.603 18766
245 1 3 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.717 -3.427 18766
246 1 3 . 1 1 18 18 ASN H H 18 8.317 8.317 8.952 -0.635 18766
247 1 3 . 1 1 19 19 CYS HA H 19 4.819 4.819 4.997 -0.178 18766
248 1 3 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.648 13.600 18766
249 1 3 . 1 1 19 19 CYS H H 19 8.872 8.872 8.621 0.251 18766
250 1 3 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.063 0.631 18766
251 1 3 . 1 1 20 20 VAL CB C 20 34.426 34.426 34.925 -0.499 18766
252 1 3 . 1 1 20 20 VAL H H 20 9.428 9.428 8.453 0.975 18766
253 1 3 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.784 -0.447 18766
254 1 3 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.137 -0.289 18766
255 1 3 . 1 1 21 21 TYR CB C 21 38.105 38.105 37.990 0.115 18766
256 1 3 . 1 1 21 21 TYR H H 21 8.524 8.524 7.618 0.906 18766
257 1 3 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.480 -0.247 18766
258 1 3 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.635 -1.444 18766
259 1 3 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.167 -2.122 18766
260 1 3 . 1 1 22 22 ASP H H 22 7.968 7.968 8.291 -0.323 18766
261 1 3 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.069 -0.281 18766
262 1 3 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.245 -0.824 18766
263 1 3 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.680 -0.597 18766
264 1 3 . 1 1 23 23 ALA H H 23 7.706 7.706 8.271 -0.565 18766
265 1 3 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.462 -0.021 18766
266 1 3 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.564 -1.273 18766
267 1 3 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.558 -1.579 18766
268 1 3 . 1 1 24 24 TYR H H 24 7.843 7.843 8.013 -0.170 18766
269 1 3 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.759 -0.191 18766
270 1 3 . 1 1 25 25 GLY H H 25 7.747 7.747 7.472 0.275 18766
271 1 3 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.743 -0.055 18766
272 1 3 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.491 13.793 18766
273 1 3 . 1 1 26 26 CYS H H 26 8.091 8.091 8.441 -0.350 18766
274 1 3 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.281 -0.527 18766
275 1 3 . 1 1 27 27 GLY H H 27 8.546 8.546 8.519 0.027 18766
276 1 3 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.496 -0.083 18766
277 1 3 . 1 1 28 28 ALA CA C 28 59.128 59.128 51.710 7.418 18766
278 1 3 . 1 1 28 28 ALA CB C 28 18.606 18.606 20.136 -1.530 18766
279 1 3 . 1 1 28 28 ALA H H 28 8.016 8.016 7.731 0.285 18766
280 1 4 . 1 1 2 2 SER HA H 2 4.613 4.613 4.761 -0.148 18766
281 1 4 . 1 1 2 2 SER CA C 2 57.815 57.815 57.556 0.259 18766
282 1 4 . 1 1 2 2 SER CB C 2 63.213 63.213 64.675 -1.462 18766
283 1 4 . 1 1 2 2 SER H H 2 8.641 8.641 7.959 0.682 18766
284 1 4 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.349 -0.104 18766
285 1 4 . 1 1 3 3 ILE CA C 3 60.112 60.112 61.049 -0.937 18766
286 1 4 . 1 1 3 3 ILE CB C 3 38.386 38.386 40.002 -1.616 18766
287 1 4 . 1 1 3 3 ILE H H 3 8.297 8.297 8.268 0.029 18766
288 1 4 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.786 0.120 18766
289 1 4 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.688 -0.897 18766
290 1 4 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.809 -1.483 18766
291 1 4 . 1 1 4 4 ASP H H 4 8.392 8.392 8.396 -0.004 18766
292 1 4 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.582 0.113 18766
293 1 4 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.380 -1.272 18766
294 1 4 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.494 -0.014 18766
295 1 4 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.577 -0.241 18766
296 1 4 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.601 -0.944 18766
297 1 4 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.465 0.240 18766
298 1 4 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.472 11.615 18766
299 1 4 . 1 1 7 7 CYS H H 7 8.431 8.431 8.628 -0.197 18766
300 1 4 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.070 0.162 18766
301 1 4 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.412 -1.030 18766
302 1 4 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.440 0.206 18766
303 1 4 . 1 1 8 8 ARG H H 8 8.371 8.371 8.435 -0.064 18766
304 1 4 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.330 0.081 18766
305 1 4 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.438 -7.688 18766
306 1 4 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.723 -0.055 18766
307 1 4 . 1 1 9 9 PHE H H 9 8.304 8.304 8.385 -0.081 18766
308 1 4 . 1 1 10 10 CYS HA H 10 3.756 3.756 3.992 -0.236 18766
309 1 4 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.802 -0.743 18766
310 1 4 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.661 16.704 18766
311 1 4 . 1 1 10 10 CYS H H 10 8.564 8.564 8.691 -0.127 18766
312 1 4 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.123 -0.023 18766
313 1 4 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.772 0.087 18766
314 1 4 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.437 -1.806 18766
315 1 4 . 1 1 11 11 TYR H H 11 8.239 8.239 8.134 0.105 18766
316 1 4 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.808 0.225 18766
317 1 4 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.732 -1.118 18766
318 1 4 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.116 -1.404 18766
319 1 4 . 1 1 12 12 HIS H H 12 9.283 9.283 8.328 0.955 18766
320 1 4 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.278 0.508 18766
321 1 4 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.190 -1.909 18766
322 1 4 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.546 -0.444 18766
323 1 4 . 1 1 13 13 ARG H H 13 8.941 8.941 8.799 0.142 18766
324 1 4 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.885 -0.024 18766
325 1 4 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.206 -1.793 18766
326 1 4 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.727 -0.904 18766
327 1 4 . 1 1 14 14 ASP H H 14 8.831 8.831 8.851 -0.020 18766
328 1 4 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.283 -0.262 18766
329 1 4 . 1 1 15 15 GLY H H 15 8.668 8.668 8.692 -0.024 18766
330 1 4 . 1 1 16 16 SER HA H 16 4.614 4.614 4.419 0.195 18766
331 1 4 . 1 1 16 16 SER CA C 16 57.346 57.346 58.849 -1.503 18766
332 1 4 . 1 1 16 16 SER CB C 16 63.633 63.633 64.197 -0.564 18766
333 1 4 . 1 1 16 16 SER H H 16 8.231 8.231 8.262 -0.031 18766
334 1 4 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.802 -0.236 18766
335 1 4 . 1 1 17 17 GLY H H 17 8.096 8.096 7.825 0.271 18766
336 1 4 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.134 -0.281 18766
337 1 4 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.345 -0.599 18766
338 1 4 . 1 1 18 18 ASN CB C 18 39.290 39.290 43.118 -3.828 18766
339 1 4 . 1 1 18 18 ASN H H 18 8.317 8.317 8.966 -0.649 18766
340 1 4 . 1 1 19 19 CYS HA H 19 4.819 4.819 4.989 -0.170 18766
341 1 4 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.363 13.885 18766
342 1 4 . 1 1 19 19 CYS H H 19 8.872 8.872 8.586 0.286 18766
343 1 4 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.087 0.607 18766
344 1 4 . 1 1 20 20 VAL CB C 20 34.426 34.426 35.279 -0.853 18766
345 1 4 . 1 1 20 20 VAL H H 20 9.428 9.428 8.392 1.036 18766
346 1 4 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.801 -0.464 18766
347 1 4 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.010 -0.162 18766
348 1 4 . 1 1 21 21 TYR CB C 21 38.105 38.105 38.163 -0.058 18766
349 1 4 . 1 1 21 21 TYR H H 21 8.524 8.524 7.632 0.892 18766
350 1 4 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.468 -0.235 18766
351 1 4 . 1 1 22 22 ASP CA C 22 52.191 52.191 54.097 -1.906 18766
352 1 4 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.264 -2.219 18766
353 1 4 . 1 1 22 22 ASP H H 22 7.968 7.968 8.284 -0.316 18766
354 1 4 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.124 -0.336 18766
355 1 4 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.029 -0.608 18766
356 1 4 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.723 -0.640 18766
357 1 4 . 1 1 23 23 ALA H H 23 7.706 7.706 8.075 -0.369 18766
358 1 4 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.354 0.087 18766
359 1 4 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.359 -1.068 18766
360 1 4 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.774 -1.795 18766
361 1 4 . 1 1 24 24 TYR H H 24 7.843 7.843 7.726 0.117 18766
362 1 4 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.761 -0.194 18766
363 1 4 . 1 1 25 25 GLY H H 25 7.747 7.747 7.453 0.294 18766
364 1 4 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.678 0.010 18766
365 1 4 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.419 13.865 18766
366 1 4 . 1 1 26 26 CYS H H 26 8.091 8.091 8.537 -0.446 18766
367 1 4 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.041 -0.287 18766
368 1 4 . 1 1 27 27 GLY H H 27 8.546 8.546 8.316 0.230 18766
369 1 4 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.551 -0.138 18766
370 1 4 . 1 1 28 28 ALA CA C 28 59.128 59.128 51.480 7.649 18766
371 1 4 . 1 1 28 28 ALA CB C 28 18.606 18.606 19.569 -0.963 18766
372 1 4 . 1 1 28 28 ALA H H 28 8.016 8.016 7.912 0.104 18766
373 1 5 . 1 1 2 2 SER HA H 2 4.613 4.613 4.857 -0.244 18766
374 1 5 . 1 1 2 2 SER CA C 2 57.815 57.815 57.509 0.306 18766
375 1 5 . 1 1 2 2 SER CB C 2 63.213 63.213 65.006 -1.793 18766
376 1 5 . 1 1 2 2 SER H H 2 8.641 8.641 8.186 0.455 18766
377 1 5 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.324 -0.079 18766
378 1 5 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.897 -0.785 18766
379 1 5 . 1 1 3 3 ILE CB C 3 38.386 38.386 38.520 -0.133 18766
380 1 5 . 1 1 3 3 ILE H H 3 8.297 8.297 8.351 -0.054 18766
381 1 5 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.768 0.138 18766
382 1 5 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.531 -0.740 18766
383 1 5 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.528 -1.202 18766
384 1 5 . 1 1 4 4 ASP H H 4 8.392 8.392 8.344 0.048 18766
385 1 5 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.593 0.102 18766
386 1 5 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.318 -1.210 18766
387 1 5 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.498 -0.018 18766
388 1 5 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.604 -0.268 18766
389 1 5 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.609 -0.952 18766
390 1 5 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.488 0.217 18766
391 1 5 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.542 11.545 18766
392 1 5 . 1 1 7 7 CYS H H 7 8.431 8.431 8.636 -0.205 18766
393 1 5 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.075 0.157 18766
394 1 5 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.297 -0.916 18766
395 1 5 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.425 0.221 18766
396 1 5 . 1 1 8 8 ARG H H 8 8.371 8.371 8.441 -0.070 18766
397 1 5 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.332 0.079 18766
398 1 5 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.232 -7.482 18766
399 1 5 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.642 0.025 18766
400 1 5 . 1 1 9 9 PHE H H 9 8.304 8.304 8.401 -0.097 18766
401 1 5 . 1 1 10 10 CYS HA H 10 3.756 3.756 4.017 -0.261 18766
402 1 5 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.825 -0.766 18766
403 1 5 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.631 16.734 18766
404 1 5 . 1 1 10 10 CYS H H 10 8.564 8.564 8.769 -0.205 18766
405 1 5 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.119 -0.019 18766
406 1 5 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.743 0.116 18766
407 1 5 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.398 -1.767 18766
408 1 5 . 1 1 11 11 TYR H H 11 8.239 8.239 8.147 0.092 18766
409 1 5 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.799 0.234 18766
410 1 5 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.718 -1.104 18766
411 1 5 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.108 -1.396 18766
412 1 5 . 1 1 12 12 HIS H H 12 9.283 9.283 8.305 0.978 18766
413 1 5 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.264 0.522 18766
414 1 5 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.214 -1.933 18766
415 1 5 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.560 -0.458 18766
416 1 5 . 1 1 13 13 ARG H H 13 8.941 8.941 8.789 0.152 18766
417 1 5 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.825 0.036 18766
418 1 5 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.251 -1.838 18766
419 1 5 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.964 -1.141 18766
420 1 5 . 1 1 14 14 ASP H H 14 8.831 8.831 8.765 0.066 18766
421 1 5 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.043 -0.022 18766
422 1 5 . 1 1 15 15 GLY H H 15 8.668 8.668 8.534 0.134 18766
423 1 5 . 1 1 16 16 SER HA H 16 4.614 4.614 4.364 0.250 18766
424 1 5 . 1 1 16 16 SER CA C 16 57.346 57.346 59.138 -1.792 18766
425 1 5 . 1 1 16 16 SER CB C 16 63.633 63.633 64.197 -0.564 18766
426 1 5 . 1 1 16 16 SER H H 16 8.231 8.231 8.565 -0.334 18766
427 1 5 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.963 -0.397 18766
428 1 5 . 1 1 17 17 GLY H H 17 8.096 8.096 7.712 0.385 18766
429 1 5 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.077 -0.224 18766
430 1 5 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.099 -0.353 18766
431 1 5 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.732 -3.442 18766
432 1 5 . 1 1 18 18 ASN H H 18 8.317 8.317 8.750 -0.433 18766
433 1 5 . 1 1 19 19 CYS HA H 19 4.819 4.819 5.010 -0.191 18766
434 1 5 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.554 13.694 18766
435 1 5 . 1 1 19 19 CYS H H 19 8.872 8.872 8.628 0.244 18766
436 1 5 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.130 0.564 18766
437 1 5 . 1 1 20 20 VAL CB C 20 34.426 34.426 35.241 -0.815 18766
438 1 5 . 1 1 20 20 VAL H H 20 9.428 9.428 8.406 1.022 18766
439 1 5 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.771 -0.434 18766
440 1 5 . 1 1 21 21 TYR CA C 21 57.848 57.848 57.977 -0.129 18766
441 1 5 . 1 1 21 21 TYR CB C 21 38.105 38.105 37.968 0.137 18766
442 1 5 . 1 1 21 21 TYR H H 21 8.524 8.524 7.630 0.894 18766
443 1 5 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.436 -0.203 18766
444 1 5 . 1 1 22 22 ASP CA C 22 52.191 52.191 54.123 -1.932 18766
445 1 5 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.281 -2.236 18766
446 1 5 . 1 1 22 22 ASP H H 22 7.968 7.968 8.285 -0.317 18766
447 1 5 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.123 -0.335 18766
448 1 5 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.389 -0.968 18766
449 1 5 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.877 -0.794 18766
450 1 5 . 1 1 23 23 ALA H H 23 7.706 7.706 8.338 -0.632 18766
451 1 5 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.510 -0.069 18766
452 1 5 . 1 1 24 24 TYR CA C 24 57.291 57.291 57.677 -0.386 18766
453 1 5 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.340 -1.361 18766
454 1 5 . 1 1 24 24 TYR H H 24 7.843 7.843 8.103 -0.260 18766
455 1 5 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.767 -0.199 18766
456 1 5 . 1 1 25 25 GLY H H 25 7.747 7.747 7.497 0.250 18766
457 1 5 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.642 0.046 18766
458 1 5 . 1 1 26 26 CYS CB C 26 40.284 40.284 25.951 14.333 18766
459 1 5 . 1 1 26 26 CYS H H 26 8.091 8.091 8.171 -0.080 18766
460 1 5 . 1 1 27 27 GLY CA C 27 44.754 44.754 44.760 -0.006 18766
461 1 5 . 1 1 27 27 GLY H H 27 8.546 8.546 7.813 0.733 18766
462 1 5 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.546 -0.133 18766
463 1 5 . 1 1 28 28 ALA CA C 28 59.128 59.128 51.747 7.381 18766
464 1 5 . 1 1 28 28 ALA CB C 28 18.606 18.606 20.057 -1.451 18766
465 1 5 . 1 1 28 28 ALA H H 28 8.016 8.016 8.116 -0.100 18766
466 1 6 . 1 1 2 2 SER HA H 2 4.613 4.613 4.834 -0.221 18766
467 1 6 . 1 1 2 2 SER CA C 2 57.815 57.815 57.899 -0.084 18766
468 1 6 . 1 1 2 2 SER CB C 2 63.213 63.213 64.043 -0.830 18766
469 1 6 . 1 1 2 2 SER H H 2 8.641 8.641 8.221 0.420 18766
470 1 6 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.249 -0.004 18766
471 1 6 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.680 -0.568 18766
472 1 6 . 1 1 3 3 ILE CB C 3 38.386 38.386 39.089 -0.703 18766
