data_25948
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25948
_Entry.PDB_ID 2NAV
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 25948
_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 GLY H H 2 8.944 8.944 8.443 0.501 25948
2 1 1 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.335 0.065 25948
3 1 1 . 1 1 3 3 GLU H H 3 8.773 8.773 8.506 0.267 25948
4 1 1 . 1 1 4 4 GLY H H 4 8.650 8.650 8.578 0.072 25948
5 1 1 . 1 1 5 5 THR HA H 5 4.278 4.278 4.225 0.053 25948
6 1 1 . 1 1 5 5 THR H H 5 8.104 8.104 7.625 0.479 25948
7 1 1 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.761 -0.125 25948
8 1 1 . 1 1 6 6 PHE H H 6 8.457 8.457 8.489 -0.032 25948
9 1 1 . 1 1 7 7 THR HA H 7 4.267 4.267 4.432 -0.165 25948
10 1 1 . 1 1 7 7 THR H H 7 8.127 8.127 8.318 -0.191 25948
11 1 1 . 1 1 8 8 SER HA H 8 4.363 4.363 4.187 0.176 25948
12 1 1 . 1 1 8 8 SER H H 8 8.355 8.355 7.570 0.785 25948
13 1 1 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.787 -0.120 25948
14 1 1 . 1 1 9 9 ASP H H 9 8.589 8.589 7.605 0.984 25948
15 1 1 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.188 0.422 25948
16 1 1 . 1 1 10 10 CYS H H 10 8.578 8.578 8.837 -0.259 25948
17 1 1 . 1 1 11 11 SER HA H 11 4.102 4.102 4.106 -0.004 25948
18 1 1 . 1 1 11 11 SER H H 11 8.492 8.492 8.787 -0.295 25948
19 1 1 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.158 -0.053 25948
20 1 1 . 1 1 12 12 LYS H H 12 7.752 7.752 7.789 -0.037 25948
21 1 1 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.171 -0.227 25948
22 1 1 . 1 1 13 13 GLN H H 13 8.230 8.230 8.398 -0.168 25948
23 1 1 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.179 0.335 25948
24 1 1 . 1 1 14 14 CYS H H 14 8.716 8.716 8.480 0.236 25948
25 1 1 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.158 0.116 25948
26 1 1 . 1 1 15 15 GLU H H 15 7.885 7.885 8.279 -0.394 25948
27 1 1 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.261 0.045 25948
28 1 1 . 1 1 16 16 GLU H H 16 7.962 7.962 7.989 -0.027 25948
29 1 1 . 1 1 17 17 GLY H H 17 7.994 7.994 7.797 0.197 25948
30 1 1 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.530 -0.188 25948
31 1 1 . 1 1 18 18 ILE H H 18 7.936 7.936 8.215 -0.279 25948
32 1 1 . 1 1 19 19 GLY H H 19 8.643 8.643 8.587 0.056 25948
33 1 1 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.376 0.114 25948
34 1 1 . 1 1 20 20 HIS H H 20 8.409 8.409 7.939 0.470 25948
35 1 1 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.556 0.517 25948
36 1 1 . 1 1 21 21 LYS H H 21 7.977 7.977 8.433 -0.456 25948
37 1 1 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.312 0.416 25948
38 1 1 . 1 1 22 22 TYR H H 22 8.145 8.145 7.275 0.870 25948
39 1 1 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.249 -0.017 25948
40 1 1 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.877 -0.398 25948
41 1 1 . 1 1 24 24 PHE H H 24 7.487 7.487 6.761 0.726 25948
42 1 1 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.838 -0.009 25948
43 1 1 . 1 1 25 25 CYS H H 25 7.692 7.692 7.519 0.173 25948
44 1 1 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.791 -0.142 25948
45 1 1 . 1 1 26 26 HIS H H 26 8.651 8.651 8.878 -0.227 25948
46 1 1 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.806 -0.112 25948
47 1 1 . 1 1 27 27 CYS H H 27 8.739 8.739 9.019 -0.280 25948
48 1 2 . 1 1 2 2 GLY H H 2 8.944 8.944 8.527 0.417 25948
49 1 2 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.377 0.023 25948
50 1 2 . 1 1 3 3 GLU H H 3 8.773 8.773 8.509 0.264 25948
51 1 2 . 1 1 4 4 GLY H H 4 8.650 8.650 8.583 0.067 25948
52 1 2 . 1 1 5 5 THR HA H 5 4.278 4.278 4.336 -0.058 25948
53 1 2 . 1 1 5 5 THR H H 5 8.104 8.104 8.127 -0.023 25948
54 1 2 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.769 -0.133 25948
55 1 2 . 1 1 6 6 PHE H H 6 8.457 8.457 7.972 0.485 25948
56 1 2 . 1 1 7 7 THR HA H 7 4.267 4.267 4.737 -0.470 25948
57 1 2 . 1 1 7 7 THR H H 7 8.127 8.127 8.467 -0.340 25948
58 1 2 . 1 1 8 8 SER HA H 8 4.363 4.363 4.491 -0.128 25948
59 1 2 . 1 1 8 8 SER H H 8 8.355 8.355 8.182 0.173 25948
60 1 2 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.736 -0.069 25948
61 1 2 . 1 1 9 9 ASP H H 9 8.589 8.589 7.529 1.060 25948
62 1 2 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.194 0.416 25948
63 1 2 . 1 1 10 10 CYS H H 10 8.578 8.578 8.938 -0.360 25948
64 1 2 . 1 1 11 11 SER HA H 11 4.102 4.102 4.172 -0.070 25948
65 1 2 . 1 1 11 11 SER H H 11 8.492 8.492 8.074 0.418 25948
66 1 2 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.012 0.093 25948
67 1 2 . 1 1 12 12 LYS H H 12 7.752 7.752 8.236 -0.484 25948
68 1 2 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.168 -0.224 25948
69 1 2 . 1 1 13 13 GLN H H 13 8.230 8.230 8.350 -0.120 25948
70 1 2 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.213 0.301 25948
71 1 2 . 1 1 14 14 CYS H H 14 8.716 8.716 7.841 0.875 25948
72 1 2 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.024 0.250 25948
73 1 2 . 1 1 15 15 GLU H H 15 7.885 7.885 8.436 -0.551 25948
74 1 2 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.165 0.141 25948
75 1 2 . 1 1 16 16 GLU H H 16 7.962 7.962 8.552 -0.590 25948
76 1 2 . 1 1 17 17 GLY H H 17 7.994 7.994 7.698 0.296 25948
77 1 2 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.225 0.117 25948
78 1 2 . 1 1 18 18 ILE H H 18 7.936 7.936 8.484 -0.548 25948
79 1 2 . 1 1 19 19 GLY H H 19 8.643 8.643 8.571 0.072 25948
80 1 2 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.524 -0.034 25948
81 1 2 . 1 1 20 20 HIS H H 20 8.409 8.409 7.785 0.624 25948
82 1 2 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.707 0.366 25948