473 1 6 . 1 1 3 3 ILE H H 3 8.297 8.297 8.319 -0.022 18766
474 1 6 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.725 0.181 18766
475 1 6 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.509 -0.718 18766
476 1 6 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.930 -1.604 18766
477 1 6 . 1 1 4 4 ASP H H 4 8.392 8.392 8.409 -0.017 18766
478 1 6 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.642 0.053 18766
479 1 6 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.260 -1.152 18766
480 1 6 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.483 -0.003 18766
481 1 6 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.672 -0.336 18766
482 1 6 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.590 -0.933 18766
483 1 6 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.523 0.182 18766
484 1 6 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.632 11.455 18766
485 1 6 . 1 1 7 7 CYS H H 7 8.431 8.431 8.637 -0.206 18766
486 1 6 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.093 0.139 18766
487 1 6 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.307 -0.925 18766
488 1 6 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.423 0.223 18766
489 1 6 . 1 1 8 8 ARG H H 8 8.371 8.371 8.466 -0.095 18766
490 1 6 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.320 0.091 18766
491 1 6 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.661 -7.911 18766
492 1 6 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.723 -0.055 18766
493 1 6 . 1 1 9 9 PHE H H 9 8.304 8.304 8.413 -0.109 18766
494 1 6 . 1 1 10 10 CYS HA H 10 3.756 3.756 3.972 -0.216 18766
495 1 6 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.787 -0.728 18766
496 1 6 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.635 16.730 18766
497 1 6 . 1 1 10 10 CYS H H 10 8.564 8.564 8.647 -0.083 18766
498 1 6 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.129 -0.029 18766
499 1 6 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.708 0.152 18766
500 1 6 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.392 -1.761 18766
501 1 6 . 1 1 11 11 TYR H H 11 8.239 8.239 8.127 0.112 18766
502 1 6 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.731 0.302 18766
503 1 6 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.752 -1.138 18766
504 1 6 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.370 -1.658 18766
505 1 6 . 1 1 12 12 HIS H H 12 9.283 9.283 8.278 1.005 18766
506 1 6 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.363 0.423 18766
507 1 6 . 1 1 13 13 ARG CA C 13 55.281 55.281 56.808 -1.527 18766
508 1 6 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.069 0.033 18766
509 1 6 . 1 1 13 13 ARG H H 13 8.941 8.941 8.800 0.141 18766
510 1 6 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.789 0.072 18766
511 1 6 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.112 -1.699 18766
512 1 6 . 1 1 14 14 ASP CB C 14 40.823 40.823 42.201 -1.378 18766
513 1 6 . 1 1 14 14 ASP H H 14 8.831 8.831 8.778 0.053 18766
514 1 6 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.051 -0.030 18766
515 1 6 . 1 1 15 15 GLY H H 15 8.668 8.668 8.594 0.074 18766
516 1 6 . 1 1 16 16 SER HA H 16 4.614 4.614 4.354 0.260 18766
517 1 6 . 1 1 16 16 SER CA C 16 57.346 57.346 58.793 -1.447 18766
518 1 6 . 1 1 16 16 SER CB C 16 63.633 63.633 63.959 -0.326 18766
519 1 6 . 1 1 16 16 SER H H 16 8.231 8.231 8.585 -0.354 18766
520 1 6 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.732 -0.166 18766
521 1 6 . 1 1 17 17 GLY H H 17 8.096 8.096 7.726 0.370 18766
522 1 6 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.094 -0.241 18766
523 1 6 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.035 -0.289 18766
524 1 6 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.903 -3.613 18766
525 1 6 . 1 1 18 18 ASN H H 18 8.317 8.317 8.899 -0.582 18766
526 1 6 . 1 1 19 19 CYS HA H 19 4.819 4.819 5.022 -0.203 18766
527 1 6 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.601 13.647 18766
528 1 6 . 1 1 19 19 CYS H H 19 8.872 8.872 8.661 0.211 18766
529 1 6 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.058 0.636 18766
530 1 6 . 1 1 20 20 VAL CB C 20 34.426 34.426 35.025 -0.599 18766
531 1 6 . 1 1 20 20 VAL H H 20 9.428 9.428 8.284 1.144 18766
532 1 6 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.805 -0.468 18766
533 1 6 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.113 -0.265 18766
534 1 6 . 1 1 21 21 TYR CB C 21 38.105 38.105 38.032 0.073 18766
535 1 6 . 1 1 21 21 TYR H H 21 8.524 8.524 7.645 0.879 18766
536 1 6 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.476 -0.242 18766
537 1 6 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.616 -1.425 18766
538 1 6 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.179 -2.134 18766
539 1 6 . 1 1 22 22 ASP H H 22 7.968 7.968 8.298 -0.330 18766
540 1 6 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.177 -0.389 18766
541 1 6 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.169 -0.748 18766
542 1 6 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.695 -0.612 18766
543 1 6 . 1 1 23 23 ALA H H 23 7.706 7.706 8.047 -0.341 18766
544 1 6 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.380 0.061 18766
545 1 6 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.072 -0.780 18766
546 1 6 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.630 -1.651 18766
547 1 6 . 1 1 24 24 TYR H H 24 7.843 7.843 7.818 0.025 18766
548 1 6 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.791 -0.223 18766
549 1 6 . 1 1 25 25 GLY H H 25 7.747 7.747 7.480 0.267 18766
550 1 6 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.744 -0.056 18766
551 1 6 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.653 13.631 18766
552 1 6 . 1 1 26 26 CYS H H 26 8.091 8.091 8.451 -0.360 18766
553 1 6 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.186 -0.432 18766
554 1 6 . 1 1 27 27 GLY H H 27 8.546 8.546 8.109 0.437 18766
555 1 6 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.484 -0.071 18766
556 1 6 . 1 1 28 28 ALA CA C 28 59.128 59.128 52.480 6.648 18766
557 1 6 . 1 1 28 28 ALA CB C 28 18.606 18.606 18.957 -0.351 18766
558 1 6 . 1 1 28 28 ALA H H 28 8.016 8.016 8.322 -0.306 18766
559 1 7 . 1 1 2 2 SER HA H 2 4.613 4.613 4.789 -0.176 18766
560 1 7 . 1 1 2 2 SER CA C 2 57.815 57.815 57.597 0.218 18766
561 1 7 . 1 1 2 2 SER CB C 2 63.213 63.213 64.010 -0.797 18766
562 1 7 . 1 1 2 2 SER H H 2 8.641 8.641 8.225 0.416 18766
563 1 7 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.232 0.013 18766
564 1 7 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.830 -0.718 18766
565 1 7 . 1 1 3 3 ILE CB C 3 38.386 38.386 39.679 -1.293 18766
566 1 7 . 1 1 3 3 ILE H H 3 8.297 8.297 8.228 0.069 18766
567 1 7 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.752 0.154 18766
568 1 7 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.614 -0.823 18766
569 1 7 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.651 -1.325 18766
570 1 7 . 1 1 4 4 ASP H H 4 8.392 8.392 8.401 -0.009 18766
571 1 7 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.577 0.118 18766
572 1 7 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.348 -1.240 18766
573 1 7 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.495 -0.015 18766
574 1 7 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.580 -0.243 18766
575 1 7 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.604 -0.947 18766
576 1 7 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.465 0.240 18766
577 1 7 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.485 11.601 18766
578 1 7 . 1 1 7 7 CYS H H 7 8.431 8.431 8.620 -0.189 18766
579 1 7 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.080 0.152 18766
580 1 7 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.335 -0.953 18766
581 1 7 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.402 0.244 18766
582 1 7 . 1 1 8 8 ARG H H 8 8.371 8.371 8.457 -0.086 18766
583 1 7 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.328 0.083 18766
584 1 7 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.259 -7.509 18766
585 1 7 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.618 0.050 18766
586 1 7 . 1 1 9 9 PHE H H 9 8.304 8.304 8.421 -0.117 18766
587 1 7 . 1 1 10 10 CYS HA H 10 3.756 3.756 4.020 -0.264 18766
588 1 7 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.832 -0.773 18766
589 1 7 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.620 16.745 18766
590 1 7 . 1 1 10 10 CYS H H 10 8.564 8.564 8.773 -0.209 18766
591 1 7 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.121 -0.021 18766
592 1 7 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.776 0.083 18766
593 1 7 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.428 -1.797 18766
594 1 7 . 1 1 11 11 TYR H H 11 8.239 8.239 8.158 0.081 18766
595 1 7 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.800 0.233 18766
596 1 7 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.699 -1.085 18766
597 1 7 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.198 -1.486 18766
598 1 7 . 1 1 12 12 HIS H H 12 9.283 9.283 8.311 0.972 18766
599 1 7 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.287 0.499 18766
600 1 7 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.111 -1.830 18766
601 1 7 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.582 -0.480 18766
602 1 7 . 1 1 13 13 ARG H H 13 8.941 8.941 8.793 0.148 18766
603 1 7 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.819 0.043 18766
604 1 7 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.198 -1.785 18766
605 1 7 . 1 1 14 14 ASP CB C 14 40.823 40.823 42.030 -1.207 18766
606 1 7 . 1 1 14 14 ASP H H 14 8.831 8.831 8.732 0.099 18766
607 1 7 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.114 -0.093 18766
608 1 7 . 1 1 15 15 GLY H H 15 8.668 8.668 8.455 0.213 18766
609 1 7 . 1 1 16 16 SER HA H 16 4.614 4.614 4.377 0.237 18766
610 1 7 . 1 1 16 16 SER CA C 16 57.346 57.346 59.110 -1.764 18766
611 1 7 . 1 1 16 16 SER CB C 16 63.633 63.633 64.166 -0.533 18766
612 1 7 . 1 1 16 16 SER H H 16 8.231 8.231 8.423 -0.192 18766
613 1 7 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.916 -0.350 18766
614 1 7 . 1 1 17 17 GLY H H 17 8.096 8.096 7.707 0.389 18766
615 1 7 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.059 -0.206 18766
616 1 7 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.317 -0.571 18766
617 1 7 . 1 1 18 18 ASN CB C 18 39.290 39.290 43.121 -3.831 18766
618 1 7 . 1 1 18 18 ASN H H 18 8.317 8.317 8.780 -0.463 18766
619 1 7 . 1 1 19 19 CYS HA H 19 4.819 4.819 4.960 -0.141 18766
620 1 7 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.586 13.662 18766
621 1 7 . 1 1 19 19 CYS H H 19 8.872 8.872 8.617 0.255 18766
622 1 7 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.064 0.630 18766
623 1 7 . 1 1 20 20 VAL CB C 20 34.426 34.426 34.883 -0.457 18766
624 1 7 . 1 1 20 20 VAL H H 20 9.428 9.428 8.449 0.979 18766
625 1 7 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.773 -0.436 18766
626 1 7 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.096 -0.248 18766
627 1 7 . 1 1 21 21 TYR CB C 21 38.105 38.105 37.958 0.147 18766
628 1 7 . 1 1 21 21 TYR H H 21 8.524 8.524 7.622 0.902 18766
629 1 7 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.460 -0.227 18766
630 1 7 . 1 1 22 22 ASP CA C 22 52.191 52.191 54.010 -1.819 18766
631 1 7 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.224 -2.179 18766
632 1 7 . 1 1 22 22 ASP H H 22 7.968 7.968 8.288 -0.320 18766
633 1 7 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.095 -0.307 18766
634 1 7 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.328 -0.907 18766
635 1 7 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.822 -0.739 18766
636 1 7 . 1 1 23 23 ALA H H 23 7.706 7.706 8.331 -0.625 18766
637 1 7 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.484 -0.043 18766
638 1 7 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.400 -1.109 18766
639 1 7 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.453 -1.474 18766
640 1 7 . 1 1 24 24 TYR H H 24 7.843 7.843 8.107 -0.264 18766
641 1 7 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.672 -0.104 18766
642 1 7 . 1 1 25 25 GLY H H 25 7.747 7.747 7.490 0.257 18766
643 1 7 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.779 -0.091 18766
644 1 7 . 1 1 26 26 CYS CB C 26 40.284 40.284 25.938 14.346 18766
645 1 7 . 1 1 26 26 CYS H H 26 8.091 8.091 8.371 -0.280 18766
646 1 7 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.303 -0.549 18766
647 1 7 . 1 1 27 27 GLY H H 27 8.546 8.546 8.337 0.209 18766
648 1 7 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.434 -0.021 18766
649 1 7 . 1 1 28 28 ALA CA C 28 59.128 59.128 51.875 7.253 18766
650 1 7 . 1 1 28 28 ALA CB C 28 18.606 18.606 19.007 -0.401 18766
651 1 7 . 1 1 28 28 ALA H H 28 8.016 8.016 7.999 0.017 18766
652 1 8 . 1 1 2 2 SER HA H 2 4.613 4.613 4.673 -0.060 18766
653 1 8 . 1 1 2 2 SER CA C 2 57.815 57.815 57.886 -0.071 18766
654 1 8 . 1 1 2 2 SER CB C 2 63.213 63.213 63.855 -0.642 18766
655 1 8 . 1 1 2 2 SER H H 2 8.641 8.641 7.916 0.725 18766
656 1 8 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.212 0.033 18766
657 1 8 . 1 1 3 3 ILE CA C 3 60.112 60.112 61.051 -0.939 18766
658 1 8 . 1 1 3 3 ILE CB C 3 38.386 38.386 38.930 -0.544 18766
659 1 8 . 1 1 3 3 ILE H H 3 8.297 8.297 8.358 -0.061 18766
660 1 8 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.699 0.207 18766
661 1 8 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.605 -0.814 18766
662 1 8 . 1 1 4 4 ASP CB C 4 39.326 39.326 41.018 -1.692 18766
663 1 8 . 1 1 4 4 ASP H H 4 8.392 8.392 8.413 -0.021 18766
664 1 8 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.638 0.057 18766
665 1 8 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.276 -1.169 18766
666 1 8 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.487 -0.007 18766
667 1 8 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.657 -0.321 18766
668 1 8 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.586 -0.929 18766
669 1 8 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.512 0.193 18766
670 1 8 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.577 11.510 18766
671 1 8 . 1 1 7 7 CYS H H 7 8.431 8.431 8.642 -0.211 18766
672 1 8 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.085 0.147 18766
673 1 8 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.267 -0.885 18766
674 1 8 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.414 0.232 18766
675 1 8 . 1 1 8 8 ARG H H 8 8.371 8.371 8.455 -0.084 18766
676 1 8 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.332 0.079 18766
677 1 8 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.218 -7.468 18766
678 1 8 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.627 0.041 18766
679 1 8 . 1 1 9 9 PHE H H 9 8.304 8.304 8.410 -0.106 18766
680 1 8 . 1 1 10 10 CYS HA H 10 3.756 3.756 4.020 -0.264 18766
681 1 8 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.827 -0.768 18766
682 1 8 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.625 16.740 18766
683 1 8 . 1 1 10 10 CYS H H 10 8.564 8.564 8.781 -0.217 18766
684 1 8 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.130 -0.030 18766
685 1 8 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.725 0.134 18766
686 1 8 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.400 -1.769 18766
687 1 8 . 1 1 11 11 TYR H H 11 8.239 8.239 8.147 0.092 18766
688 1 8 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.808 0.225 18766
689 1 8 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.718 -1.104 18766
690 1 8 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.167 -1.455 18766
691 1 8 . 1 1 12 12 HIS H H 12 9.283 9.283 8.295 0.988 18766
692 1 8 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.296 0.490 18766
693 1 8 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.155 -1.874 18766
694 1 8 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.578 -0.476 18766
695 1 8 . 1 1 13 13 ARG H H 13 8.941 8.941 8.799 0.142 18766
696 1 8 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.844 0.017 18766
697 1 8 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.243 -1.830 18766
698 1 8 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.996 -1.173 18766
699 1 8 . 1 1 14 14 ASP H H 14 8.831 8.831 8.782 0.049 18766
700 1 8 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.204 -0.183 18766
701 1 8 . 1 1 15 15 GLY H H 15 8.668 8.668 8.439 0.229 18766
702 1 8 . 1 1 16 16 SER HA H 16 4.614 4.614 4.385 0.229 18766
703 1 8 . 1 1 16 16 SER CA C 16 57.346 57.346 58.875 -1.529 18766
704 1 8 . 1 1 16 16 SER CB C 16 63.633 63.633 64.117 -0.484 18766
705 1 8 . 1 1 16 16 SER H H 16 8.231 8.231 8.385 -0.154 18766
706 1 8 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.874 -0.308 18766
707 1 8 . 1 1 17 17 GLY H H 17 8.096 8.096 7.674 0.422 18766
708 1 8 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.083 -0.230 18766
709 1 8 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.202 -0.456 18766
710 1 8 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.931 -3.641 18766
711 1 8 . 1 1 18 18 ASN H H 18 8.317 8.317 8.790 -0.473 18766
712 1 8 . 1 1 19 19 CYS HA H 19 4.819 4.819 5.036 -0.217 18766
713 1 8 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.526 13.722 18766
714 1 8 . 1 1 19 19 CYS H H 19 8.872 8.872 8.572 0.300 18766
715 1 8 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.068 0.626 18766
716 1 8 . 1 1 20 20 VAL CB C 20 34.426 34.426 35.340 -0.914 18766
717 1 8 . 1 1 20 20 VAL H H 20 9.428 9.428 8.322 1.106 18766
718 1 8 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.809 -0.472 18766
719 1 8 . 1 1 21 21 TYR CA C 21 57.848 57.848 57.951 -0.103 18766
720 1 8 . 1 1 21 21 TYR CB C 21 38.105 38.105 38.166 -0.061 18766
721 1 8 . 1 1 21 21 TYR H H 21 8.524 8.524 7.644 0.880 18766
722 1 8 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.477 -0.244 18766
723 1 8 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.835 -1.644 18766
724 1 8 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.170 -2.125 18766
725 1 8 . 1 1 22 22 ASP H H 22 7.968 7.968 8.288 -0.320 18766
726 1 8 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.072 -0.284 18766
727 1 8 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.249 -0.828 18766
728 1 8 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.720 -0.637 18766
729 1 8 . 1 1 23 23 ALA H H 23 7.706 7.706 8.298 -0.592 18766
730 1 8 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.463 -0.022 18766
731 1 8 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.609 -1.318 18766
732 1 8 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.563 -1.584 18766
733 1 8 . 1 1 24 24 TYR H H 24 7.843 7.843 8.046 -0.203 18766
734 1 8 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.760 -0.192 18766
735 1 8 . 1 1 25 25 GLY H H 25 7.747 7.747 7.479 0.268 18766
736 1 8 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.705 -0.017 18766
737 1 8 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.420 13.864 18766
738 1 8 . 1 1 26 26 CYS H H 26 8.091 8.091 8.478 -0.387 18766
739 1 8 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.388 -0.634 18766
740 1 8 . 1 1 27 27 GLY H H 27 8.546 8.546 8.366 0.180 18766
741 1 8 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.442 -0.029 18766
742 1 8 . 1 1 28 28 ALA CA C 28 59.128 59.128 52.325 6.803 18766
743 1 8 . 1 1 28 28 ALA CB C 28 18.606 18.606 19.190 -0.584 18766
744 1 8 . 1 1 28 28 ALA H H 28 8.016 8.016 8.265 -0.249 18766
745 1 9 . 1 1 2 2 SER HA H 2 4.613 4.613 4.776 -0.163 18766
746 1 9 . 1 1 2 2 SER CA C 2 57.815 57.815 57.915 -0.100 18766
747 1 9 . 1 1 2 2 SER CB C 2 63.213 63.213 64.481 -1.268 18766
748 1 9 . 1 1 2 2 SER H H 2 8.641 8.641 7.943 0.698 18766
749 1 9 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.341 -0.096 18766
750 1 9 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.856 -0.744 18766
751 1 9 . 1 1 3 3 ILE CB C 3 38.386 38.386 39.076 -0.690 18766
752 1 9 . 1 1 3 3 ILE H H 3 8.297 8.297 8.364 -0.067 18766
753 1 9 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.715 0.191 18766
754 1 9 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.789 -0.998 18766
755 1 9 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.741 -1.415 18766
756 1 9 . 1 1 4 4 ASP H H 4 8.392 8.392 8.374 0.018 18766
757 1 9 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.568 0.127 18766
758 1 9 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.343 -1.235 18766
759 1 9 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.495 -0.015 18766
760 1 9 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.622 -0.286 18766
761 1 9 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.625 -0.968 18766
762 1 9 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.501 0.204 18766
763 1 9 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.593 11.495 18766
764 1 9 . 1 1 7 7 CYS H H 7 8.431 8.431 8.630 -0.199 18766
765 1 9 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.089 0.143 18766
766 1 9 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.325 -0.943 18766
767 1 9 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.409 0.237 18766
768 1 9 . 1 1 8 8 ARG H H 8 8.371 8.371 8.462 -0.091 18766
769 1 9 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.322 0.089 18766
770 1 9 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.546 -7.796 18766
771 1 9 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.693 -0.025 18766
772 1 9 . 1 1 9 9 PHE H H 9 8.304 8.304 8.415 -0.111 18766
773 1 9 . 1 1 10 10 CYS HA H 10 3.756 3.756 3.982 -0.226 18766
774 1 9 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.798 -0.739 18766
775 1 9 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.627 16.738 18766
776 1 9 . 1 1 10 10 CYS H H 10 8.564 8.564 8.682 -0.118 18766
777 1 9 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.124 -0.024 18766
778 1 9 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.720 0.139 18766
779 1 9 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.391 -1.760 18766
780 1 9 . 1 1 11 11 TYR H H 11 8.239 8.239 8.126 0.113 18766
781 1 9 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.796 0.237 18766
782 1 9 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.709 -1.095 18766
783 1 9 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.133 -1.421 18766
784 1 9 . 1 1 12 12 HIS H H 12 9.283 9.283 8.284 0.999 18766
785 1 9 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.276 0.510 18766
786 1 9 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.157 -1.876 18766
787 1 9 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.565 -0.463 18766
788 1 9 . 1 1 13 13 ARG H H 13 8.941 8.941 8.787 0.154 18766
789 1 9 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.821 0.040 18766
790 1 9 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.231 -1.818 18766
791 1 9 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.996 -1.173 18766
792 1 9 . 1 1 14 14 ASP H H 14 8.831 8.831 8.762 0.069 18766
793 1 9 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.417 -0.396 18766
794 1 9 . 1 1 15 15 GLY H H 15 8.668 8.668 8.614 0.054 18766
795 1 9 . 1 1 16 16 SER HA H 16 4.614 4.614 4.409 0.205 18766
796 1 9 . 1 1 16 16 SER CA C 16 57.346 57.346 58.836 -1.490 18766
797 1 9 . 1 1 16 16 SER CB C 16 63.633 63.633 63.792 -0.159 18766
798 1 9 . 1 1 16 16 SER H H 16 8.231 8.231 8.533 -0.301 18766
799 1 9 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.964 -0.398 18766
800 1 9 . 1 1 17 17 GLY H H 17 8.096 8.096 7.663 0.433 18766
801 1 9 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.084 -0.231 18766
802 1 9 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.125 -0.379 18766
803 1 9 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.801 -3.511 18766
804 1 9 . 1 1 18 18 ASN H H 18 8.317 8.317 8.760 -0.443 18766
805 1 9 . 1 1 19 19 CYS HA H 19 4.819 4.819 5.016 -0.197 18766
806 1 9 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.829 13.419 18766
807 1 9 . 1 1 19 19 CYS H H 19 8.872 8.872 8.592 0.280 18766
808 1 9 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.036 0.658 18766
809 1 9 . 1 1 20 20 VAL CB C 20 34.426 34.426 34.883 -0.457 18766
810 1 9 . 1 1 20 20 VAL H H 20 9.428 9.428 8.383 1.045 18766
811 1 9 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.800 -0.463 18766
812 1 9 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.096 -0.248 18766
813 1 9 . 1 1 21 21 TYR CB C 21 38.105 38.105 38.004 0.101 18766
814 1 9 . 1 1 21 21 TYR H H 21 8.524 8.524 7.636 0.888 18766
815 1 9 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.455 -0.222 18766
816 1 9 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.683 -1.492 18766
817 1 9 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.157 -2.112 18766
818 1 9 . 1 1 22 22 ASP H H 22 7.968 7.968 8.285 -0.317 18766
819 1 9 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.191 -0.403 18766
820 1 9 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.207 -0.786 18766
821 1 9 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.759 -0.676 18766
822 1 9 . 1 1 23 23 ALA H H 23 7.706 7.706 8.069 -0.363 18766
823 1 9 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.383 0.057 18766
824 1 9 . 1 1 24 24 TYR CA C 24 57.291 57.291 57.405 -0.114 18766
825 1 9 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.493 -1.514 18766
826 1 9 . 1 1 24 24 TYR H H 24 7.843 7.843 7.818 0.025 18766
827 1 9 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.821 -0.253 18766
828 1 9 . 1 1 25 25 GLY H H 25 7.747 7.747 7.486 0.261 18766
829 1 9 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.720 -0.032 18766
830 1 9 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.456 13.828 18766
831 1 9 . 1 1 26 26 CYS H H 26 8.091 8.091 8.446 -0.355 18766
832 1 9 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.625 -0.871 18766
833 1 9 . 1 1 27 27 GLY H H 27 8.546 8.546 8.382 0.164 18766
834 1 9 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.441 -0.028 18766
835 1 9 . 1 1 28 28 ALA CA C 28 59.128 59.128 52.123 7.005 18766
836 1 9 . 1 1 28 28 ALA CB C 28 18.606 18.606 19.327 -0.721 18766
837 1 9 . 1 1 28 28 ALA H H 28 8.016 8.016 8.162 -0.146 18766
838 1 10 . 1 1 2 2 SER HA H 2 4.613 4.613 4.958 -0.345 18766
839 1 10 . 1 1 2 2 SER CA C 2 57.815 57.815 57.908 -0.093 18766
840 1 10 . 1 1 2 2 SER CB C 2 63.213 63.213 64.673 -1.460 18766
841 1 10 . 1 1 2 2 SER H H 2 8.641 8.641 8.189 0.452 18766
842 1 10 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.380 -0.135 18766
843 1 10 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.857 -0.745 18766
844 1 10 . 1 1 3 3 ILE CB C 3 38.386 38.386 38.732 -0.346 18766
845 1 10 . 1 1 3 3 ILE H H 3 8.297 8.297 8.187 0.110 18766
846 1 10 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.689 0.217 18766
847 1 10 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.793 -1.002 18766
848 1 10 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.776 -1.450 18766
849 1 10 . 1 1 4 4 ASP H H 4 8.392 8.392 8.420 -0.028 18766
850 1 10 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.562 0.133 18766
851 1 10 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.348 -1.240 18766
852 1 10 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.497 -0.017 18766
853 1 10 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.604 -0.268 18766
854 1 10 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.620 -0.963 18766
855 1 10 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.492 0.213 18766
856 1 10 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.537 11.550 18766
857 1 10 . 1 1 7 7 CYS H H 7 8.431 8.431 8.643 -0.212 18766
858 1 10 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.076 0.156 18766
859 1 10 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.334 -0.952 18766
860 1 10 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.440 0.206 18766
861 1 10 . 1 1 8 8 ARG H H 8 8.371 8.371 8.441 -0.070 18766
862 1 10 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.334 0.077 18766
863 1 10 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.191 -7.441 18766
864 1 10 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.646 0.022 18766
865 1 10 . 1 1 9 9 PHE H H 9 8.304 8.304 8.397 -0.093 18766
866 1 10 . 1 1 10 10 CYS HA H 10 3.756 3.756 4.024 -0.268 18766
867 1 10 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.827 -0.768 18766
868 1 10 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.629 16.736 18766
869 1 10 . 1 1 10 10 CYS H H 10 8.564 8.564 8.779 -0.215 18766
870 1 10 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.123 -0.023 18766
871 1 10 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.755 0.104 18766
872 1 10 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.409 -1.778 18766
873 1 10 . 1 1 11 11 TYR H H 11 8.239 8.239 8.163 0.076 18766
874 1 10 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.809 0.224 18766
875 1 10 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.715 -1.101 18766
876 1 10 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.156 -1.444 18766
877 1 10 . 1 1 12 12 HIS H H 12 9.283 9.283 8.326 0.957 18766
878 1 10 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.280 0.506 18766
879 1 10 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.151 -1.870 18766
880 1 10 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.552 -0.450 18766
881 1 10 . 1 1 13 13 ARG H H 13 8.941 8.941 8.800 0.141 18766
882 1 10 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.870 -0.009 18766
883 1 10 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.190 -1.776 18766
884 1 10 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.709 -0.886 18766
885 1 10 . 1 1 14 14 ASP H H 14 8.831 8.831 8.844 -0.013 18766
886 1 10 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.169 -0.148 18766
887 1 10 . 1 1 15 15 GLY H H 15 8.668 8.668 8.676 -0.008 18766
888 1 10 . 1 1 16 16 SER HA H 16 4.614 4.614 4.401 0.213 18766
889 1 10 . 1 1 16 16 SER CA C 16 57.346 57.346 58.699 -1.353 18766
890 1 10 . 1 1 16 16 SER CB C 16 63.633 63.633 64.123 -0.490 18766
891 1 10 . 1 1 16 16 SER H H 16 8.231 8.231 8.333 -0.102 18766
892 1 10 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.819 -0.253 18766
893 1 10 . 1 1 17 17 GLY H H 17 8.096 8.096 7.810 0.286 18766
894 1 10 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.045 -0.192 18766
895 1 10 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.259 -0.513 18766
896 1 10 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.671 -3.381 18766
897 1 10 . 1 1 18 18 ASN H H 18 8.317 8.317 8.954 -0.637 18766
898 1 10 . 1 1 19 19 CYS HA H 19 4.819 4.819 4.991 -0.172 18766
899 1 10 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.658 13.590 18766
900 1 10 . 1 1 19 19 CYS H H 19 8.872 8.872 8.619 0.253 18766
901 1 10 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.074 0.620 18766
902 1 10 . 1 1 20 20 VAL CB C 20 34.426 34.426 34.936 -0.510 18766
903 1 10 . 1 1 20 20 VAL H H 20 9.428 9.428 8.482 0.946 18766
904 1 10 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.776 -0.439 18766
905 1 10 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.123 -0.276 18766
906 1 10 . 1 1 21 21 TYR CB C 21 38.105 38.105 37.956 0.149 18766
907 1 10 . 1 1 21 21 TYR H H 21 8.524 8.524 7.623 0.901 18766
908 1 10 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.474 -0.241 18766
909 1 10 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.807 -1.617 18766
910 1 10 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.168 -2.123 18766
911 1 10 . 1 1 22 22 ASP H H 22 7.968 7.968 8.285 -0.317 18766
912 1 10 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.072 -0.284 18766
913 1 10 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.263 -0.842 18766
914 1 10 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.734 -0.651 18766
915 1 10 . 1 1 23 23 ALA H H 23 7.706 7.706 8.299 -0.593 18766
916 1 10 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.466 -0.025 18766
917 1 10 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.621 -1.330 18766
918 1 10 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.542 -1.563 18766
919 1 10 . 1 1 24 24 TYR H H 24 7.843 7.843 8.060 -0.217 18766
920 1 10 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.710 -0.142 18766
921 1 10 . 1 1 25 25 GLY H H 25 7.747 7.747 7.461 0.286 18766
922 1 10 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.582 0.106 18766
923 1 10 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.296 13.988 18766
924 1 10 . 1 1 26 26 CYS H H 26 8.091 8.091 8.168 -0.077 18766
925 1 10 . 1 1 27 27 GLY CA C 27 44.754 44.754 44.940 -0.186 18766