83 1 2 . 1 1 21 21 LYS H H 21 7.977 7.977 8.448 -0.471 25948
84 1 2 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.326 0.402 25948
85 1 2 . 1 1 22 22 TYR H H 22 8.145 8.145 7.339 0.806 25948
86 1 2 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.391 -0.159 25948
87 1 2 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.805 -0.326 25948
88 1 2 . 1 1 24 24 PHE H H 24 7.487 7.487 7.058 0.429 25948
89 1 2 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.792 0.037 25948
90 1 2 . 1 1 25 25 CYS H H 25 7.692 7.692 7.350 0.342 25948
91 1 2 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.645 0.004 25948
92 1 2 . 1 1 26 26 HIS H H 26 8.651 8.651 8.782 -0.131 25948
93 1 2 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.666 0.028 25948
94 1 2 . 1 1 27 27 CYS H H 27 8.739 8.739 8.617 0.122 25948
95 1 3 . 1 1 2 2 GLY H H 2 8.944 8.944 8.075 0.869 25948
96 1 3 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.487 -0.087 25948
97 1 3 . 1 1 3 3 GLU H H 3 8.773 8.773 8.378 0.395 25948
98 1 3 . 1 1 4 4 GLY H H 4 8.650 8.650 8.724 -0.074 25948
99 1 3 . 1 1 5 5 THR HA H 5 4.278 4.278 4.037 0.241 25948
100 1 3 . 1 1 5 5 THR H H 5 8.104 8.104 8.061 0.043 25948
101 1 3 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.709 -0.073 25948
102 1 3 . 1 1 6 6 PHE H H 6 8.457 8.457 7.809 0.648 25948
103 1 3 . 1 1 7 7 THR HA H 7 4.267 4.267 3.960 0.307 25948
104 1 3 . 1 1 7 7 THR H H 7 8.127 8.127 8.203 -0.076 25948
105 1 3 . 1 1 8 8 SER HA H 8 4.363 4.363 4.450 -0.087 25948
106 1 3 . 1 1 8 8 SER H H 8 8.355 8.355 7.928 0.427 25948
107 1 3 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.593 0.074 25948
108 1 3 . 1 1 9 9 ASP H H 9 8.589 8.589 7.626 0.963 25948
109 1 3 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.148 0.462 25948
110 1 3 . 1 1 10 10 CYS H H 10 8.578 8.578 8.880 -0.302 25948
111 1 3 . 1 1 11 11 SER HA H 11 4.102 4.102 4.156 -0.054 25948
112 1 3 . 1 1 11 11 SER H H 11 8.492 8.492 9.267 -0.775 25948
113 1 3 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.164 -0.059 25948
114 1 3 . 1 1 12 12 LYS H H 12 7.752 7.752 7.503 0.249 25948
115 1 3 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.203 -0.259 25948
116 1 3 . 1 1 13 13 GLN H H 13 8.230 8.230 7.980 0.250 25948
117 1 3 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.548 -0.034 25948
118 1 3 . 1 1 14 14 CYS H H 14 8.716 8.716 7.812 0.904 25948
119 1 3 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.210 0.064 25948
120 1 3 . 1 1 15 15 GLU H H 15 7.885 7.885 8.078 -0.193 25948
121 1 3 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.350 -0.044 25948
122 1 3 . 1 1 16 16 GLU H H 16 7.962 7.962 8.041 -0.079 25948
123 1 3 . 1 1 17 17 GLY H H 17 7.994 7.994 7.737 0.257 25948
124 1 3 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.419 -0.077 25948
125 1 3 . 1 1 18 18 ILE H H 18 7.936 7.936 8.572 -0.636 25948
126 1 3 . 1 1 19 19 GLY H H 19 8.643 8.643 8.681 -0.038 25948
127 1 3 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.500 -0.010 25948
128 1 3 . 1 1 20 20 HIS H H 20 8.409 8.409 7.628 0.781 25948
129 1 3 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.684 0.389 25948
130 1 3 . 1 1 21 21 LYS H H 21 7.977 7.977 8.403 -0.426 25948
131 1 3 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.236 0.492 25948
132 1 3 . 1 1 22 22 TYR H H 22 8.145 8.145 7.510 0.635 25948
133 1 3 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.147 0.085 25948
134 1 3 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.764 -0.285 25948
135 1 3 . 1 1 24 24 PHE H H 24 7.487 7.487 6.672 0.815 25948
136 1 3 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.786 0.043 25948
137 1 3 . 1 1 25 25 CYS H H 25 7.692 7.692 7.384 0.308 25948
138 1 3 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.840 -0.191 25948
139 1 3 . 1 1 26 26 HIS H H 26 8.651 8.651 8.242 0.409 25948
140 1 3 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.685 0.009 25948
141 1 3 . 1 1 27 27 CYS H H 27 8.739 8.739 8.909 -0.170 25948
142 1 4 . 1 1 2 2 GLY H H 2 8.944 8.944 8.561 0.383 25948
143 1 4 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.608 -0.208 25948
144 1 4 . 1 1 3 3 GLU H H 3 8.773 8.773 8.014 0.759 25948
145 1 4 . 1 1 4 4 GLY H H 4 8.650 8.650 8.421 0.229 25948
146 1 4 . 1 1 5 5 THR HA H 5 4.278 4.278 4.302 -0.024 25948
147 1 4 . 1 1 5 5 THR H H 5 8.104 8.104 8.082 0.022 25948
148 1 4 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.670 -0.034 25948
149 1 4 . 1 1 6 6 PHE H H 6 8.457 8.457 7.950 0.507 25948
150 1 4 . 1 1 7 7 THR HA H 7 4.267 4.267 4.503 -0.236 25948
151 1 4 . 1 1 7 7 THR H H 7 8.127 8.127 8.238 -0.111 25948
152 1 4 . 1 1 8 8 SER HA H 8 4.363 4.363 4.289 0.074 25948
153 1 4 . 1 1 8 8 SER H H 8 8.355 8.355 7.034 1.321 25948
154 1 4 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.865 -0.198 25948
155 1 4 . 1 1 9 9 ASP H H 9 8.589 8.589 7.826 0.763 25948
156 1 4 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.440 0.170 25948
157 1 4 . 1 1 10 10 CYS H H 10 8.578 8.578 8.909 -0.331 25948
158 1 4 . 1 1 11 11 SER HA H 11 4.102 4.102 4.266 -0.164 25948
159 1 4 . 1 1 11 11 SER H H 11 8.492 8.492 8.742 -0.250 25948
160 1 4 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.130 -0.025 25948
161 1 4 . 1 1 12 12 LYS H H 12 7.752 7.752 7.709 0.043 25948
162 1 4 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.036 -0.092 25948
163 1 4 . 1 1 13 13 GLN H H 13 8.230 8.230 8.020 0.210 25948
164 1 4 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.391 0.123 25948
165 1 4 . 1 1 14 14 CYS H H 14 8.716 8.716 8.287 0.429 25948