926 1 10 . 1 1 27 27 GLY H H 27 8.546 8.546 7.913 0.633 18766
927 1 10 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.552 -0.139 18766
928 1 10 . 1 1 28 28 ALA CA C 28 59.128 59.128 52.017 7.112 18766
929 1 10 . 1 1 28 28 ALA CB C 28 18.606 18.606 19.464 -0.858 18766
930 1 10 . 1 1 28 28 ALA H H 28 8.016 8.016 8.229 -0.213 18766
931 1 11 . 1 1 2 2 SER HA H 2 4.613 4.613 4.590 0.023 18766
932 1 11 . 1 1 2 2 SER CA C 2 57.815 57.815 57.825 -0.010 18766
933 1 11 . 1 1 2 2 SER CB C 2 63.213 63.213 63.018 0.195 18766
934 1 11 . 1 1 2 2 SER H H 2 8.641 8.641 8.211 0.430 18766
935 1 11 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.224 0.021 18766
936 1 11 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.270 -0.158 18766
937 1 11 . 1 1 3 3 ILE CB C 3 38.386 38.386 38.464 -0.077 18766
938 1 11 . 1 1 3 3 ILE H H 3 8.297 8.297 7.370 0.927 18766
939 1 11 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.793 0.113 18766
940 1 11 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.577 -0.786 18766
941 1 11 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.920 -1.594 18766
942 1 11 . 1 1 4 4 ASP H H 4 8.392 8.392 8.381 0.011 18766
943 1 11 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.654 0.041 18766
944 1 11 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.292 -1.184 18766
945 1 11 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.484 -0.004 18766
946 1 11 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.661 -0.325 18766
947 1 11 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.593 -0.936 18766
948 1 11 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.514 0.191 18766
949 1 11 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.563 11.524 18766
950 1 11 . 1 1 7 7 CYS H H 7 8.431 8.431 8.650 -0.219 18766
951 1 11 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.081 0.151 18766
952 1 11 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.280 -0.898 18766
953 1 11 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.433 0.213 18766
954 1 11 . 1 1 8 8 ARG H H 8 8.371 8.371 8.445 -0.074 18766
955 1 11 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.336 0.075 18766
956 1 11 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.111 -7.361 18766
957 1 11 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.619 0.049 18766
958 1 11 . 1 1 9 9 PHE H H 9 8.304 8.304 8.404 -0.100 18766
959 1 11 . 1 1 10 10 CYS HA H 10 3.756 3.756 4.034 -0.278 18766
960 1 11 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.839 -0.780 18766
961 1 11 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.637 16.728 18766
962 1 11 . 1 1 10 10 CYS H H 10 8.564 8.564 8.806 -0.242 18766
963 1 11 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.132 -0.032 18766
964 1 11 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.741 0.118 18766
965 1 11 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.409 -1.778 18766
966 1 11 . 1 1 11 11 TYR H H 11 8.239 8.239 8.164 0.075 18766
967 1 11 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.808 0.225 18766
968 1 11 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.733 -1.119 18766
969 1 11 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.136 -1.424 18766
970 1 11 . 1 1 12 12 HIS H H 12 9.283 9.283 8.328 0.955 18766
971 1 11 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.277 0.509 18766
972 1 11 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.227 -1.946 18766
973 1 11 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.576 -0.475 18766
974 1 11 . 1 1 13 13 ARG H H 13 8.941 8.941 8.801 0.140 18766
975 1 11 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.852 0.009 18766
976 1 11 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.304 -1.891 18766
977 1 11 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.940 -1.117 18766
978 1 11 . 1 1 14 14 ASP H H 14 8.831 8.831 8.782 0.049 18766
979 1 11 . 1 1 15 15 GLY CA C 15 46.021 46.021 45.966 0.055 18766
980 1 11 . 1 1 15 15 GLY H H 15 8.668 8.668 8.557 0.111 18766
981 1 11 . 1 1 16 16 SER HA H 16 4.614 4.614 4.397 0.217 18766
982 1 11 . 1 1 16 16 SER CA C 16 57.346 57.346 58.642 -1.296 18766
983 1 11 . 1 1 16 16 SER CB C 16 63.633 63.633 64.084 -0.451 18766
984 1 11 . 1 1 16 16 SER H H 16 8.231 8.231 8.521 -0.290 18766
985 1 11 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.867 -0.301 18766
986 1 11 . 1 1 17 17 GLY H H 17 8.096 8.096 7.684 0.412 18766
987 1 11 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.086 -0.233 18766
988 1 11 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.122 -0.376 18766
989 1 11 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.763 -3.473 18766
990 1 11 . 1 1 18 18 ASN H H 18 8.317 8.317 8.768 -0.451 18766
991 1 11 . 1 1 19 19 CYS HA H 19 4.819 4.819 5.011 -0.192 18766
992 1 11 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.547 13.701 18766
993 1 11 . 1 1 19 19 CYS H H 19 8.872 8.872 8.639 0.233 18766
994 1 11 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.148 0.546 18766
995 1 11 . 1 1 20 20 VAL CB C 20 34.426 34.426 35.251 -0.825 18766
996 1 11 . 1 1 20 20 VAL H H 20 9.428 9.428 8.444 0.984 18766
997 1 11 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.772 -0.435 18766
998 1 11 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.009 -0.161 18766
999 1 11 . 1 1 21 21 TYR CB C 21 38.105 38.105 37.999 0.106 18766
1000 1 11 . 1 1 21 21 TYR H H 21 8.524 8.524 7.637 0.887 18766
1001 1 11 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.475 -0.242 18766
1002 1 11 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.884 -1.693 18766
1003 1 11 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.177 -2.132 18766
1004 1 11 . 1 1 22 22 ASP H H 22 7.968 7.968 8.286 -0.318 18766
1005 1 11 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.119 -0.331 18766
1006 1 11 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.067 -0.646 18766
1007 1 11 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.699 -0.616 18766
1008 1 11 . 1 1 23 23 ALA H H 23 7.706 7.706 8.074 -0.368 18766
1009 1 11 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.353 0.088 18766
1010 1 11 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.394 -1.103 18766
1011 1 11 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.763 -1.784 18766
1012 1 11 . 1 1 24 24 TYR H H 24 7.843 7.843 7.747 0.096 18766
1013 1 11 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.758 -0.190 18766
1014 1 11 . 1 1 25 25 GLY H H 25 7.747 7.747 7.472 0.275 18766
1015 1 11 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.704 -0.016 18766
1016 1 11 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.433 13.851 18766
1017 1 11 . 1 1 26 26 CYS H H 26 8.091 8.091 8.492 -0.401 18766
1018 1 11 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.341 -0.587 18766
1019 1 11 . 1 1 27 27 GLY H H 27 8.546 8.546 8.325 0.221 18766
1020 1 11 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.436 -0.023 18766
1021 1 11 . 1 1 28 28 ALA CA C 28 59.128 59.128 52.319 6.809 18766
1022 1 11 . 1 1 28 28 ALA CB C 28 18.606 18.606 19.198 -0.592 18766
1023 1 11 . 1 1 28 28 ALA H H 28 8.016 8.016 8.365 -0.349 18766
1024 1 12 . 1 1 2 2 SER HA H 2 4.613 4.613 4.851 -0.238 18766
1025 1 12 . 1 1 2 2 SER CA C 2 57.815 57.815 57.800 0.015 18766
1026 1 12 . 1 1 2 2 SER CB C 2 63.213 63.213 65.079 -1.866 18766
1027 1 12 . 1 1 2 2 SER H H 2 8.641 8.641 8.288 0.353 18766
1028 1 12 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.361 -0.116 18766
1029 1 12 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.638 -0.526 18766
1030 1 12 . 1 1 3 3 ILE CB C 3 38.386 38.386 38.237 0.149 18766
1031 1 12 . 1 1 3 3 ILE H H 3 8.297 8.297 8.310 -0.013 18766
1032 1 12 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.755 0.151 18766
1033 1 12 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.705 -0.914 18766
1034 1 12 . 1 1 4 4 ASP CB C 4 39.326 39.326 41.058 -1.732 18766
1035 1 12 . 1 1 4 4 ASP H H 4 8.392 8.392 8.398 -0.006 18766
1036 1 12 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.634 0.061 18766
1037 1 12 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.076 -0.968 18766
1038 1 12 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.468 0.012 18766
1039 1 12 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.740 -0.404 18766
1040 1 12 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.484 -0.827 18766
1041 1 12 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.506 0.199 18766
1042 1 12 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.572 11.515 18766
1043 1 12 . 1 1 7 7 CYS H H 7 8.431 8.431 8.641 -0.210 18766
1044 1 12 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.086 0.146 18766
1045 1 12 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.296 -0.914 18766
1046 1 12 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.422 0.223 18766
1047 1 12 . 1 1 8 8 ARG H H 8 8.371 8.371 8.467 -0.096 18766
1048 1 12 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.322 0.089 18766
1049 1 12 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.445 -7.695 18766
1050 1 12 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.643 0.025 18766
1051 1 12 . 1 1 9 9 PHE H H 9 8.304 8.304 8.424 -0.120 18766
1052 1 12 . 1 1 10 10 CYS HA H 10 3.756 3.756 4.004 -0.248 18766
1053 1 12 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.794 -0.735 18766
1054 1 12 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.599 16.766 18766
1055 1 12 . 1 1 10 10 CYS H H 10 8.564 8.564 8.708 -0.144 18766
1056 1 12 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.109 -0.009 18766
1057 1 12 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.728 0.131 18766
1058 1 12 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.436 -1.805 18766
1059 1 12 . 1 1 11 11 TYR H H 11 8.239 8.239 8.190 0.049 18766
1060 1 12 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.819 0.214 18766
1061 1 12 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.789 -1.175 18766
1062 1 12 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.028 -1.316 18766
1063 1 12 . 1 1 12 12 HIS H H 12 9.283 9.283 8.290 0.993 18766
1064 1 12 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.270 0.516 18766
1065 1 12 . 1 1 13 13 ARG CA C 13 55.281 55.281 56.983 -1.702 18766
1066 1 12 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.515 -0.413 18766
1067 1 12 . 1 1 13 13 ARG H H 13 8.941 8.941 8.788 0.153 18766
1068 1 12 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.819 0.042 18766
1069 1 12 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.191 -1.778 18766
1070 1 12 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.673 -0.850 18766
1071 1 12 . 1 1 14 14 ASP H H 14 8.831 8.831 8.219 0.612 18766
1072 1 12 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.569 -0.548 18766
1073 1 12 . 1 1 15 15 GLY H H 15 8.668 8.668 8.795 -0.127 18766
1074 1 12 . 1 1 16 16 SER HA H 16 4.614 4.614 4.466 0.148 18766
1075 1 12 . 1 1 16 16 SER CA C 16 57.346 57.346 58.480 -1.134 18766
1076 1 12 . 1 1 16 16 SER CB C 16 63.633 63.633 64.230 -0.597 18766
1077 1 12 . 1 1 16 16 SER H H 16 8.231 8.231 8.222 0.009 18766
1078 1 12 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.836 -0.270 18766
1079 1 12 . 1 1 17 17 GLY H H 17 8.096 8.096 7.950 0.146 18766
1080 1 12 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.076 -0.223 18766
1081 1 12 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.280 -0.534 18766
1082 1 12 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.785 -3.495 18766
1083 1 12 . 1 1 18 18 ASN H H 18 8.317 8.317 8.701 -0.384 18766
1084 1 12 . 1 1 19 19 CYS HA H 19 4.819 4.819 4.601 0.218 18766
1085 1 12 . 1 1 19 19 CYS CB C 19 40.248 40.248 25.863 14.385 18766
1086 1 12 . 1 1 19 19 CYS H H 19 8.872 8.872 9.055 -0.183 18766
1087 1 12 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.131 0.563 18766
1088 1 12 . 1 1 20 20 VAL CB C 20 34.426 34.426 34.978 -0.552 18766
1089 1 12 . 1 1 20 20 VAL H H 20 9.428 9.428 8.529 0.899 18766
1090 1 12 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.727 -0.390 18766
1091 1 12 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.057 -0.209 18766
1092 1 12 . 1 1 21 21 TYR CB C 21 38.105 38.105 37.879 0.226 18766
1093 1 12 . 1 1 21 21 TYR H H 21 8.524 8.524 7.663 0.861 18766
1094 1 12 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.455 -0.222 18766
1095 1 12 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.886 -1.695 18766
1096 1 12 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.214 -2.169 18766
1097 1 12 . 1 1 22 22 ASP H H 22 7.968 7.968 8.279 -0.311 18766
1098 1 12 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.056 -0.268 18766
1099 1 12 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.246 -0.825 18766
1100 1 12 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.766 -0.683 18766
1101 1 12 . 1 1 23 23 ALA H H 23 7.706 7.706 8.287 -0.581 18766
1102 1 12 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.471 -0.030 18766
1103 1 12 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.595 -1.304 18766
1104 1 12 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.522 -1.543 18766
1105 1 12 . 1 1 24 24 TYR H H 24 7.843 7.843 8.078 -0.235 18766
1106 1 12 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.769 -0.201 18766
1107 1 12 . 1 1 25 25 GLY H H 25 7.747 7.747 7.425 0.322 18766
1108 1 12 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.713 -0.025 18766
1109 1 12 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.530 13.754 18766
1110 1 12 . 1 1 26 26 CYS H H 26 8.091 8.091 8.496 -0.405 18766
1111 1 12 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.374 -0.620 18766
1112 1 12 . 1 1 27 27 GLY H H 27 8.546 8.546 8.168 0.378 18766
1113 1 12 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.424 -0.011 18766
1114 1 12 . 1 1 28 28 ALA CA C 28 59.128 59.128 52.088 7.040 18766
1115 1 12 . 1 1 28 28 ALA CB C 28 18.606 18.606 18.675 -0.069 18766
1116 1 12 . 1 1 28 28 ALA H H 28 8.016 8.016 8.299 -0.283 18766
1117 1 13 . 1 1 2 2 SER HA H 2 4.613 4.613 4.899 -0.286 18766
1118 1 13 . 1 1 2 2 SER CA C 2 57.815 57.815 57.814 0.001 18766
1119 1 13 . 1 1 2 2 SER CB C 2 63.213 63.213 64.783 -1.570 18766
1120 1 13 . 1 1 2 2 SER H H 2 8.641 8.641 8.372 0.269 18766
1121 1 13 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.353 -0.108 18766
1122 1 13 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.983 -0.871 18766
1123 1 13 . 1 1 3 3 ILE CB C 3 38.386 38.386 39.773 -1.387 18766
1124 1 13 . 1 1 3 3 ILE H H 3 8.297 8.297 8.294 0.003 18766
1125 1 13 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.763 0.143 18766
1126 1 13 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.725 -0.934 18766
1127 1 13 . 1 1 4 4 ASP CB C 4 39.326 39.326 41.028 -1.702 18766
1128 1 13 . 1 1 4 4 ASP H H 4 8.392 8.392 8.432 -0.040 18766
1129 1 13 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.639 0.056 18766
1130 1 13 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.352 -1.244 18766
1131 1 13 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.479 0.001 18766
1132 1 13 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.644 -0.308 18766
1133 1 13 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.592 -0.935 18766
1134 1 13 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.501 0.204 18766
1135 1 13 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.550 11.537 18766
1136 1 13 . 1 1 7 7 CYS H H 7 8.431 8.431 8.645 -0.214 18766
1137 1 13 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.073 0.159 18766
1138 1 13 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.325 -0.943 18766
1139 1 13 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.447 0.199 18766
1140 1 13 . 1 1 8 8 ARG H H 8 8.371 8.371 8.444 -0.073 18766
1141 1 13 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.323 0.088 18766
1142 1 13 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.487 -7.737 18766
1143 1 13 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.705 -0.037 18766
1144 1 13 . 1 1 9 9 PHE H H 9 8.304 8.304 8.396 -0.092 18766
1145 1 13 . 1 1 10 10 CYS HA H 10 3.756 3.756 3.993 -0.237 18766
1146 1 13 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.808 -0.749 18766
1147 1 13 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.601 16.764 18766
1148 1 13 . 1 1 10 10 CYS H H 10 8.564 8.564 8.682 -0.118 18766
1149 1 13 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.107 -0.007 18766
1150 1 13 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.728 0.131 18766
1151 1 13 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.443 -1.812 18766
1152 1 13 . 1 1 11 11 TYR H H 11 8.239 8.239 8.186 0.053 18766
1153 1 13 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.813 0.220 18766
1154 1 13 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.779 -1.165 18766
1155 1 13 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.020 -1.308 18766
1156 1 13 . 1 1 12 12 HIS H H 12 9.283 9.283 8.281 1.002 18766
1157 1 13 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.263 0.523 18766
1158 1 13 . 1 1 13 13 ARG CA C 13 55.281 55.281 56.982 -1.701 18766
1159 1 13 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.512 -0.410 18766
1160 1 13 . 1 1 13 13 ARG H H 13 8.941 8.941 8.781 0.160 18766
1161 1 13 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.801 0.060 18766
1162 1 13 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.172 -1.759 18766
1163 1 13 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.652 -0.829 18766
1164 1 13 . 1 1 14 14 ASP H H 14 8.831 8.831 8.216 0.615 18766
1165 1 13 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.434 -0.414 18766
1166 1 13 . 1 1 15 15 GLY H H 15 8.668 8.668 8.772 -0.104 18766
1167 1 13 . 1 1 16 16 SER HA H 16 4.614 4.614 4.449 0.165 18766
1168 1 13 . 1 1 16 16 SER CA C 16 57.346 57.346 58.337 -0.991 18766
1169 1 13 . 1 1 16 16 SER CB C 16 63.633 63.633 64.163 -0.530 18766
1170 1 13 . 1 1 16 16 SER H H 16 8.231 8.231 8.214 0.017 18766
1171 1 13 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.742 -0.176 18766
1172 1 13 . 1 1 17 17 GLY H H 17 8.096 8.096 7.922 0.174 18766
1173 1 13 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.060 -0.207 18766
1174 1 13 . 1 1 18 18 ASN CA C 18 51.746 51.746 51.968 -0.223 18766
1175 1 13 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.356 -3.066 18766
1176 1 13 . 1 1 18 18 ASN H H 18 8.317 8.317 8.730 -0.413 18766
1177 1 13 . 1 1 19 19 CYS HA H 19 4.819 4.819 4.615 0.204 18766
1178 1 13 . 1 1 19 19 CYS CB C 19 40.248 40.248 25.752 14.496 18766
1179 1 13 . 1 1 19 19 CYS H H 19 8.872 8.872 8.864 0.008 18766
1180 1 13 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.129 0.565 18766
1181 1 13 . 1 1 20 20 VAL CB C 20 34.426 34.426 35.235 -0.809 18766
1182 1 13 . 1 1 20 20 VAL H H 20 9.428 9.428 8.514 0.914 18766
1183 1 13 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.741 -0.404 18766
1184 1 13 . 1 1 21 21 TYR CA C 21 57.848 57.848 57.922 -0.074 18766
1185 1 13 . 1 1 21 21 TYR CB C 21 38.105 38.105 38.089 0.016 18766
1186 1 13 . 1 1 21 21 TYR H H 21 8.524 8.524 7.668 0.856 18766
1187 1 13 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.433 -0.200 18766
1188 1 13 . 1 1 22 22 ASP CA C 22 52.191 52.191 54.046 -1.855 18766
1189 1 13 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.260 -2.215 18766
1190 1 13 . 1 1 22 22 ASP H H 22 7.968 7.968 8.276 -0.308 18766
1191 1 13 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.093 -0.305 18766
1192 1 13 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.333 -0.912 18766
1193 1 13 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.871 -0.788 18766
1194 1 13 . 1 1 23 23 ALA H H 23 7.706 7.706 8.312 -0.606 18766
1195 1 13 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.500 -0.059 18766
1196 1 13 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.051 -0.760 18766
1197 1 13 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.383 -1.403 18766
1198 1 13 . 1 1 24 24 TYR H H 24 7.843 7.843 8.120 -0.277 18766
1199 1 13 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.690 -0.122 18766
1200 1 13 . 1 1 25 25 GLY H H 25 7.747 7.747 7.451 0.296 18766
1201 1 13 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.768 -0.080 18766
1202 1 13 . 1 1 26 26 CYS CB C 26 40.284 40.284 25.985 14.299 18766
1203 1 13 . 1 1 26 26 CYS H H 26 8.091 8.091 8.375 -0.284 18766
1204 1 13 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.440 -0.686 18766
1205 1 13 . 1 1 27 27 GLY H H 27 8.546 8.546 8.350 0.196 18766
1206 1 13 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.464 -0.051 18766
1207 1 13 . 1 1 28 28 ALA CA C 28 59.128 59.128 52.159 6.969 18766
1208 1 13 . 1 1 28 28 ALA CB C 28 18.606 18.606 19.154 -0.548 18766
1209 1 13 . 1 1 28 28 ALA H H 28 8.016 8.016 8.145 -0.129 18766
1210 1 14 . 1 1 2 2 SER HA H 2 4.613 4.613 4.837 -0.224 18766
1211 1 14 . 1 1 2 2 SER CA C 2 57.815 57.815 57.577 0.238 18766
1212 1 14 . 1 1 2 2 SER CB C 2 63.213 63.213 63.987 -0.774 18766
1213 1 14 . 1 1 2 2 SER H H 2 8.641 8.641 8.280 0.361 18766
1214 1 14 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.272 -0.027 18766
1215 1 14 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.439 -0.327 18766
1216 1 14 . 1 1 3 3 ILE CB C 3 38.386 38.386 38.241 0.145 18766
1217 1 14 . 1 1 3 3 ILE H H 3 8.297 8.297 8.310 -0.013 18766
1218 1 14 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.741 0.165 18766
1219 1 14 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.550 -0.759 18766
1220 1 14 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.845 -1.519 18766
1221 1 14 . 1 1 4 4 ASP H H 4 8.392 8.392 8.356 0.036 18766
1222 1 14 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.665 0.030 18766
1223 1 14 . 1 1 5 5 PRO CB C 5 30.108 30.108 30.845 -0.737 18766
1224 1 14 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.471 0.009 18766
1225 1 14 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.669 -0.333 18766
1226 1 14 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.490 -0.833 18766
1227 1 14 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.529 0.176 18766
1228 1 14 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.645 11.443 18766
1229 1 14 . 1 1 7 7 CYS H H 7 8.431 8.431 8.651 -0.220 18766
1230 1 14 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.082 0.150 18766
1231 1 14 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.237 -0.855 18766
1232 1 14 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.427 0.219 18766
1233 1 14 . 1 1 8 8 ARG H H 8 8.371 8.371 8.457 -0.086 18766
1234 1 14 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.327 0.084 18766
1235 1 14 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.215 -7.465 18766
1236 1 14 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.615 0.052 18766
1237 1 14 . 1 1 9 9 PHE H H 9 8.304 8.304 8.416 -0.112 18766
1238 1 14 . 1 1 10 10 CYS HA H 10 3.756 3.756 4.029 -0.273 18766
1239 1 14 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.837 -0.778 18766
1240 1 14 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.603 16.762 18766
1241 1 14 . 1 1 10 10 CYS H H 10 8.564 8.564 8.773 -0.209 18766
1242 1 14 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.108 -0.008 18766
1243 1 14 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.717 0.142 18766
1244 1 14 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.439 -1.808 18766
1245 1 14 . 1 1 11 11 TYR H H 11 8.239 8.239 8.197 0.042 18766
1246 1 14 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.815 0.218 18766
1247 1 14 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.788 -1.174 18766
1248 1 14 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.020 -1.308 18766
1249 1 14 . 1 1 12 12 HIS H H 12 9.283 9.283 8.280 1.003 18766
1250 1 14 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.263 0.523 18766
1251 1 14 . 1 1 13 13 ARG CA C 13 55.281 55.281 56.983 -1.702 18766
1252 1 14 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.515 -0.413 18766
1253 1 14 . 1 1 13 13 ARG H H 13 8.941 8.941 8.782 0.159 18766
1254 1 14 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.801 0.060 18766
1255 1 14 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.156 -1.742 18766
1256 1 14 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.649 -0.826 18766
1257 1 14 . 1 1 14 14 ASP H H 14 8.831 8.831 8.212 0.619 18766
1258 1 14 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.314 -0.293 18766
1259 1 14 . 1 1 15 15 GLY H H 15 8.668 8.668 8.679 -0.011 18766
1260 1 14 . 1 1 16 16 SER HA H 16 4.614 4.614 4.403 0.211 18766
1261 1 14 . 1 1 16 16 SER CA C 16 57.346 57.346 58.708 -1.362 18766
1262 1 14 . 1 1 16 16 SER CB C 16 63.633 63.633 64.521 -0.888 18766
1263 1 14 . 1 1 16 16 SER H H 16 8.231 8.231 8.232 -0.001 18766
1264 1 14 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.822 -0.256 18766
1265 1 14 . 1 1 17 17 GLY H H 17 8.096 8.096 8.080 0.016 18766
1266 1 14 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.056 -0.203 18766
1267 1 14 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.061 -0.315 18766
1268 1 14 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.412 -3.122 18766
1269 1 14 . 1 1 18 18 ASN H H 18 8.317 8.317 8.751 -0.434 18766
1270 1 14 . 1 1 19 19 CYS HA H 19 4.819 4.819 4.610 0.209 18766
1271 1 14 . 1 1 19 19 CYS CB C 19 40.248 40.248 25.746 14.502 18766
1272 1 14 . 1 1 19 19 CYS H H 19 8.872 8.872 8.866 0.006 18766
1273 1 14 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.130 0.564 18766
1274 1 14 . 1 1 20 20 VAL CB C 20 34.426 34.426 35.230 -0.804 18766
1275 1 14 . 1 1 20 20 VAL H H 20 9.428 9.428 8.518 0.910 18766
1276 1 14 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.731 -0.394 18766
1277 1 14 . 1 1 21 21 TYR CA C 21 57.848 57.848 57.909 -0.061 18766
1278 1 14 . 1 1 21 21 TYR CB C 21 38.105 38.105 38.079 0.026 18766
1279 1 14 . 1 1 21 21 TYR H H 21 8.524 8.524 7.665 0.859 18766
1280 1 14 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.430 -0.197 18766
1281 1 14 . 1 1 22 22 ASP CA C 22 52.191 52.191 54.046 -1.855 18766
1282 1 14 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.256 -2.211 18766
1283 1 14 . 1 1 22 22 ASP H H 22 7.968 7.968 8.271 -0.303 18766
1284 1 14 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.090 -0.302 18766
1285 1 14 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.336 -0.915 18766
1286 1 14 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.872 -0.789 18766
1287 1 14 . 1 1 23 23 ALA H H 23 7.706 7.706 8.309 -0.603 18766
1288 1 14 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.501 -0.060 18766
1289 1 14 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.006 -0.715 18766
1290 1 14 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.374 -1.395 18766
1291 1 14 . 1 1 24 24 TYR H H 24 7.843 7.843 8.120 -0.277 18766
1292 1 14 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.692 -0.124 18766
1293 1 14 . 1 1 25 25 GLY H H 25 7.747 7.747 7.452 0.295 18766
1294 1 14 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.777 -0.089 18766
1295 1 14 . 1 1 26 26 CYS CB C 26 40.284 40.284 25.998 14.286 18766
1296 1 14 . 1 1 26 26 CYS H H 26 8.091 8.091 8.374 -0.283 18766
1297 1 14 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.451 -0.697 18766
1298 1 14 . 1 1 27 27 GLY H H 27 8.546 8.546 8.354 0.192 18766
1299 1 14 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.414 -0.001 18766
1300 1 14 . 1 1 28 28 ALA CA C 28 59.128 59.128 51.631 7.497 18766
1301 1 14 . 1 1 28 28 ALA CB C 28 18.606 18.606 18.758 -0.151 18766
1302 1 14 . 1 1 28 28 ALA H H 28 8.016 8.016 8.175 -0.159 18766
1303 1 15 . 1 1 2 2 SER HA H 2 4.613 4.613 4.792 -0.179 18766
1304 1 15 . 1 1 2 2 SER CA C 2 57.815 57.815 57.740 0.075 18766
1305 1 15 . 1 1 2 2 SER CB C 2 63.213 63.213 63.808 -0.595 18766
1306 1 15 . 1 1 2 2 SER H H 2 8.641 8.641 8.205 0.436 18766
1307 1 15 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.411 -0.166 18766
1308 1 15 . 1 1 3 3 ILE CA C 3 60.112 60.112 59.055 1.057 18766
1309 1 15 . 1 1 3 3 ILE CB C 3 38.386 38.386 39.796 -1.410 18766
1310 1 15 . 1 1 3 3 ILE H H 3 8.297 8.297 7.856 0.441 18766
1311 1 15 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.712 0.194 18766
1312 1 15 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.823 -1.032 18766
1313 1 15 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.637 -1.311 18766
1314 1 15 . 1 1 4 4 ASP H H 4 8.392 8.392 8.311 0.081 18766
1315 1 15 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.573 0.122 18766
1316 1 15 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.317 -1.209 18766
1317 1 15 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.501 -0.021 18766
1318 1 15 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.665 -0.329 18766
1319 1 15 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.579 -0.922 18766
1320 1 15 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.531 0.174 18766
1321 1 15 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.674 11.414 18766
1322 1 15 . 1 1 7 7 CYS H H 7 8.431 8.431 8.648 -0.217 18766
1323 1 15 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.090 0.142 18766
1324 1 15 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.279 -0.897 18766
1325 1 15 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.434 0.212 18766
1326 1 15 . 1 1 8 8 ARG H H 8 8.371 8.371 8.459 -0.088 18766
1327 1 15 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.327 0.084 18766
1328 1 15 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.435 -7.685 18766
1329 1 15 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.673 -0.005 18766
1330 1 15 . 1 1 9 9 PHE H H 9 8.304 8.304 8.411 -0.107 18766
1331 1 15 . 1 1 10 10 CYS HA H 10 3.756 3.756 3.995 -0.239 18766
1332 1 15 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.804 -0.745 18766
1333 1 15 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.625 16.740 18766
1334 1 15 . 1 1 10 10 CYS H H 10 8.564 8.564 8.711 -0.147 18766
1335 1 15 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.123 -0.023 18766
1336 1 15 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.716 0.143 18766
1337 1 15 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.402 -1.771 18766
1338 1 15 . 1 1 11 11 TYR H H 11 8.239 8.239 8.144 0.095 18766
1339 1 15 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.737 0.296 18766
1340 1 15 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.761 -1.147 18766
1341 1 15 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.378 -1.666 18766
1342 1 15 . 1 1 12 12 HIS H H 12 9.283 9.283 8.302 0.981 18766
1343 1 15 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.356 0.430 18766
1344 1 15 . 1 1 13 13 ARG CA C 13 55.281 55.281 56.802 -1.521 18766
1345 1 15 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.003 0.099 18766
1346 1 15 . 1 1 13 13 ARG H H 13 8.941 8.941 8.812 0.129 18766
1347 1 15 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.831 0.030 18766
1348 1 15 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.021 -1.608 18766
1349 1 15 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.892 -1.069 18766
1350 1 15 . 1 1 14 14 ASP H H 14 8.831 8.831 8.876 -0.045 18766
1351 1 15 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.244 -0.223 18766
1352 1 15 . 1 1 15 15 GLY H H 15 8.668 8.668 8.709 -0.041 18766
1353 1 15 . 1 1 16 16 SER HA H 16 4.614 4.614 4.349 0.265 18766
1354 1 15 . 1 1 16 16 SER CA C 16 57.346 57.346 58.574 -1.228 18766
1355 1 15 . 1 1 16 16 SER CB C 16 63.633 63.633 64.008 -0.375 18766
1356 1 15 . 1 1 16 16 SER H H 16 8.231 8.231 8.310 -0.079 18766
1357 1 15 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.890 -0.324 18766
1358 1 15 . 1 1 17 17 GLY H H 17 8.096 8.096 7.744 0.352 18766
1359 1 15 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.063 -0.210 18766
1360 1 15 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.324 -0.578 18766
1361 1 15 . 1 1 18 18 ASN CB C 18 39.290 39.290 43.199 -3.909 18766
1362 1 15 . 1 1 18 18 ASN H H 18 8.317 8.317 8.870 -0.553 18766
1363 1 15 . 1 1 19 19 CYS HA H 19 4.819 4.819 4.986 -0.167 18766
1364 1 15 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.579 13.669 18766
1365 1 15 . 1 1 19 19 CYS H H 19 8.872 8.872 8.628 0.244 18766
1366 1 15 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.069 0.625 18766
1367 1 15 . 1 1 20 20 VAL CB C 20 34.426 34.426 34.928 -0.502 18766
1368 1 15 . 1 1 20 20 VAL H H 20 9.428 9.428 8.465 0.963 18766
1369 1 15 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.784 -0.447 18766
1370 1 15 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.129 -0.281 18766