166 1 4 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.108 0.166 25948
167 1 4 . 1 1 15 15 GLU H H 15 7.885 7.885 7.903 -0.018 25948
168 1 4 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.315 -0.009 25948
169 1 4 . 1 1 16 16 GLU H H 16 7.962 7.962 8.270 -0.308 25948
170 1 4 . 1 1 17 17 GLY H H 17 7.994 7.994 7.698 0.296 25948
171 1 4 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.389 -0.047 25948
172 1 4 . 1 1 18 18 ILE H H 18 7.936 7.936 8.618 -0.682 25948
173 1 4 . 1 1 19 19 GLY H H 19 8.643 8.643 8.678 -0.035 25948
174 1 4 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.323 0.167 25948
175 1 4 . 1 1 20 20 HIS H H 20 8.409 8.409 7.917 0.492 25948
176 1 4 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.594 0.479 25948
177 1 4 . 1 1 21 21 LYS H H 21 7.977 7.977 8.435 -0.458 25948
178 1 4 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.391 0.337 25948
179 1 4 . 1 1 22 22 TYR H H 22 8.145 8.145 7.250 0.895 25948
180 1 4 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.169 0.063 25948
181 1 4 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.833 -0.354 25948
182 1 4 . 1 1 24 24 PHE H H 24 7.487 7.487 6.715 0.772 25948
183 1 4 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.886 -0.057 25948
184 1 4 . 1 1 25 25 CYS H H 25 7.692 7.692 7.604 0.088 25948
185 1 4 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.759 -0.110 25948
186 1 4 . 1 1 26 26 HIS H H 26 8.651 8.651 9.095 -0.444 25948
187 1 4 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.583 0.111 25948
188 1 4 . 1 1 27 27 CYS H H 27 8.739 8.739 9.081 -0.342 25948
189 1 5 . 1 1 2 2 GLY H H 2 8.944 8.944 8.610 0.334 25948
190 1 5 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.444 -0.044 25948
191 1 5 . 1 1 3 3 GLU H H 3 8.773 8.773 7.843 0.930 25948
192 1 5 . 1 1 4 4 GLY H H 4 8.650 8.650 8.544 0.106 25948
193 1 5 . 1 1 5 5 THR HA H 5 4.278 4.278 4.231 0.047 25948
194 1 5 . 1 1 5 5 THR H H 5 8.104 8.104 8.050 0.054 25948
195 1 5 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.723 -0.087 25948
196 1 5 . 1 1 6 6 PHE H H 6 8.457 8.457 7.858 0.599 25948
197 1 5 . 1 1 7 7 THR HA H 7 4.267 4.267 4.208 0.059 25948
198 1 5 . 1 1 7 7 THR H H 7 8.127 8.127 8.569 -0.442 25948
199 1 5 . 1 1 8 8 SER HA H 8 4.363 4.363 4.146 0.217 25948
200 1 5 . 1 1 8 8 SER H H 8 8.355 8.355 7.350 1.005 25948
201 1 5 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.823 -0.156 25948
202 1 5 . 1 1 9 9 ASP H H 9 8.589 8.589 7.238 1.351 25948
203 1 5 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.328 0.282 25948
204 1 5 . 1 1 10 10 CYS H H 10 8.578 8.578 8.922 -0.344 25948
205 1 5 . 1 1 11 11 SER HA H 11 4.102 4.102 4.231 -0.129 25948
206 1 5 . 1 1 11 11 SER H H 11 8.492 8.492 8.835 -0.343 25948
207 1 5 . 1 1 12 12 LYS HA H 12 4.105 4.105 3.957 0.148 25948
208 1 5 . 1 1 12 12 LYS H H 12 7.752 7.752 7.501 0.251 25948
209 1 5 . 1 1 13 13 GLN HA H 13 3.944 3.944 3.990 -0.046 25948
210 1 5 . 1 1 13 13 GLN H H 13 8.230 8.230 7.959 0.271 25948
211 1 5 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.224 0.290 25948
212 1 5 . 1 1 14 14 CYS H H 14 8.716 8.716 7.952 0.764 25948
213 1 5 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.063 0.211 25948
214 1 5 . 1 1 15 15 GLU H H 15 7.885 7.885 7.989 -0.104 25948
215 1 5 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.246 0.060 25948
216 1 5 . 1 1 16 16 GLU H H 16 7.962 7.962 8.325 -0.363 25948
217 1 5 . 1 1 17 17 GLY H H 17 7.994 7.994 7.683 0.311 25948
218 1 5 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.328 0.014 25948
219 1 5 . 1 1 18 18 ILE H H 18 7.936 7.936 8.325 -0.389 25948
220 1 5 . 1 1 19 19 GLY H H 19 8.643 8.643 8.450 0.193 25948
221 1 5 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.299 0.191 25948
222 1 5 . 1 1 20 20 HIS H H 20 8.409 8.409 8.070 0.339 25948
223 1 5 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.537 0.536 25948
224 1 5 . 1 1 21 21 LYS H H 21 7.977 7.977 8.441 -0.464 25948
225 1 5 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.505 0.223 25948
226 1 5 . 1 1 22 22 TYR H H 22 8.145 8.145 7.208 0.937 25948
227 1 5 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.264 -0.032 25948
228 1 5 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.927 -0.448 25948
229 1 5 . 1 1 24 24 PHE H H 24 7.487 7.487 6.651 0.836 25948
230 1 5 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.829 -0.000 25948
231 1 5 . 1 1 25 25 CYS H H 25 7.692 7.692 7.630 0.062 25948
232 1 5 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.799 -0.150 25948
233 1 5 . 1 1 26 26 HIS H H 26 8.651 8.651 8.684 -0.033 25948
234 1 5 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.715 -0.022 25948
235 1 5 . 1 1 27 27 CYS H H 27 8.739 8.739 8.833 -0.094 25948
236 1 6 . 1 1 2 2 GLY H H 2 8.944 8.944 8.678 0.266 25948
237 1 6 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.180 0.220 25948
238 1 6 . 1 1 3 3 GLU H H 3 8.773 8.773 8.229 0.544 25948
239 1 6 . 1 1 4 4 GLY H H 4 8.650 8.650 8.861 -0.211 25948
240 1 6 . 1 1 5 5 THR HA H 5 4.278 4.278 4.187 0.091 25948
241 1 6 . 1 1 5 5 THR H H 5 8.104 8.104 7.753 0.351 25948
242 1 6 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.732 -0.096 25948
243 1 6 . 1 1 6 6 PHE H H 6 8.457 8.457 8.300 0.157 25948
244 1 6 . 1 1 7 7 THR HA H 7 4.267 4.267 4.282 -0.015 25948
245 1 6 . 1 1 7 7 THR H H 7 8.127 8.127 8.260 -0.133 25948
246 1 6 . 1 1 8 8 SER HA H 8 4.363 4.363 4.408 -0.045 25948
247 1 6 . 1 1 8 8 SER H H 8 8.355 8.355 7.778 0.577 25948
248 1 6 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.751 -0.084 25948
249 1 6 . 1 1 9 9 ASP H H 9 8.589 8.589 7.895 0.694 25948
250 1 6 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.363 0.247 25948
251 1 6 . 1 1 10 10 CYS H H 10 8.578 8.578 8.936 -0.358 25948
252 1 6 . 1 1 11 11 SER HA H 11 4.102 4.102 4.110 -0.008 25948
253 1 6 . 1 1 11 11 SER H H 11 8.492 8.492 9.151 -0.659 25948
254 1 6 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.122 -0.017 25948
255 1 6 . 1 1 12 12 LYS H H 12 7.752 7.752 7.692 0.060 25948
256 1 6 . 1 1 13 13 GLN HA H 13 3.944 3.944 3.952 -0.008 25948
257 1 6 . 1 1 13 13 GLN H H 13 8.230 8.230 8.139 0.091 25948
258 1 6 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.228 0.286 25948
259 1 6 . 1 1 14 14 CYS H H 14 8.716 8.716 8.521 0.195 25948
260 1 6 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.178 0.096 25948
261 1 6 . 1 1 15 15 GLU H H 15 7.885 7.885 8.130 -0.245 25948
262 1 6 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.206 0.100 25948
263 1 6 . 1 1 16 16 GLU H H 16 7.962 7.962 8.565 -0.603 25948
264 1 6 . 1 1 17 17 GLY H H 17 7.994 7.994 7.848 0.146 25948
265 1 6 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.115 0.227 25948
266 1 6 . 1 1 18 18 ILE H H 18 7.936 7.936 8.281 -0.345 25948
267 1 6 . 1 1 19 19 GLY H H 19 8.643 8.643 8.506 0.137 25948
268 1 6 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.219 0.271 25948
269 1 6 . 1 1 20 20 HIS H H 20 8.409 8.409 7.798 0.611 25948
270 1 6 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.708 0.365 25948
271 1 6 . 1 1 21 21 LYS H H 21 7.977 7.977 8.504 -0.527 25948
272 1 6 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.384 0.344 25948
273 1 6 . 1 1 22 22 TYR H H 22 8.145 8.145 7.486 0.659 25948
274 1 6 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.062 0.170 25948
275 1 6 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.712 -0.233 25948
276 1 6 . 1 1 24 24 PHE H H 24 7.487 7.487 6.467 1.020 25948
277 1 6 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.803 0.026 25948
278 1 6 . 1 1 25 25 CYS H H 25 7.692 7.692 7.206 0.486 25948
279 1 6 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.731 -0.082 25948
280 1 6 . 1 1 26 26 HIS H H 26 8.651 8.651 8.242 0.409 25948
281 1 6 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.962 -0.268 25948
282 1 6 . 1 1 27 27 CYS H H 27 8.739 8.739 9.141 -0.402 25948
283 1 7 . 1 1 2 2 GLY H H 2 8.944 8.944 8.297 0.647 25948
284 1 7 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.687 -0.287 25948
285 1 7 . 1 1 3 3 GLU H H 3 8.773 8.773 8.632 0.141 25948
286 1 7 . 1 1 4 4 GLY H H 4 8.650 8.650 8.565 0.085 25948
287 1 7 . 1 1 5 5 THR HA H 5 4.278 4.278 4.236 0.042 25948
288 1 7 . 1 1 5 5 THR H H 5 8.104 8.104 7.840 0.264 25948
289 1 7 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.769 -0.133 25948
290 1 7 . 1 1 6 6 PHE H H 6 8.457 8.457 8.110 0.347 25948
291 1 7 . 1 1 7 7 THR HA H 7 4.267 4.267 4.192 0.075 25948
292 1 7 . 1 1 7 7 THR H H 7 8.127 8.127 8.545 -0.418 25948
293 1 7 . 1 1 8 8 SER HA H 8 4.363 4.363 4.312 0.051 25948
294 1 7 . 1 1 8 8 SER H H 8 8.355 8.355 7.174 1.181 25948
295 1 7 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.904 -0.237 25948
296 1 7 . 1 1 9 9 ASP H H 9 8.589 8.589 7.389 1.200 25948
297 1 7 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.334 0.276 25948
298 1 7 . 1 1 10 10 CYS H H 10 8.578 8.578 8.901 -0.323 25948
299 1 7 . 1 1 11 11 SER HA H 11 4.102 4.102 4.148 -0.046 25948
300 1 7 . 1 1 11 11 SER H H 11 8.492 8.492 8.307 0.185 25948
301 1 7 . 1 1 12 12 LYS HA H 12 4.105 4.105 3.896 0.209 25948
302 1 7 . 1 1 12 12 LYS H H 12 7.752 7.752 8.660 -0.908 25948
303 1 7 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.087 -0.143 25948
304 1 7 . 1 1 13 13 GLN H H 13 8.230 8.230 7.933 0.297 25948
305 1 7 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.476 0.038 25948
306 1 7 . 1 1 14 14 CYS H H 14 8.716 8.716 7.785 0.931 25948
307 1 7 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.164 0.110 25948
308 1 7 . 1 1 15 15 GLU H H 15 7.885 7.885 8.423 -0.538 25948
309 1 7 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.270 0.036 25948
310 1 7 . 1 1 16 16 GLU H H 16 7.962 7.962 8.426 -0.464 25948
311 1 7 . 1 1 17 17 GLY H H 17 7.994 7.994 7.732 0.262 25948
312 1 7 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.388 -0.046 25948
313 1 7 . 1 1 18 18 ILE H H 18 7.936 7.936 9.005 -1.069 25948
314 1 7 . 1 1 19 19 GLY H H 19 8.643 8.643 8.662 -0.019 25948
315 1 7 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.525 -0.035 25948
316 1 7 . 1 1 20 20 HIS H H 20 8.409 8.409 7.727 0.682 25948
317 1 7 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.579 0.494 25948
318 1 7 . 1 1 21 21 LYS H H 21 7.977 7.977 8.628 -0.651 25948
319 1 7 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.295 0.433 25948
320 1 7 . 1 1 22 22 TYR H H 22 8.145 8.145 7.311 0.834 25948
321 1 7 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.240 -0.008 25948
322 1 7 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.834 -0.355 25948
323 1 7 . 1 1 24 24 PHE H H 24 7.487 7.487 6.780 0.707 25948
324 1 7 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.852 -0.023 25948
325 1 7 . 1 1 25 25 CYS H H 25 7.692 7.692 7.387 0.305 25948
326 1 7 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.803 -0.154 25948
327 1 7 . 1 1 26 26 HIS H H 26 8.651 8.651 8.916 -0.265 25948
328 1 7 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.678 0.016 25948
329 1 7 . 1 1 27 27 CYS H H 27 8.739 8.739 8.572 0.167 25948
330 1 8 . 1 1 2 2 GLY H H 2 8.944 8.944 8.414 0.530 25948
331 1 8 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.435 -0.035 25948
332 1 8 . 1 1 3 3 GLU H H 3 8.773 8.773 8.393 0.380 25948