1371 1 15 . 1 1 21 21 TYR CB C 21 38.105 38.105 37.968 0.137 18766
1372 1 15 . 1 1 21 21 TYR H H 21 8.524 8.524 7.623 0.901 18766
1373 1 15 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.475 -0.242 18766
1374 1 15 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.790 -1.599 18766
1375 1 15 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.164 -2.119 18766
1376 1 15 . 1 1 22 22 ASP H H 22 7.968 7.968 8.284 -0.316 18766
1377 1 15 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.120 -0.332 18766
1378 1 15 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.083 -0.662 18766
1379 1 15 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.666 -0.583 18766
1380 1 15 . 1 1 23 23 ALA H H 23 7.706 7.706 8.066 -0.360 18766
1381 1 15 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.360 0.081 18766
1382 1 15 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.387 -1.096 18766
1383 1 15 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.723 -1.744 18766
1384 1 15 . 1 1 24 24 TYR H H 24 7.843 7.843 7.762 0.081 18766
1385 1 15 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.756 -0.188 18766
1386 1 15 . 1 1 25 25 GLY H H 25 7.747 7.747 7.469 0.278 18766
1387 1 15 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.709 -0.021 18766
1388 1 15 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.419 13.865 18766
1389 1 15 . 1 1 26 26 CYS H H 26 8.091 8.091 8.468 -0.377 18766
1390 1 15 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.148 -0.394 18766
1391 1 15 . 1 1 27 27 GLY H H 27 8.546 8.546 8.482 0.064 18766
1392 1 15 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.464 -0.051 18766
1393 1 15 . 1 1 28 28 ALA CA C 28 59.128 59.128 51.898 7.230 18766
1394 1 15 . 1 1 28 28 ALA CB C 28 18.606 18.606 20.088 -1.482 18766
1395 1 15 . 1 1 28 28 ALA H H 28 8.016 8.016 7.705 0.311 18766
1396 1 16 . 1 1 2 2 SER HA H 2 4.613 4.613 4.696 -0.083 18766
1397 1 16 . 1 1 2 2 SER CA C 2 57.815 57.815 57.937 -0.122 18766
1398 1 16 . 1 1 2 2 SER CB C 2 63.213 63.213 62.454 0.759 18766
1399 1 16 . 1 1 2 2 SER H H 2 8.641 8.641 8.453 0.188 18766
1400 1 16 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.324 -0.079 18766
1401 1 16 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.638 -0.526 18766
1402 1 16 . 1 1 3 3 ILE CB C 3 38.386 38.386 39.057 -0.671 18766
1403 1 16 . 1 1 3 3 ILE H H 3 8.297 8.297 7.242 1.055 18766
1404 1 16 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.722 0.184 18766
1405 1 16 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.776 -0.985 18766
1406 1 16 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.413 -1.087 18766
1407 1 16 . 1 1 4 4 ASP H H 4 8.392 8.392 8.497 -0.105 18766
1408 1 16 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.624 0.071 18766
1409 1 16 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.294 -1.186 18766
1410 1 16 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.496 -0.016 18766
1411 1 16 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.638 -0.302 18766
1412 1 16 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.566 -0.909 18766
1413 1 16 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.499 0.206 18766
1414 1 16 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.580 11.507 18766
1415 1 16 . 1 1 7 7 CYS H H 7 8.431 8.431 8.633 -0.202 18766
1416 1 16 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.088 0.144 18766
1417 1 16 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.325 -0.943 18766
1418 1 16 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.412 0.234 18766
1419 1 16 . 1 1 8 8 ARG H H 8 8.371 8.371 8.461 -0.090 18766
1420 1 16 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.325 0.086 18766
1421 1 16 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.368 -7.618 18766
1422 1 16 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.643 0.025 18766
1423 1 16 . 1 1 9 9 PHE H H 9 8.304 8.304 8.423 -0.119 18766
1424 1 16 . 1 1 10 10 CYS HA H 10 3.756 3.756 4.004 -0.248 18766
1425 1 16 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.810 -0.752 18766
1426 1 16 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.637 16.728 18766
1427 1 16 . 1 1 10 10 CYS H H 10 8.564 8.564 8.729 -0.165 18766
1428 1 16 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.117 -0.017 18766
1429 1 16 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.739 0.120 18766
1430 1 16 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.399 -1.768 18766
1431 1 16 . 1 1 11 11 TYR H H 11 8.239 8.239 8.156 0.083 18766
1432 1 16 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.795 0.238 18766
1433 1 16 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.699 -1.085 18766
1434 1 16 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.161 -1.449 18766
1435 1 16 . 1 1 12 12 HIS H H 12 9.283 9.283 8.307 0.976 18766
1436 1 16 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.276 0.510 18766
1437 1 16 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.165 -1.884 18766
1438 1 16 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.549 -0.448 18766
1439 1 16 . 1 1 13 13 ARG H H 13 8.941 8.941 8.792 0.149 18766
1440 1 16 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.812 0.049 18766
1441 1 16 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.200 -1.787 18766
1442 1 16 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.985 -1.162 18766
1443 1 16 . 1 1 14 14 ASP H H 14 8.831 8.831 8.752 0.079 18766
1444 1 16 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.290 -0.269 18766
1445 1 16 . 1 1 15 15 GLY H H 15 8.668 8.668 8.419 0.249 18766
1446 1 16 . 1 1 16 16 SER HA H 16 4.614 4.614 4.376 0.238 18766
1447 1 16 . 1 1 16 16 SER CA C 16 57.346 57.346 58.542 -1.196 18766
1448 1 16 . 1 1 16 16 SER CB C 16 63.633 63.633 64.032 -0.399 18766
1449 1 16 . 1 1 16 16 SER H H 16 8.231 8.231 8.304 -0.073 18766
1450 1 16 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.812 -0.246 18766
1451 1 16 . 1 1 17 17 GLY H H 17 8.096 8.096 7.611 0.485 18766
1452 1 16 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.065 -0.212 18766
1453 1 16 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.230 -0.484 18766
1454 1 16 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.965 -3.675 18766
1455 1 16 . 1 1 18 18 ASN H H 18 8.317 8.317 8.772 -0.455 18766
1456 1 16 . 1 1 19 19 CYS HA H 19 4.819 4.819 4.991 -0.172 18766
1457 1 16 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.462 13.786 18766
1458 1 16 . 1 1 19 19 CYS H H 19 8.872 8.872 8.639 0.233 18766
1459 1 16 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.142 0.552 18766
1460 1 16 . 1 1 20 20 VAL CB C 20 34.426 34.426 35.230 -0.804 18766
1461 1 16 . 1 1 20 20 VAL H H 20 9.428 9.428 8.442 0.986 18766
1462 1 16 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.776 -0.439 18766
1463 1 16 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.038 -0.190 18766
1464 1 16 . 1 1 21 21 TYR CB C 21 38.105 38.105 38.039 0.066 18766
1465 1 16 . 1 1 21 21 TYR H H 21 8.524 8.524 7.636 0.888 18766
1466 1 16 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.444 -0.211 18766
1467 1 16 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.638 -1.447 18766
1468 1 16 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.152 -2.107 18766
1469 1 16 . 1 1 22 22 ASP H H 22 7.968 7.968 8.280 -0.312 18766
1470 1 16 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.143 -0.355 18766
1471 1 16 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.395 -0.974 18766
1472 1 16 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.849 -0.766 18766
1473 1 16 . 1 1 23 23 ALA H H 23 7.706 7.706 8.296 -0.590 18766
1474 1 16 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.519 -0.078 18766
1475 1 16 . 1 1 24 24 TYR CA C 24 57.291 57.291 57.585 -0.294 18766
1476 1 16 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.286 -1.307 18766
1477 1 16 . 1 1 24 24 TYR H H 24 7.843 7.843 8.071 -0.228 18766
1478 1 16 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.839 -0.271 18766
1479 1 16 . 1 1 25 25 GLY H H 25 7.747 7.747 7.482 0.265 18766
1480 1 16 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.738 -0.050 18766
1481 1 16 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.522 13.762 18766
1482 1 16 . 1 1 26 26 CYS H H 26 8.091 8.091 8.447 -0.356 18766
1483 1 16 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.519 -0.765 18766
1484 1 16 . 1 1 27 27 GLY H H 27 8.546 8.546 8.378 0.168 18766
1485 1 16 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.445 -0.032 18766
1486 1 16 . 1 1 28 28 ALA CA C 28 59.128 59.128 52.140 6.988 18766
1487 1 16 . 1 1 28 28 ALA CB C 28 18.606 18.606 19.023 -0.417 18766
1488 1 16 . 1 1 28 28 ALA H H 28 8.016 8.016 8.278 -0.262 18766
1489 1 17 . 1 1 2 2 SER HA H 2 4.613 4.613 4.720 -0.107 18766
1490 1 17 . 1 1 2 2 SER CA C 2 57.815 57.815 58.431 -0.616 18766
1491 1 17 . 1 1 2 2 SER CB C 2 63.213 63.213 63.688 -0.475 18766
1492 1 17 . 1 1 2 2 SER H H 2 8.641 8.641 8.083 0.558 18766
1493 1 17 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.292 -0.047 18766
1494 1 17 . 1 1 3 3 ILE CA C 3 60.112 60.112 61.078 -0.966 18766
1495 1 17 . 1 1 3 3 ILE CB C 3 38.386 38.386 38.877 -0.491 18766
1496 1 17 . 1 1 3 3 ILE H H 3 8.297 8.297 8.176 0.121 18766
1497 1 17 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.759 0.147 18766
1498 1 17 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.471 -0.680 18766
1499 1 17 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.984 -1.658 18766
1500 1 17 . 1 1 4 4 ASP H H 4 8.392 8.392 8.370 0.022 18766
1501 1 17 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.645 0.050 18766
1502 1 17 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.271 -1.163 18766
1503 1 17 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.463 0.017 18766
1504 1 17 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.658 -0.322 18766
1505 1 17 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.693 -1.036 18766
1506 1 17 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.503 0.202 18766
1507 1 17 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.760 11.327 18766
1508 1 17 . 1 1 7 7 CYS H H 7 8.431 8.431 8.589 -0.158 18766
1509 1 17 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.125 0.107 18766
1510 1 17 . 1 1 8 8 ARG CA C 8 55.382 55.382 55.759 -0.377 18766
1511 1 17 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.225 0.421 18766
1512 1 17 . 1 1 8 8 ARG H H 8 8.371 8.371 8.518 -0.147 18766
1513 1 17 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.312 0.099 18766
1514 1 17 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.682 -7.932 18766
1515 1 17 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.760 -0.092 18766
1516 1 17 . 1 1 9 9 PHE H H 9 8.304 8.304 8.437 -0.133 18766
1517 1 17 . 1 1 10 10 CYS HA H 10 3.756 3.756 3.977 -0.221 18766
1518 1 17 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.799 -0.740 18766
1519 1 17 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.657 16.708 18766
1520 1 17 . 1 1 10 10 CYS H H 10 8.564 8.564 8.638 -0.074 18766
1521 1 17 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.139 -0.039 18766
1522 1 17 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.684 0.175 18766
1523 1 17 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.443 -1.812 18766
1524 1 17 . 1 1 11 11 TYR H H 11 8.239 8.239 8.089 0.150 18766
1525 1 17 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.800 0.233 18766
1526 1 17 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.703 -1.089 18766
1527 1 17 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.145 -1.433 18766
1528 1 17 . 1 1 12 12 HIS H H 12 9.283 9.283 8.280 1.003 18766
1529 1 17 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.261 0.525 18766
1530 1 17 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.167 -1.886 18766
1531 1 17 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.562 -0.460 18766
1532 1 17 . 1 1 13 13 ARG H H 13 8.941 8.941 8.783 0.158 18766
1533 1 17 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.826 0.035 18766
1534 1 17 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.242 -1.829 18766
1535 1 17 . 1 1 14 14 ASP CB C 14 40.823 40.823 42.005 -1.182 18766
1536 1 17 . 1 1 14 14 ASP H H 14 8.831 8.831 8.755 0.076 18766
1537 1 17 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.188 -0.167 18766
1538 1 17 . 1 1 15 15 GLY H H 15 8.668 8.668 8.553 0.115 18766
1539 1 17 . 1 1 16 16 SER HA H 16 4.614 4.614 4.388 0.226 18766
1540 1 17 . 1 1 16 16 SER CA C 16 57.346 57.346 59.100 -1.754 18766
1541 1 17 . 1 1 16 16 SER CB C 16 63.633 63.633 64.116 -0.483 18766
1542 1 17 . 1 1 16 16 SER H H 16 8.231 8.231 8.527 -0.296 18766
1543 1 17 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.840 -0.274 18766
1544 1 17 . 1 1 17 17 GLY H H 17 8.096 8.096 7.841 0.255 18766
1545 1 17 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.046 -0.193 18766
1546 1 17 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.213 -0.467 18766
1547 1 17 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.950 -3.660 18766
1548 1 17 . 1 1 18 18 ASN H H 18 8.317 8.317 8.900 -0.583 18766
1549 1 17 . 1 1 19 19 CYS HA H 19 4.819 4.819 4.999 -0.180 18766
1550 1 17 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.697 13.551 18766
1551 1 17 . 1 1 19 19 CYS H H 19 8.872 8.872 8.611 0.261 18766
1552 1 17 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.031 0.663 18766
1553 1 17 . 1 1 20 20 VAL CB C 20 34.426 34.426 34.900 -0.474 18766
1554 1 17 . 1 1 20 20 VAL H H 20 9.428 9.428 8.375 1.053 18766
1555 1 17 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.811 -0.474 18766
1556 1 17 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.035 -0.187 18766
1557 1 17 . 1 1 21 21 TYR CB C 21 38.105 38.105 37.948 0.157 18766
1558 1 17 . 1 1 21 21 TYR H H 21 8.524 8.524 7.646 0.878 18766
1559 1 17 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.439 -0.206 18766
1560 1 17 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.739 -1.548 18766
1561 1 17 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.173 -2.128 18766
1562 1 17 . 1 1 22 22 ASP H H 22 7.968 7.968 8.268 -0.300 18766
1563 1 17 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.092 -0.304 18766
1564 1 17 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.086 -0.665 18766
1565 1 17 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.678 -0.595 18766
1566 1 17 . 1 1 23 23 ALA H H 23 7.706 7.706 8.336 -0.630 18766
1567 1 17 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.505 -0.064 18766
1568 1 17 . 1 1 24 24 TYR CA C 24 57.291 57.291 57.840 -0.549 18766
1569 1 17 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.340 -1.361 18766
1570 1 17 . 1 1 24 24 TYR H H 24 7.843 7.843 8.095 -0.252 18766
1571 1 17 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.833 -0.265 18766
1572 1 17 . 1 1 25 25 GLY H H 25 7.747 7.747 7.488 0.259 18766
1573 1 17 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.704 -0.016 18766
1574 1 17 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.412 13.872 18766
1575 1 17 . 1 1 26 26 CYS H H 26 8.091 8.091 8.465 -0.374 18766
1576 1 17 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.119 -0.365 18766
1577 1 17 . 1 1 27 27 GLY H H 27 8.546 8.546 8.477 0.069 18766
1578 1 17 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.476 -0.063 18766
1579 1 17 . 1 1 28 28 ALA CA C 28 59.128 59.128 51.697 7.431 18766
1580 1 17 . 1 1 28 28 ALA CB C 28 18.606 18.606 20.052 -1.446 18766
1581 1 17 . 1 1 28 28 ALA H H 28 8.016 8.016 7.735 0.281 18766
1582 1 18 . 1 1 2 2 SER HA H 2 4.613 4.613 4.892 -0.279 18766
1583 1 18 . 1 1 2 2 SER CA C 2 57.815 57.815 58.083 -0.268 18766
1584 1 18 . 1 1 2 2 SER CB C 2 63.213 63.213 64.218 -1.004 18766
1585 1 18 . 1 1 2 2 SER H H 2 8.641 8.641 8.372 0.269 18766
1586 1 18 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.390 -0.145 18766
1587 1 18 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.923 -0.811 18766
1588 1 18 . 1 1 3 3 ILE CB C 3 38.386 38.386 38.883 -0.497 18766
1589 1 18 . 1 1 3 3 ILE H H 3 8.297 8.297 7.993 0.304 18766
1590 1 18 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.727 0.179 18766
1591 1 18 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.492 -0.702 18766
1592 1 18 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.763 -1.437 18766