333 1 8 . 1 1 4 4 GLY H H 4 8.650 8.650 8.593 0.057 25948
334 1 8 . 1 1 5 5 THR HA H 5 4.278 4.278 4.602 -0.324 25948
335 1 8 . 1 1 5 5 THR H H 5 8.104 8.104 8.845 -0.741 25948
336 1 8 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.765 -0.129 25948
337 1 8 . 1 1 6 6 PHE H H 6 8.457 8.457 8.401 0.056 25948
338 1 8 . 1 1 7 7 THR HA H 7 4.267 4.267 4.688 -0.421 25948
339 1 8 . 1 1 7 7 THR H H 7 8.127 8.127 8.196 -0.069 25948
340 1 8 . 1 1 8 8 SER HA H 8 4.363 4.363 4.547 -0.184 25948
341 1 8 . 1 1 8 8 SER H H 8 8.355 8.355 7.648 0.707 25948
342 1 8 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.865 -0.198 25948
343 1 8 . 1 1 9 9 ASP H H 9 8.589 8.589 7.830 0.759 25948
344 1 8 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.143 0.467 25948
345 1 8 . 1 1 10 10 CYS H H 10 8.578 8.578 9.062 -0.484 25948
346 1 8 . 1 1 11 11 SER HA H 11 4.102 4.102 4.160 -0.058 25948
347 1 8 . 1 1 11 11 SER H H 11 8.492 8.492 8.113 0.379 25948
348 1 8 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.008 0.097 25948
349 1 8 . 1 1 12 12 LYS H H 12 7.752 7.752 8.144 -0.392 25948
350 1 8 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.087 -0.143 25948
351 1 8 . 1 1 13 13 GLN H H 13 8.230 8.230 8.205 0.025 25948
352 1 8 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.211 0.303 25948
353 1 8 . 1 1 14 14 CYS H H 14 8.716 8.716 8.196 0.520 25948
354 1 8 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.119 0.155 25948
355 1 8 . 1 1 15 15 GLU H H 15 7.885 7.885 8.124 -0.239 25948
356 1 8 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.372 -0.066 25948
357 1 8 . 1 1 16 16 GLU H H 16 7.962 7.962 8.061 -0.099 25948
358 1 8 . 1 1 17 17 GLY H H 17 7.994 7.994 7.269 0.725 25948
359 1 8 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.092 0.250 25948
360 1 8 . 1 1 18 18 ILE H H 18 7.936 7.936 8.563 -0.627 25948
361 1 8 . 1 1 19 19 GLY H H 19 8.643 8.643 8.522 0.121 25948
362 1 8 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.318 0.172 25948
363 1 8 . 1 1 20 20 HIS H H 20 8.409 8.409 7.899 0.510 25948
364 1 8 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.597 0.476 25948
365 1 8 . 1 1 21 21 LYS H H 21 7.977 7.977 8.508 -0.531 25948
366 1 8 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.424 0.304 25948
367 1 8 . 1 1 22 22 TYR H H 22 8.145 8.145 7.275 0.870 25948
368 1 8 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.198 0.034 25948
369 1 8 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.865 -0.386 25948
370 1 8 . 1 1 24 24 PHE H H 24 7.487 7.487 6.569 0.918 25948
371 1 8 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.805 0.024 25948
372 1 8 . 1 1 25 25 CYS H H 25 7.692 7.692 7.418 0.274 25948
373 1 8 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.715 -0.066 25948
374 1 8 . 1 1 26 26 HIS H H 26 8.651 8.651 8.724 -0.073 25948
375 1 8 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.906 -0.212 25948
376 1 8 . 1 1 27 27 CYS H H 27 8.739 8.739 8.875 -0.136 25948
377 1 9 . 1 1 2 2 GLY H H 2 8.944 8.944 8.398 0.546 25948
378 1 9 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.127 0.273 25948
379 1 9 . 1 1 3 3 GLU H H 3 8.773 8.773 8.076 0.697 25948
380 1 9 . 1 1 4 4 GLY H H 4 8.650 8.650 8.624 0.026 25948
381 1 9 . 1 1 5 5 THR HA H 5 4.278 4.278 4.438 -0.160 25948
382 1 9 . 1 1 5 5 THR H H 5 8.104 8.104 8.001 0.103 25948
383 1 9 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.582 0.054 25948
384 1 9 . 1 1 6 6 PHE H H 6 8.457 8.457 8.371 0.086 25948
385 1 9 . 1 1 7 7 THR HA H 7 4.267 4.267 4.488 -0.221 25948
386 1 9 . 1 1 7 7 THR H H 7 8.127 8.127 8.039 0.088 25948
387 1 9 . 1 1 8 8 SER HA H 8 4.363 4.363 4.196 0.167 25948
388 1 9 . 1 1 8 8 SER H H 8 8.355 8.355 7.023 1.332 25948
389 1 9 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.753 -0.086 25948
390 1 9 . 1 1 9 9 ASP H H 9 8.589 8.589 7.992 0.597 25948
391 1 9 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.201 0.409 25948
392 1 9 . 1 1 10 10 CYS H H 10 8.578 8.578 8.944 -0.366 25948
393 1 9 . 1 1 11 11 SER HA H 11 4.102 4.102 4.177 -0.075 25948
394 1 9 . 1 1 11 11 SER H H 11 8.492 8.492 8.652 -0.160 25948
395 1 9 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.072 0.033 25948
396 1 9 . 1 1 12 12 LYS H H 12 7.752 7.752 7.361 0.391 25948
397 1 9 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.101 -0.157 25948
398 1 9 . 1 1 13 13 GLN H H 13 8.230 8.230 7.955 0.275 25948
399 1 9 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.197 0.317 25948
400 1 9 . 1 1 14 14 CYS H H 14 8.716 8.716 8.339 0.377 25948
401 1 9 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.121 0.153 25948
402 1 9 . 1 1 15 15 GLU H H 15 7.885 7.885 8.196 -0.311 25948
403 1 9 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.278 0.028 25948
404 1 9 . 1 1 16 16 GLU H H 16 7.962 7.962 8.146 -0.184 25948
405 1 9 . 1 1 17 17 GLY H H 17 7.994 7.994 7.667 0.327 25948
406 1 9 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.160 0.182 25948
407 1 9 . 1 1 18 18 ILE H H 18 7.936 7.936 8.257 -0.321 25948
408 1 9 . 1 1 19 19 GLY H H 19 8.643 8.643 8.583 0.060 25948
409 1 9 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.270 0.220 25948
410 1 9 . 1 1 20 20 HIS H H 20 8.409 8.409 7.847 0.562 25948
411 1 9 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.603 0.470 25948
412 1 9 . 1 1 21 21 LYS H H 21 7.977 7.977 8.393 -0.416 25948
413 1 9 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.399 0.329 25948
414 1 9 . 1 1 22 22 TYR H H 22 8.145 8.145 7.161 0.984 25948
415 1 9 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.167 0.065 25948
416 1 9 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.688 -0.209 25948
417 1 9 . 1 1 24 24 PHE H H 24 7.487 7.487 6.685 0.802 25948
418 1 9 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.779 0.050 25948
419 1 9 . 1 1 25 25 CYS H H 25 7.692 7.692 7.230 0.462 25948
420 1 9 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.741 -0.092 25948
421 1 9 . 1 1 26 26 HIS H H 26 8.651 8.651 8.468 0.183 25948
422 1 9 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.822 -0.128 25948
423 1 9 . 1 1 27 27 CYS H H 27 8.739 8.739 8.698 0.041 25948
424 1 10 . 1 1 2 2 GLY H H 2 8.944 8.944 8.505 0.439 25948
425 1 10 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.343 0.057 25948
426 1 10 . 1 1 3 3 GLU H H 3 8.773 8.773 8.322 0.451 25948
427 1 10 . 1 1 4 4 GLY H H 4 8.650 8.650 8.408 0.242 25948
428 1 10 . 1 1 5 5 THR HA H 5 4.278 4.278 4.248 0.030 25948
429 1 10 . 1 1 5 5 THR H H 5 8.104 8.104 7.832 0.272 25948
430 1 10 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.636 -0.000 25948
431 1 10 . 1 1 6 6 PHE H H 6 8.457 8.457 7.799 0.658 25948
432 1 10 . 1 1 7 7 THR HA H 7 4.267 4.267 4.410 -0.143 25948
433 1 10 . 1 1 7 7 THR H H 7 8.127 8.127 8.075 0.052 25948
434 1 10 . 1 1 8 8 SER HA H 8 4.363 4.363 4.105 0.258 25948
435 1 10 . 1 1 8 8 SER H H 8 8.355 8.355 7.259 1.096 25948
436 1 10 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.820 -0.153 25948
437 1 10 . 1 1 9 9 ASP H H 9 8.589 8.589 7.819 0.770 25948
438 1 10 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.484 0.126 25948
439 1 10 . 1 1 10 10 CYS H H 10 8.578 8.578 8.973 -0.395 25948
440 1 10 . 1 1 11 11 SER HA H 11 4.102 4.102 4.160 -0.058 25948
441 1 10 . 1 1 11 11 SER H H 11 8.492 8.492 8.795 -0.303 25948
442 1 10 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.063 0.042 25948
443 1 10 . 1 1 12 12 LYS H H 12 7.752 7.752 7.520 0.232 25948
444 1 10 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.105 -0.161 25948
445 1 10 . 1 1 13 13 GLN H H 13 8.230 8.230 7.712 0.518 25948
446 1 10 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.309 0.205 25948
447 1 10 . 1 1 14 14 CYS H H 14 8.716 8.716 8.383 0.333 25948
448 1 10 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.186 0.088 25948
449 1 10 . 1 1 15 15 GLU H H 15 7.885 7.885 7.949 -0.064 25948
450 1 10 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.336 -0.030 25948
451 1 10 . 1 1 16 16 GLU H H 16 7.962 7.962 8.008 -0.046 25948
452 1 10 . 1 1 17 17 GLY H H 17 7.994 7.994 7.691 0.303 25948
453 1 10 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.148 0.194 25948
454 1 10 . 1 1 18 18 ILE H H 18 7.936 7.936 8.441 -0.505 25948
455 1 10 . 1 1 19 19 GLY H H 19 8.643 8.643 8.592 0.051 25948
456 1 10 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.365 0.125 25948
457 1 10 . 1 1 20 20 HIS H H 20 8.409 8.409 7.855 0.554 25948
458 1 10 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.579 0.494 25948
459 1 10 . 1 1 21 21 LYS H H 21 7.977 7.977 8.550 -0.573 25948
460 1 10 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.280 0.448 25948
461 1 10 . 1 1 22 22 TYR H H 22 8.145 8.145 7.155 0.990 25948
462 1 10 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.207 0.025 25948
463 1 10 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.776 -0.297 25948
464 1 10 . 1 1 24 24 PHE H H 24 7.487 7.487 6.766 0.721 25948
465 1 10 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.795 0.034 25948
466 1 10 . 1 1 25 25 CYS H H 25 7.692 7.692 7.281 0.411 25948
467 1 10 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.733 -0.084 25948
468 1 10 . 1 1 26 26 HIS H H 26 8.651 8.651 8.683 -0.032 25948
469 1 10 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.786 -0.092 25948
470 1 10 . 1 1 27 27 CYS H H 27 8.739 8.739 8.761 -0.022 25948
471 1 11 . 1 1 2 2 GLY H H 2 8.944 8.944 8.524 0.420 25948
472 1 11 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.334 0.066 25948
473 1 11 . 1 1 3 3 GLU H H 3 8.773 8.773 8.453 0.320 25948
474 1 11 . 1 1 4 4 GLY H H 4 8.650 8.650 8.062 0.588 25948
475 1 11 . 1 1 5 5 THR HA H 5 4.278 4.278 4.211 0.067 25948
476 1 11 . 1 1 5 5 THR H H 5 8.104 8.104 8.503 -0.399 25948
477 1 11 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.687 -0.051 25948
478 1 11 . 1 1 6 6 PHE H H 6 8.457 8.457 7.712 0.745 25948
479 1 11 . 1 1 7 7 THR HA H 7 4.267 4.267 4.002 0.265 25948
480 1 11 . 1 1 7 7 THR H H 7 8.127 8.127 7.699 0.428 25948
481 1 11 . 1 1 8 8 SER HA H 8 4.363 4.363 4.384 -0.021 25948
482 1 11 . 1 1 8 8 SER H H 8 8.355 8.355 8.162 0.193 25948
483 1 11 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.824 -0.157 25948
484 1 11 . 1 1 9 9 ASP H H 9 8.589 8.589 7.807 0.782 25948
485 1 11 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.141 0.469 25948
486 1 11 . 1 1 10 10 CYS H H 10 8.578 8.578 9.231 -0.653 25948
487 1 11 . 1 1 11 11 SER HA H 11 4.102 4.102 4.237 -0.135 25948
488 1 11 . 1 1 11 11 SER H H 11 8.492 8.492 8.430 0.062 25948
489 1 11 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.010 0.095 25948
490 1 11 . 1 1 12 12 LYS H H 12 7.752 7.752 7.779 -0.027 25948
491 1 11 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.182 -0.238 25948
492 1 11 . 1 1 13 13 GLN H H 13 8.230 8.230 8.497 -0.267 25948
493 1 11 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.454 0.060 25948
494 1 11 . 1 1 14 14 CYS H H 14 8.716 8.716 7.845 0.871 25948
495 1 11 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.163 0.111 25948
496 1 11 . 1 1 15 15 GLU H H 15 7.885 7.885 8.113 -0.228 25948
497 1 11 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.335 -0.029 25948