1593 1 18 . 1 1 4 4 ASP H H 4 8.392 8.392 8.393 -0.001 18766
1594 1 18 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.578 0.117 18766
1595 1 18 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.299 -1.191 18766
1596 1 18 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.498 -0.018 18766
1597 1 18 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.648 -0.312 18766
1598 1 18 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.575 -0.918 18766
1599 1 18 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.493 0.212 18766
1600 1 18 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.631 11.456 18766
1601 1 18 . 1 1 7 7 CYS H H 7 8.431 8.431 8.621 -0.190 18766
1602 1 18 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.096 0.136 18766
1603 1 18 . 1 1 8 8 ARG CA C 8 55.382 55.382 55.996 -0.614 18766
1604 1 18 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.226 0.420 18766
1605 1 18 . 1 1 8 8 ARG H H 8 8.371 8.371 8.468 -0.097 18766
1606 1 18 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.339 0.072 18766
1607 1 18 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.422 -7.672 18766
1608 1 18 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.893 -0.225 18766
1609 1 18 . 1 1 9 9 PHE H H 9 8.304 8.304 8.340 -0.036 18766
1610 1 18 . 1 1 10 10 CYS HA H 10 3.756 3.756 3.986 -0.230 18766
1611 1 18 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.800 -0.741 18766
1612 1 18 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.642 16.724 18766
1613 1 18 . 1 1 10 10 CYS H H 10 8.564 8.564 8.666 -0.102 18766
1614 1 18 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.148 -0.048 18766
1615 1 18 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.693 0.166 18766
1616 1 18 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.452 -1.821 18766
1617 1 18 . 1 1 11 11 TYR H H 11 8.239 8.239 8.111 0.129 18766
1618 1 18 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.805 0.228 18766
1619 1 18 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.719 -1.105 18766
1620 1 18 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.145 -1.433 18766
1621 1 18 . 1 1 12 12 HIS H H 12 9.283 9.283 8.288 0.995 18766
1622 1 18 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.277 0.509 18766
1623 1 18 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.178 -1.897 18766
1624 1 18 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.578 -0.476 18766
1625 1 18 . 1 1 13 13 ARG H H 13 8.941 8.941 8.788 0.153 18766
1626 1 18 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.840 0.021 18766
1627 1 18 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.269 -1.856 18766
1628 1 18 . 1 1 14 14 ASP CB C 14 40.823 40.823 42.004 -1.181 18766
1629 1 18 . 1 1 14 14 ASP H H 14 8.831 8.831 8.771 0.060 18766
1630 1 18 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.202 -0.181 18766
1631 1 18 . 1 1 15 15 GLY H H 15 8.668 8.668 8.572 0.096 18766
1632 1 18 . 1 1 16 16 SER HA H 16 4.614 4.614 4.397 0.217 18766
1633 1 18 . 1 1 16 16 SER CA C 16 57.346 57.346 59.149 -1.803 18766
1634 1 18 . 1 1 16 16 SER CB C 16 63.633 63.633 64.133 -0.500 18766
1635 1 18 . 1 1 16 16 SER H H 16 8.231 8.231 8.547 -0.316 18766
1636 1 18 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.828 -0.262 18766
1637 1 18 . 1 1 17 17 GLY H H 17 8.096 8.096 7.840 0.256 18766
1638 1 18 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.043 -0.190 18766
1639 1 18 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.325 -0.579 18766
1640 1 18 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.925 -3.635 18766
1641 1 18 . 1 1 18 18 ASN H H 18 8.317 8.317 8.901 -0.584 18766
1642 1 18 . 1 1 19 19 CYS HA H 19 4.819 4.819 5.016 -0.197 18766
1643 1 18 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.316 13.932 18766
1644 1 18 . 1 1 19 19 CYS H H 19 8.872 8.872 8.616 0.256 18766
1645 1 18 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.075 0.619 18766
1646 1 18 . 1 1 20 20 VAL CB C 20 34.426 34.426 35.331 -0.905 18766
1647 1 18 . 1 1 20 20 VAL H H 20 9.428 9.428 8.234 1.194 18766
1648 1 18 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.825 -0.488 18766
1649 1 18 . 1 1 21 21 TYR CA C 21 57.848 57.848 57.908 -0.060 18766
1650 1 18 . 1 1 21 21 TYR CB C 21 38.105 38.105 38.148 -0.043 18766
1651 1 18 . 1 1 21 21 TYR H H 21 8.524 8.524 7.659 0.865 18766
1652 1 18 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.465 -0.232 18766
1653 1 18 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.785 -1.594 18766
1654 1 18 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.199 -2.154 18766
1655 1 18 . 1 1 22 22 ASP H H 22 7.968 7.968 8.276 -0.308 18766
1656 1 18 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.061 -0.273 18766
1657 1 18 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.037 -0.616 18766
1658 1 18 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.605 -0.522 18766
1659 1 18 . 1 1 23 23 ALA H H 23 7.706 7.706 8.335 -0.629 18766
1660 1 18 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.475 -0.034 18766
1661 1 18 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.561 -1.270 18766
1662 1 18 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.488 -1.509 18766
1663 1 18 . 1 1 24 24 TYR H H 24 7.843 7.843 8.090 -0.247 18766
1664 1 18 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.786 -0.218 18766
1665 1 18 . 1 1 25 25 GLY H H 25 7.747 7.747 7.470 0.277 18766
1666 1 18 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.705 -0.017 18766
1667 1 18 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.515 13.769 18766
1668 1 18 . 1 1 26 26 CYS H H 26 8.091 8.091 8.476 -0.385 18766
1669 1 18 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.221 -0.467 18766
1670 1 18 . 1 1 27 27 GLY H H 27 8.546 8.546 8.118 0.428 18766
1671 1 18 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.442 -0.029 18766
1672 1 18 . 1 1 28 28 ALA CA C 28 59.128 59.128 52.141 6.987 18766
1673 1 18 . 1 1 28 28 ALA CB C 28 18.606 18.606 18.851 -0.245 18766
1674 1 18 . 1 1 28 28 ALA H H 28 8.016 8.016 8.094 -0.078 18766
1675 1 19 . 1 1 2 2 SER HA H 2 4.613 4.613 4.797 -0.184 18766
1676 1 19 . 1 1 2 2 SER CA C 2 57.815 57.815 58.087 -0.272 18766
1677 1 19 . 1 1 2 2 SER CB C 2 63.213 63.213 64.152 -0.939 18766
1678 1 19 . 1 1 2 2 SER H H 2 8.641 8.641 7.988 0.653 18766
1679 1 19 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.429 -0.184 18766
1680 1 19 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.815 -0.703 18766
1681 1 19 . 1 1 3 3 ILE CB C 3 38.386 38.386 38.738 -0.352 18766
1682 1 19 . 1 1 3 3 ILE H H 3 8.297 8.297 8.239 0.058 18766
1683 1 19 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.797 0.109 18766
1684 1 19 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.607 -0.816 18766
1685 1 19 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.819 -1.493 18766
1686 1 19 . 1 1 4 4 ASP H H 4 8.392 8.392 8.379 0.013 18766
1687 1 19 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.587 0.108 18766
1688 1 19 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.346 -1.238 18766
1689 1 19 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.496 -0.016 18766
1690 1 19 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.592 -0.256 18766
1691 1 19 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.615 -0.958 18766
1692 1 19 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.479 0.226 18766
1693 1 19 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.509 11.578 18766
1694 1 19 . 1 1 7 7 CYS H H 7 8.431 8.431 8.634 -0.203 18766
1695 1 19 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.073 0.159 18766
1696 1 19 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.329 -0.947 18766
1697 1 19 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.428 0.218 18766
1698 1 19 . 1 1 8 8 ARG H H 8 8.371 8.371 8.438 -0.067 18766
1699 1 19 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.331 0.080 18766
1700 1 19 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.317 -7.567 18766
1701 1 19 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.685 -0.017 18766
1702 1 19 . 1 1 9 9 PHE H H 9 8.304 8.304 8.393 -0.089 18766
1703 1 19 . 1 1 10 10 CYS HA H 10 3.756 3.756 4.004 -0.248 18766
1704 1 19 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.830 -0.770 18766
1705 1 19 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.620 16.745 18766
1706 1 19 . 1 1 10 10 CYS H H 10 8.564 8.564 8.741 -0.177 18766
1707 1 19 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.128 -0.028 18766
1708 1 19 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.756 0.103 18766
1709 1 19 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.412 -1.781 18766
1710 1 19 . 1 1 11 11 TYR H H 11 8.239 8.239 8.140 0.099 18766
1711 1 19 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.809 0.224 18766
1712 1 19 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.723 -1.109 18766
1713 1 19 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.128 -1.416 18766
1714 1 19 . 1 1 12 12 HIS H H 12 9.283 9.283 8.303 0.980 18766
1715 1 19 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.284 0.502 18766
1716 1 19 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.176 -1.895 18766
1717 1 19 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.588 -0.486 18766
1718 1 19 . 1 1 13 13 ARG H H 13 8.941 8.941 8.796 0.145 18766
1719 1 19 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.850 0.011 18766
1720 1 19 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.272 -1.859 18766
1721 1 19 . 1 1 14 14 ASP CB C 14 40.823 40.823 42.014 -1.191 18766
1722 1 19 . 1 1 14 14 ASP H H 14 8.831 8.831 8.776 0.055 18766
1723 1 19 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.049 -0.028 18766
1724 1 19 . 1 1 15 15 GLY H H 15 8.668 8.668 8.602 0.066 18766
1725 1 19 . 1 1 16 16 SER HA H 16 4.614 4.614 4.364 0.250 18766
1726 1 19 . 1 1 16 16 SER CA C 16 57.346 57.346 58.388 -1.042 18766
1727 1 19 . 1 1 16 16 SER CB C 16 63.633 63.633 64.049 -0.416 18766
1728 1 19 . 1 1 16 16 SER H H 16 8.231 8.231 8.308 -0.077 18766
1729 1 19 . 1 1 17 17 GLY CA C 17 44.566 44.566 45.092 -0.526 18766
1730 1 19 . 1 1 17 17 GLY H H 17 8.096 8.096 7.849 0.247 18766
1731 1 19 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.050 -0.197 18766
1732 1 19 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.056 -0.310 18766
1733 1 19 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.834 -3.545 18766
1734 1 19 . 1 1 18 18 ASN H H 18 8.317 8.317 8.802 -0.485 18766
1735 1 19 . 1 1 19 19 CYS HA H 19 4.819 4.819 5.027 -0.208 18766
1736 1 19 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.471 13.777 18766
1737 1 19 . 1 1 19 19 CYS H H 19 8.872 8.872 8.580 0.292 18766
1738 1 19 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.071 0.623 18766
1739 1 19 . 1 1 20 20 VAL CB C 20 34.426 34.426 35.349 -0.923 18766
1740 1 19 . 1 1 20 20 VAL H H 20 9.428 9.428 8.324 1.104 18766
1741 1 19 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.811 -0.474 18766
1742 1 19 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.002 -0.154 18766
1743 1 19 . 1 1 21 21 TYR CB C 21 38.105 38.105 38.189 -0.084 18766
1744 1 19 . 1 1 21 21 TYR H H 21 8.524 8.524 7.649 0.875 18766
1745 1 19 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.482 -0.249 18766
1746 1 19 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.628 -1.437 18766
1747 1 19 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.180 -2.135 18766
1748 1 19 . 1 1 22 22 ASP H H 22 7.968 7.968 8.292 -0.324 18766
1749 1 19 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.087 -0.299 18766
1750 1 19 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.257 -0.836 18766
1751 1 19 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.688 -0.605 18766
1752 1 19 . 1 1 23 23 ALA H H 23 7.706 7.706 8.275 -0.569 18766
1753 1 19 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.465 -0.024 18766
1754 1 19 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.528 -1.236 18766
1755 1 19 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.558 -1.579 18766
1756 1 19 . 1 1 24 24 TYR H H 24 7.843 7.843 8.038 -0.195 18766
1757 1 19 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.646 -0.078 18766
1758 1 19 . 1 1 25 25 GLY H H 25 7.747 7.747 7.477 0.270 18766
1759 1 19 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.813 -0.125 18766
1760 1 19 . 1 1 26 26 CYS CB C 26 40.284 40.284 25.992 14.292 18766
1761 1 19 . 1 1 26 26 CYS H H 26 8.091 8.091 8.279 -0.188 18766
1762 1 19 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.396 -0.642 18766
1763 1 19 . 1 1 27 27 GLY H H 27 8.546 8.546 8.348 0.198 18766
1764 1 19 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.450 -0.037 18766
1765 1 19 . 1 1 28 28 ALA CA C 28 59.128 59.128 51.958 7.170 18766
1766 1 19 . 1 1 28 28 ALA CB C 28 18.606 18.606 19.045 -0.439 18766
1767 1 19 . 1 1 28 28 ALA H H 28 8.016 8.016 8.033 -0.017 18766
1768 1 20 . 1 1 2 2 SER HA H 2 4.613 4.613 4.708 -0.095 18766
1769 1 20 . 1 1 2 2 SER CA C 2 57.815 57.815 58.224 -0.409 18766
1770 1 20 . 1 1 2 2 SER CB C 2 63.213 63.213 63.325 -0.112 18766
1771 1 20 . 1 1 2 2 SER H H 2 8.641 8.641 8.307 0.334 18766
1772 1 20 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.278 -0.033 18766
1773 1 20 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.248 -0.136 18766
1774 1 20 . 1 1 3 3 ILE CB C 3 38.386 38.386 38.984 -0.598 18766
1775 1 20 . 1 1 3 3 ILE H H 3 8.297 8.297 7.427 0.870 18766
1776 1 20 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.778 0.128 18766
1777 1 20 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.463 -0.672 18766
1778 1 20 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.632 -1.306 18766
1779 1 20 . 1 1 4 4 ASP H H 4 8.392 8.392 8.334 0.058 18766
1780 1 20 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.642 0.053 18766
1781 1 20 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.247 -1.139 18766
1782 1 20 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.486 -0.006 18766
1783 1 20 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.668 -0.332 18766
1784 1 20 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.595 -0.938 18766
1785 1 20 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.525 0.180 18766
1786 1 20 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.613 11.474 18766
1787 1 20 . 1 1 7 7 CYS H H 7 8.431 8.431 8.647 -0.216 18766
1788 1 20 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.085 0.147 18766
1789 1 20 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.264 -0.882 18766
1790 1 20 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.423 0.223 18766
1791 1 20 . 1 1 8 8 ARG H H 8 8.371 8.371 8.451 -0.080 18766
1792 1 20 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.333 0.078 18766
1793 1 20 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.126 -7.376 18766
1794 1 20 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.601 0.067 18766
1795 1 20 . 1 1 9 9 PHE H H 9 8.304 8.304 8.411 -0.107 18766
1796 1 20 . 1 1 10 10 CYS HA H 10 3.756 3.756 4.033 -0.277 18766
1797 1 20 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.838 -0.779 18766
1798 1 20 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.633 16.732 18766
1799 1 20 . 1 1 10 10 CYS H H 10 8.564 8.564 8.811 -0.247 18766
1800 1 20 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.127 -0.027 18766
1801 1 20 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.729 0.130 18766
1802 1 20 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.394 -1.763 18766
1803 1 20 . 1 1 11 11 TYR H H 11 8.239 8.239 8.156 0.083 18766
1804 1 20 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.760 0.273 18766
1805 1 20 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.779 -1.165 18766
1806 1 20 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.150 -1.438 18766
1807 1 20 . 1 1 12 12 HIS H H 12 9.283 9.283 8.322 0.961 18766
1808 1 20 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.227 0.559 18766
1809 1 20 . 1 1 13 13 ARG CA C 13 55.281 55.281 56.971 -1.690 18766
1810 1 20 . 1 1 13 13 ARG CB C 13 30.102 30.102 29.925 0.177 18766
1811 1 20 . 1 1 13 13 ARG H H 13 8.941 8.941 8.791 0.150 18766
1812 1 20 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.798 0.063 18766