498 1 11 . 1 1 16 16 GLU H H 16 7.962 7.962 7.775 0.187 25948
499 1 11 . 1 1 17 17 GLY H H 17 7.994 7.994 7.715 0.279 25948
500 1 11 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.218 0.124 25948
501 1 11 . 1 1 18 18 ILE H H 18 7.936 7.936 8.239 -0.303 25948
502 1 11 . 1 1 19 19 GLY H H 19 8.643 8.643 8.627 0.016 25948
503 1 11 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.210 0.280 25948
504 1 11 . 1 1 20 20 HIS H H 20 8.409 8.409 7.935 0.474 25948
505 1 11 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.746 0.327 25948
506 1 11 . 1 1 21 21 LYS H H 21 7.977 7.977 8.283 -0.306 25948
507 1 11 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.233 0.495 25948
508 1 11 . 1 1 22 22 TYR H H 22 8.145 8.145 7.291 0.854 25948
509 1 11 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.102 0.130 25948
510 1 11 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.713 -0.234 25948
511 1 11 . 1 1 24 24 PHE H H 24 7.487 7.487 6.370 1.117 25948
512 1 11 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.765 0.064 25948
513 1 11 . 1 1 25 25 CYS H H 25 7.692 7.692 7.239 0.453 25948
514 1 11 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.674 -0.025 25948
515 1 11 . 1 1 26 26 HIS H H 26 8.651 8.651 8.592 0.059 25948
516 1 11 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.627 0.067 25948
517 1 11 . 1 1 27 27 CYS H H 27 8.739 8.739 8.763 -0.024 25948
518 1 12 . 1 1 2 2 GLY H H 2 8.944 8.944 8.653 0.291 25948
519 1 12 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.392 0.008 25948
520 1 12 . 1 1 3 3 GLU H H 3 8.773 8.773 8.541 0.232 25948
521 1 12 . 1 1 4 4 GLY H H 4 8.650 8.650 7.832 0.818 25948
522 1 12 . 1 1 5 5 THR HA H 5 4.278 4.278 4.192 0.086 25948
523 1 12 . 1 1 5 5 THR H H 5 8.104 8.104 8.063 0.041 25948
524 1 12 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.715 -0.079 25948
525 1 12 . 1 1 6 6 PHE H H 6 8.457 8.457 8.106 0.351 25948
526 1 12 . 1 1 7 7 THR HA H 7 4.267 4.267 4.514 -0.247 25948
527 1 12 . 1 1 7 7 THR H H 7 8.127 8.127 8.303 -0.176 25948
528 1 12 . 1 1 8 8 SER HA H 8 4.363 4.363 4.329 0.034 25948
529 1 12 . 1 1 8 8 SER H H 8 8.355 8.355 7.840 0.515 25948
530 1 12 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.791 -0.124 25948
531 1 12 . 1 1 9 9 ASP H H 9 8.589 8.589 8.092 0.497 25948
532 1 12 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.191 0.419 25948
533 1 12 . 1 1 10 10 CYS H H 10 8.578 8.578 8.619 -0.041 25948
534 1 12 . 1 1 11 11 SER HA H 11 4.102 4.102 4.066 0.036 25948
535 1 12 . 1 1 11 11 SER H H 11 8.492 8.492 8.586 -0.094 25948
536 1 12 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.142 -0.037 25948
537 1 12 . 1 1 12 12 LYS H H 12 7.752 7.752 7.367 0.385 25948
538 1 12 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.090 -0.146 25948
539 1 12 . 1 1 13 13 GLN H H 13 8.230 8.230 7.989 0.241 25948
540 1 12 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.250 0.264 25948
541 1 12 . 1 1 14 14 CYS H H 14 8.716 8.716 7.979 0.737 25948
542 1 12 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.090 0.184 25948
543 1 12 . 1 1 15 15 GLU H H 15 7.885 7.885 7.959 -0.074 25948
544 1 12 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.269 0.037 25948
545 1 12 . 1 1 16 16 GLU H H 16 7.962 7.962 8.304 -0.342 25948
546 1 12 . 1 1 17 17 GLY H H 17 7.994 7.994 7.663 0.331 25948
547 1 12 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.140 0.202 25948
548 1 12 . 1 1 18 18 ILE H H 18 7.936 7.936 8.406 -0.470 25948
549 1 12 . 1 1 19 19 GLY H H 19 8.643 8.643 8.693 -0.050 25948
550 1 12 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.394 0.096 25948
551 1 12 . 1 1 20 20 HIS H H 20 8.409 8.409 8.054 0.355 25948
552 1 12 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.552 0.521 25948
553 1 12 . 1 1 21 21 LYS H H 21 7.977 7.977 8.351 -0.374 25948
554 1 12 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.517 0.211 25948
555 1 12 . 1 1 22 22 TYR H H 22 8.145 8.145 7.218 0.926 25948
556 1 12 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.235 -0.003 25948
557 1 12 . 1 1 24 24 PHE HA H 24 4.479 4.479 5.049 -0.570 25948
558 1 12 . 1 1 24 24 PHE H H 24 7.487 7.487 7.063 0.424 25948
559 1 12 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.752 0.077 25948
560 1 12 . 1 1 25 25 CYS H H 25 7.692 7.692 7.331 0.361 25948
561 1 12 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.835 -0.186 25948
562 1 12 . 1 1 26 26 HIS H H 26 8.651 8.651 7.890 0.761 25948
563 1 12 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.749 -0.055 25948
564 1 12 . 1 1 27 27 CYS H H 27 8.739 8.739 8.899 -0.160 25948
565 1 13 . 1 1 2 2 GLY H H 2 8.944 8.944 8.230 0.714 25948
566 1 13 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.523 -0.123 25948
567 1 13 . 1 1 3 3 GLU H H 3 8.773 8.773 7.962 0.811 25948
568 1 13 . 1 1 4 4 GLY H H 4 8.650 8.650 8.813 -0.163 25948
569 1 13 . 1 1 5 5 THR HA H 5 4.278 4.278 4.264 0.014 25948
570 1 13 . 1 1 5 5 THR H H 5 8.104 8.104 7.771 0.333 25948
571 1 13 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.759 -0.123 25948
572 1 13 . 1 1 6 6 PHE H H 6 8.457 8.457 8.556 -0.099 25948
573 1 13 . 1 1 7 7 THR HA H 7 4.267 4.267 4.393 -0.126 25948
574 1 13 . 1 1 7 7 THR H H 7 8.127 8.127 8.417 -0.290 25948
575 1 13 . 1 1 8 8 SER HA H 8 4.363 4.363 3.904 0.459 25948
576 1 13 . 1 1 8 8 SER H H 8 8.355 8.355 7.361 0.994 25948
577 1 13 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.655 0.012 25948
578 1 13 . 1 1 9 9 ASP H H 9 8.589 8.589 7.465 1.124 25948
579 1 13 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.377 0.233 25948
580 1 13 . 1 1 10 10 CYS H H 10 8.578 8.578 9.006 -0.428 25948