1813 1 20 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.190 -1.777 18766
1814 1 20 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.830 -1.007 18766
1815 1 20 . 1 1 14 14 ASP H H 14 8.831 8.831 8.063 0.768 18766
1816 1 20 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.436 -0.415 18766
1817 1 20 . 1 1 15 15 GLY H H 15 8.668 8.668 8.525 0.143 18766
1818 1 20 . 1 1 16 16 SER HA H 16 4.614 4.614 4.344 0.270 18766
1819 1 20 . 1 1 16 16 SER CA C 16 57.346 57.346 59.229 -1.883 18766
1820 1 20 . 1 1 16 16 SER CB C 16 63.633 63.633 63.776 -0.143 18766
1821 1 20 . 1 1 16 16 SER H H 16 8.231 8.231 8.077 0.154 18766
1822 1 20 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.789 -0.223 18766
1823 1 20 . 1 1 17 17 GLY H H 17 8.096 8.096 7.816 0.280 18766
1824 1 20 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.051 -0.198 18766
1825 1 20 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.362 -0.616 18766
1826 1 20 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.619 -3.329 18766
1827 1 20 . 1 1 18 18 ASN H H 18 8.317 8.317 9.087 -0.770 18766
1828 1 20 . 1 1 19 19 CYS HA H 19 4.819 4.819 4.717 0.102 18766
1829 1 20 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.408 13.840 18766
1830 1 20 . 1 1 19 19 CYS H H 19 8.872 8.872 8.950 -0.078 18766
1831 1 20 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.067 0.627 18766
1832 1 20 . 1 1 20 20 VAL CB C 20 34.426 34.426 35.078 -0.652 18766
1833 1 20 . 1 1 20 20 VAL H H 20 9.428 9.428 8.260 1.168 18766
1834 1 20 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.776 -0.439 18766
1835 1 20 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.135 -0.286 18766
1836 1 20 . 1 1 21 21 TYR CB C 21 38.105 38.105 37.926 0.179 18766
1837 1 20 . 1 1 21 21 TYR H H 21 8.524 8.524 7.618 0.906 18766
1838 1 20 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.453 -0.220 18766
1839 1 20 . 1 1 22 22 ASP CA C 22 52.191 52.191 54.026 -1.835 18766
1840 1 20 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.241 -2.196 18766
1841 1 20 . 1 1 22 22 ASP H H 22 7.968 7.968 8.273 -0.305 18766
1842 1 20 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.125 -0.337 18766
1843 1 20 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.372 -0.951 18766
1844 1 20 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.856 -0.773 18766
1845 1 20 . 1 1 23 23 ALA H H 23 7.706 7.706 8.343 -0.637 18766
1846 1 20 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.496 -0.055 18766
1847 1 20 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.120 -0.829 18766
1848 1 20 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.404 -1.425 18766
1849 1 20 . 1 1 24 24 TYR H H 24 7.843 7.843 8.107 -0.264 18766
1850 1 20 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.817 -0.249 18766
1851 1 20 . 1 1 25 25 GLY H H 25 7.747 7.747 7.484 0.263 18766
1852 1 20 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.687 0.001 18766
1853 1 20 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.402 13.882 18766
1854 1 20 . 1 1 26 26 CYS H H 26 8.091 8.091 8.531 -0.440 18766
1855 1 20 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.114 -0.359 18766
1856 1 20 . 1 1 27 27 GLY H H 27 8.546 8.546 8.340 0.206 18766
1857 1 20 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.542 -0.129 18766
1858 1 20 . 1 1 28 28 ALA CA C 28 59.128 59.128 51.752 7.376 18766
1859 1 20 . 1 1 28 28 ALA CB C 28 18.606 18.606 19.987 -1.381 18766
1860 1 20 . 1 1 28 28 ALA H H 28 8.016 8.016 7.975 0.041 18766
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 0 0.000 0.000 0.000 18766
2 1 1 "Average Difference" HA 31 0.277 -0.088 0.267 18766
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18766
4 1 1 "Average Difference" CA 22 2.428 0.744 2.366 18766
5 1 1 "Average Difference" CB 23 5.993 -1.559 5.917 18766
6 1 1 "Average Difference" HN 25 0.438 -0.108 0.433 18766
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18766
8 1 2 "Average Difference" HA 31 0.276 -0.068 0.272 18766
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18766
10 1 2 "Average Difference" CA 22 2.407 0.690 2.361 18766
11 1 2 "Average Difference" CB 23 6.022 -1.501 5.963 18766
12 1 2 "Average Difference" HN 25 0.415 -0.125 0.403 18766
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18766
14 1 3 "Average Difference" HA 31 0.270 -0.079 0.263 18766
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18766
16 1 3 "Average Difference" CA 22 2.415 0.699 2.366 18766
17 1 3 "Average Difference" CB 23 5.989 -1.568 5.909 18766
18 1 3 "Average Difference" HN 25 0.426 -0.075 0.428 18766
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18766
20 1 4 "Average Difference" HA 31 0.272 -0.072 0.267 18766
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18766
22 1 4 "Average Difference" CA 22 2.497 0.690 2.456 18766
23 1 4 "Average Difference" CB 23 6.043 -1.477 5.991 18766
24 1 4 "Average Difference" HN 25 0.425 -0.113 0.418 18766
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18766
26 1 5 "Average Difference" HA 31 0.257 -0.054 0.255 18766
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18766
28 1 5 "Average Difference" CA 22 2.430 0.646 2.398 18766
29 1 5 "Average Difference" CB 23 6.052 -1.564 5.978 18766
30 1 5 "Average Difference" HN 25 0.441 -0.107 0.436 18766
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18766
32 1 6 "Average Difference" HA 31 0.275 -0.073 0.269 18766
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18766
34 1 6 "Average Difference" CA 22 2.349 0.665 2.306 18766
35 1 6 "Average Difference" CB 23 5.964 -1.584 5.880 18766
36 1 6 "Average Difference" HN 25 0.435 -0.093 0.434 18766
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18766
38 1 7 "Average Difference" HA 31 0.252 -0.057 0.250 18766
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18766
40 1 7 "Average Difference" CA 22 2.420 0.713 2.367 18766
41 1 7 "Average Difference" CB 23 6.058 -1.592 5.976 18766
42 1 7 "Average Difference" HN 25 0.415 -0.090 0.413 18766
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18766
44 1 8 "Average Difference" HA 31 0.269 -0.079 0.262 18766
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18766
46 1 8 "Average Difference" CA 22 2.349 0.742 2.281 18766
47 1 8 "Average Difference" CB 23 6.000 -1.575 5.920 18766
48 1 8 "Average Difference" HN 25 0.448 -0.092 0.448 18766
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18766
50 1 9 "Average Difference" HA 31 0.287 -0.085 0.278 18766
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18766
52 1 9 "Average Difference" CA 22 2.406 0.713 2.352 18766
53 1 9 "Average Difference" CB 23 5.961 -1.576 5.878 18766
54 1 9 "Average Difference" HN 25 0.425 -0.107 0.420 18766
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18766
56 1 10 "Average Difference" HA 31 0.263 -0.055 0.262 18766
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18766
58 1 10 "Average Difference" CA 22 2.377 0.703 2.325 18766
59 1 10 "Average Difference" CB 23 5.996 -1.593 5.911 18766
60 1 10 "Average Difference" HN 25 0.427 -0.090 0.426 18766
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 18766
62 1 11 "Average Difference" HA 31 0.262 -0.079 0.254 18766
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18766
64 1 11 "Average Difference" CA 22 2.317 0.666 2.272 18766
65 1 11 "Average Difference" CB 23 5.990 -1.648 5.888 18766
66 1 11 "Average Difference" HN 25 0.449 -0.120 0.442 18766
67 1 12 "Average Difference" N 0 0.000 0.000 0.000 18766
68 1 12 "Average Difference" HA 31 0.269 -0.091 0.257 18766
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18766
70 1 12 "Average Difference" CA 22 2.398 0.727 2.339 18766
71 1 12 "Average Difference" CB 23 6.059 -1.659 5.958 18766
72 1 12 "Average Difference" HN 25 0.417 -0.067 0.420 18766
73 1 13 "Average Difference" N 0 0.000 0.000 0.000 18766
74 1 13 "Average Difference" HA 31 0.255 -0.069 0.249 18766
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18766
76 1 13 "Average Difference" CA 22 2.389 0.694 2.339 18766
77 1 13 "Average Difference" CB 23 6.124 -1.596 6.045 18766
78 1 13 "Average Difference" HN 25 0.405 -0.076 0.406 18766
79 1 14 "Average Difference" N 0 0.000 0.000 0.000 18766
80 1 14 "Average Difference" HA 31 0.251 -0.073 0.244 18766
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18766
82 1 14 "Average Difference" CA 22 2.420 0.630 2.392 18766
83 1 14 "Average Difference" CB 23 6.097 -1.733 5.977 18766
84 1 14 "Average Difference" HN 25 0.409 -0.071 0.411 18766
85 1 15 "Average Difference" N 0 0.000 0.000 0.000 18766
86 1 15 "Average Difference" HA 31 0.271 -0.077 0.264 18766
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18766
88 1 15 "Average Difference" CA 22 2.409 0.592 2.390 18766
89 1 15 "Average Difference" CB 23 6.003 -1.542 5.932 18766
90 1 15 "Average Difference" HN 25 0.413 -0.121 0.403 18766
91 1 16 "Average Difference" N 0 0.000 0.000 0.000 18766
92 1 16 "Average Difference" HA 31 0.272 -0.080 0.264 18766
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18766
94 1 16 "Average Difference" CA 22 2.367 0.683 2.319 18766
95 1 16 "Average Difference" CB 23 5.986 -1.683 5.874 18766
96 1 16 "Average Difference" HN 25 0.463 -0.114 0.458 18766
97 1 17 "Average Difference" N 0 0.000 0.000 0.000 18766
98 1 17 "Average Difference" HA 31 0.271 -0.079 0.264 18766
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18766
100 1 17 "Average Difference" CA 22 2.483 0.685 2.442 18766
101 1 17 "Average Difference" CB 23 5.967 -1.569 5.887 18766
102 1 17 "Average Difference" HN 25 0.436 -0.092 0.435 18766
103 1 18 "Average Difference" N 0 0.000 0.000 0.000 18766
104 1 18 "Average Difference" HA 31 0.273 -0.069 0.268 18766
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18766
106 1 18 "Average Difference" CA 22 2.400 0.722 2.343 18766
107 1 18 "Average Difference" CB 23 6.003 -1.591 5.919 18766
108 1 18 "Average Difference" HN 25 0.446 -0.092 0.446 18766
109 1 19 "Average Difference" N 0 0.000 0.000 0.000 18766
110 1 19 "Average Difference" HA 31 0.257 -0.047 0.257 18766
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18766
112 1 19 "Average Difference" CA 22 2.393 0.691 2.344 18766
113 1 19 "Average Difference" CB 23 6.052 -1.609 5.965 18766
114 1 19 "Average Difference" HN 25 0.424 -0.107 0.419 18766
115 1 20 "Average Difference" N 0 0.000 0.000 0.000 18766
116 1 20 "Average Difference" HA 31 0.269 -0.083 0.260 18766
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18766
118 1 20 "Average Difference" CA 22 2.409 0.698 2.360 18766
119 1 20 "Average Difference" CB 23 5.998 -1.668 5.890 18766
120 1 20 "Average Difference" HN 25 0.503 -0.130 0.496 18766
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 18766
_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 SER HA H 2 4.613 4.613 4.785 -0.172 18766
2 1 . 1 1 2 2 SER CA C 2 57.815 57.815 57.909 -0.094 18766
3 1 . 1 1 2 2 SER CB C 2 63.213 63.213 64.038 -0.825 18766
4 1 . 1 1 2 2 SER H H 2 8.641 8.641 8.209 0.432 18766
5 1 . 1 1 3 3 ILE HA H 3 4.245 4.245 4.310 -0.065 18766
6 1 . 1 1 3 3 ILE CA C 3 60.112 60.112 60.669 -0.557 18766
7 1 . 1 1 3 3 ILE CB C 3 38.386 38.386 39.130 -0.744 18766
8 1 . 1 1 3 3 ILE H H 3 8.297 8.297 8.065 0.232 18766
9 1 . 1 1 4 4 ASP HA H 4 4.906 4.906 4.745 0.161 18766
10 1 . 1 1 4 4 ASP CA C 4 51.791 51.791 52.648 -0.858 18766
11 1 . 1 1 4 4 ASP CB C 4 39.326 39.326 40.788 -1.462 18766
12 1 . 1 1 4 4 ASP H H 4 8.392 8.392 8.381 0.010 18766
13 1 . 1 1 5 5 PRO HA H 5 4.695 4.695 4.609 0.086 18766
14 1 . 1 1 5 5 PRO CB C 5 30.108 30.108 31.279 -1.171 18766
15 1 . 1 1 6 6 PRO HA H 6 4.480 4.480 4.488 -0.008 18766
16 1 . 1 1 6 6 PRO CA C 6 62.336 62.336 62.635 -0.299 18766
17 1 . 1 1 6 6 PRO CB C 6 31.657 31.657 32.590 -0.933 18766
18 1 . 1 1 7 7 CYS HA H 7 4.705 4.705 4.498 0.207 18766
19 1 . 1 1 7 7 CYS CB C 7 39.087 39.087 27.571 11.516 18766
20 1 . 1 1 7 7 CYS H H 7 8.431 8.431 8.635 -0.204 18766
21 1 . 1 1 8 8 ARG HA H 8 4.232 4.232 4.083 0.149 18766
22 1 . 1 1 8 8 ARG CA C 8 55.382 55.382 56.272 -0.890 18766
23 1 . 1 1 8 8 ARG CB C 8 30.646 30.646 30.407 0.239 18766
24 1 . 1 1 8 8 ARG H H 8 8.371 8.371 8.454 -0.083 18766
25 1 . 1 1 9 9 PHE HA H 9 4.411 4.411 4.328 0.083 18766
26 1 . 1 1 9 9 PHE CA C 9 51.750 51.750 59.360 -7.610 18766
27 1 . 1 1 9 9 PHE CB C 9 38.668 38.668 38.679 -0.011 18766
28 1 . 1 1 9 9 PHE H H 9 8.304 8.304 8.403 -0.099 18766
29 1 . 1 1 10 10 CYS HA H 10 3.756 3.756 4.005 -0.249 18766
30 1 . 1 1 10 10 CYS CA C 10 59.059 59.059 59.815 -0.756 18766
31 1 . 1 1 10 10 CYS CB C 10 41.365 41.365 24.628 16.737 18766
32 1 . 1 1 10 10 CYS H H 10 8.564 8.564 8.729 -0.165 18766
33 1 . 1 1 11 11 TYR HA H 11 5.100 5.100 5.124 -0.024 18766
34 1 . 1 1 11 11 TYR CA C 11 55.859 55.859 55.734 0.125 18766
35 1 . 1 1 11 11 TYR CB C 11 40.631 40.631 42.416 -1.785 18766
36 1 . 1 1 11 11 TYR H H 11 8.239 8.239 8.149 0.090 18766
37 1 . 1 1 12 12 HIS HA H 12 5.033 5.033 4.796 0.237 18766
38 1 . 1 1 12 12 HIS CA C 12 53.614 53.614 54.733 -1.119 18766
39 1 . 1 1 12 12 HIS CB C 12 30.712 30.712 32.150 -1.438 18766
40 1 . 1 1 12 12 HIS H H 12 9.283 9.283 8.302 0.982 18766
41 1 . 1 1 13 13 ARG HA H 13 4.786 4.786 4.282 0.504 18766
42 1 . 1 1 13 13 ARG CA C 13 55.281 55.281 57.096 -1.815 18766
43 1 . 1 1 13 13 ARG CB C 13 30.102 30.102 30.471 -0.369 18766
44 1 . 1 1 13 13 ARG H H 13 8.941 8.941 8.793 0.148 18766
45 1 . 1 1 14 14 ASP HA H 14 4.861 4.861 4.832 0.029 18766
46 1 . 1 1 14 14 ASP CA C 14 51.413 51.413 53.203 -1.790 18766
47 1 . 1 1 14 14 ASP CB C 14 40.823 40.823 41.885 -1.062 18766
48 1 . 1 1 14 14 ASP H H 14 8.831 8.831 8.669 0.162 18766
49 1 . 1 1 15 15 GLY CA C 15 46.021 46.021 46.240 -0.219 18766
50 1 . 1 1 15 15 GLY H H 15 8.668 8.668 8.596 0.072 18766
51 1 . 1 1 16 16 SER HA H 16 4.614 4.614 4.391 0.223 18766
52 1 . 1 1 16 16 SER CA C 16 57.346 57.346 58.789 -1.443 18766
53 1 . 1 1 16 16 SER CB C 16 63.633 63.633 64.095 -0.462 18766
54 1 . 1 1 16 16 SER H H 16 8.231 8.231 8.374 -0.143 18766
55 1 . 1 1 17 17 GLY CA C 17 44.566 44.566 44.855 -0.289 18766
56 1 . 1 1 17 17 GLY H H 17 8.096 8.096 7.782 0.314 18766
57 1 . 1 1 18 18 ASN HA H 18 4.853 4.853 5.068 -0.215 18766
58 1 . 1 1 18 18 ASN CA C 18 51.746 51.746 52.205 -0.460 18766
59 1 . 1 1 18 18 ASN CB C 18 39.290 39.290 42.836 -3.546 18766
60 1 . 1 1 18 18 ASN H H 18 8.317 8.317 8.836 -0.519 18766
61 1 . 1 1 19 19 CYS HA H 19 4.819 4.819 4.930 -0.111 18766
62 1 . 1 1 19 19 CYS CB C 19 40.248 40.248 26.439 13.809 18766
63 1 . 1 1 19 19 CYS H H 19 8.872 8.872 8.676 0.196 18766
64 1 . 1 1 20 20 VAL HA H 20 4.694 4.694 4.085 0.609 18766
65 1 . 1 1 20 20 VAL CB C 20 34.426 34.426 35.113 -0.687 18766
66 1 . 1 1 20 20 VAL H H 20 9.428 9.428 8.403 1.025 18766
67 1 . 1 1 21 21 TYR HA H 21 3.337 3.337 3.784 -0.447 18766
68 1 . 1 1 21 21 TYR CA C 21 57.848 57.848 58.040 -0.192 18766
69 1 . 1 1 21 21 TYR CB C 21 38.105 38.105 38.035 0.070 18766
70 1 . 1 1 21 21 TYR H H 21 8.524 8.524 7.640 0.884 18766
71 1 . 1 1 22 22 ASP HA H 22 4.233 4.233 4.461 -0.228 18766
72 1 . 1 1 22 22 ASP CA C 22 52.191 52.191 53.827 -1.636 18766
73 1 . 1 1 22 22 ASP CB C 22 38.045 38.045 40.199 -2.154 18766
74 1 . 1 1 22 22 ASP H H 22 7.968 7.968 8.283 -0.315 18766
75 1 . 1 1 23 23 ALA HA H 23 3.788 3.788 4.110 -0.322 18766
76 1 . 1 1 23 23 ALA CA C 23 53.421 53.421 54.228 -0.807 18766
77 1 . 1 1 23 23 ALA CB C 23 18.083 18.083 18.756 -0.673 18766
78 1 . 1 1 23 23 ALA H H 23 7.706 7.706 8.235 -0.529 18766
79 1 . 1 1 24 24 TYR HA H 24 4.441 4.441 4.450 -0.009 18766
80 1 . 1 1 24 24 TYR CA C 24 57.291 57.291 58.206 -0.915 18766
81 1 . 1 1 24 24 TYR CB C 24 36.979 36.979 38.517 -1.538 18766
82 1 . 1 1 24 24 TYR H H 24 7.843 7.843 7.990 -0.147 18766
83 1 . 1 1 25 25 GLY CA C 25 44.568 44.568 44.762 -0.194 18766
84 1 . 1 1 25 25 GLY H H 25 7.747 7.747 7.472 0.275 18766
85 1 . 1 1 26 26 CYS HA H 26 4.688 4.688 4.720 -0.032 18766
86 1 . 1 1 26 26 CYS CB C 26 40.284 40.284 26.346 13.938 18766
87 1 . 1 1 26 26 CYS H H 26 8.091 8.091 8.418 -0.327 18766
88 1 . 1 1 27 27 GLY CA C 27 44.754 44.754 45.267 -0.512 18766
89 1 . 1 1 27 27 GLY H H 27 8.546 8.546 8.290 0.256 18766
90 1 . 1 1 28 28 ALA HA H 28 4.413 4.413 4.471 -0.058 18766
91 1 . 1 1 28 28 ALA CA C 28 59.128 59.128 51.971 7.157 18766
92 1 . 1 1 28 28 ALA CB C 28 18.606 18.606 19.381 -0.775 18766
93 1 . 1 1 28 28 ALA H H 28 8.016 8.016 8.074 -0.058 18766
stop_
save_