581 1 13 . 1 1 11 11 SER HA H 11 4.102 4.102 4.177 -0.075 25948
582 1 13 . 1 1 11 11 SER H H 11 8.492 8.492 8.742 -0.250 25948
583 1 13 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.053 0.052 25948
584 1 13 . 1 1 12 12 LYS H H 12 7.752 7.752 8.151 -0.399 25948
585 1 13 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.149 -0.205 25948
586 1 13 . 1 1 13 13 GLN H H 13 8.230 8.230 8.480 -0.250 25948
587 1 13 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.320 0.194 25948
588 1 13 . 1 1 14 14 CYS H H 14 8.716 8.716 8.457 0.259 25948
589 1 13 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.150 0.124 25948
590 1 13 . 1 1 15 15 GLU H H 15 7.885 7.885 8.517 -0.632 25948
591 1 13 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.295 0.011 25948
592 1 13 . 1 1 16 16 GLU H H 16 7.962 7.962 8.331 -0.369 25948
593 1 13 . 1 1 17 17 GLY H H 17 7.994 7.994 7.827 0.167 25948
594 1 13 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.314 0.028 25948
595 1 13 . 1 1 18 18 ILE H H 18 7.936 7.936 8.253 -0.317 25948
596 1 13 . 1 1 19 19 GLY H H 19 8.643 8.643 8.681 -0.038 25948
597 1 13 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.471 0.019 25948
598 1 13 . 1 1 20 20 HIS H H 20 8.409 8.409 7.969 0.440 25948
599 1 13 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.629 0.444 25948
600 1 13 . 1 1 21 21 LYS H H 21 7.977 7.977 8.430 -0.452 25948
601 1 13 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.426 0.302 25948
602 1 13 . 1 1 22 22 TYR H H 22 8.145 8.145 7.504 0.641 25948
603 1 13 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.169 0.063 25948
604 1 13 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.712 -0.233 25948
605 1 13 . 1 1 24 24 PHE H H 24 7.487 7.487 6.800 0.687 25948
606 1 13 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.723 0.106 25948
607 1 13 . 1 1 25 25 CYS H H 25 7.692 7.692 7.490 0.202 25948
608 1 13 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.750 -0.101 25948
609 1 13 . 1 1 26 26 HIS H H 26 8.651 8.651 8.698 -0.047 25948
610 1 13 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.684 0.010 25948
611 1 13 . 1 1 27 27 CYS H H 27 8.739 8.739 8.881 -0.142 25948
612 1 14 . 1 1 2 2 GLY H H 2 8.944 8.944 8.484 0.460 25948
613 1 14 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.230 0.170 25948
614 1 14 . 1 1 3 3 GLU H H 3 8.773 8.773 9.105 -0.332 25948
615 1 14 . 1 1 4 4 GLY H H 4 8.650 8.650 8.014 0.636 25948
616 1 14 . 1 1 5 5 THR HA H 5 4.278 4.278 4.189 0.089 25948
617 1 14 . 1 1 5 5 THR H H 5 8.104 8.104 8.544 -0.440 25948
618 1 14 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.765 -0.129 25948
619 1 14 . 1 1 6 6 PHE H H 6 8.457 8.457 7.929 0.528 25948
620 1 14 . 1 1 7 7 THR HA H 7 4.267 4.267 4.049 0.218 25948
621 1 14 . 1 1 7 7 THR H H 7 8.127 8.127 8.248 -0.121 25948
622 1 14 . 1 1 8 8 SER HA H 8 4.363 4.363 4.427 -0.064 25948
623 1 14 . 1 1 8 8 SER H H 8 8.355 8.355 8.236 0.119 25948
624 1 14 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.712 -0.045 25948
625 1 14 . 1 1 9 9 ASP H H 9 8.589 8.589 7.673 0.916 25948
626 1 14 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.214 0.396 25948
627 1 14 . 1 1 10 10 CYS H H 10 8.578 8.578 9.033 -0.455 25948
628 1 14 . 1 1 11 11 SER HA H 11 4.102 4.102 4.241 -0.139 25948
629 1 14 . 1 1 11 11 SER H H 11 8.492 8.492 8.653 -0.161 25948
630 1 14 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.137 -0.032 25948
631 1 14 . 1 1 12 12 LYS H H 12 7.752 7.752 7.539 0.213 25948
632 1 14 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.107 -0.163 25948
633 1 14 . 1 1 13 13 GLN H H 13 8.230 8.230 8.183 0.047 25948
634 1 14 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.392 0.122 25948
635 1 14 . 1 1 14 14 CYS H H 14 8.716 8.716 7.753 0.963 25948
636 1 14 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.170 0.104 25948
637 1 14 . 1 1 15 15 GLU H H 15 7.885 7.885 7.957 -0.072 25948
638 1 14 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.341 -0.035 25948
639 1 14 . 1 1 16 16 GLU H H 16 7.962 7.962 7.706 0.256 25948
640 1 14 . 1 1 17 17 GLY H H 17 7.994 7.994 7.786 0.208 25948
641 1 14 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.335 0.007 25948
642 1 14 . 1 1 18 18 ILE H H 18 7.936 7.936 7.856 0.080 25948
643 1 14 . 1 1 19 19 GLY H H 19 8.643 8.643 8.672 -0.029 25948
644 1 14 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.320 0.170 25948
645 1 14 . 1 1 20 20 HIS H H 20 8.409 8.409 8.139 0.270 25948
646 1 14 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.721 0.352 25948
647 1 14 . 1 1 21 21 LYS H H 21 7.977 7.977 8.159 -0.182 25948
648 1 14 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.353 0.375 25948
649 1 14 . 1 1 22 22 TYR H H 22 8.145 8.145 7.378 0.767 25948
650 1 14 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.402 -0.170 25948
651 1 14 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.741 -0.262 25948
652 1 14 . 1 1 24 24 PHE H H 24 7.487 7.487 7.000 0.487 25948
653 1 14 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.666 0.163 25948
654 1 14 . 1 1 25 25 CYS H H 25 7.692 7.692 7.338 0.354 25948
655 1 14 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.733 -0.084 25948
656 1 14 . 1 1 26 26 HIS H H 26 8.651 8.651 8.553 0.098 25948
657 1 14 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.742 -0.048 25948
658 1 14 . 1 1 27 27 CYS H H 27 8.739 8.739 8.889 -0.150 25948
659 1 15 . 1 1 2 2 GLY H H 2 8.944 8.944 8.404 0.540 25948
660 1 15 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.409 -0.009 25948
661 1 15 . 1 1 3 3 GLU H H 3 8.773 8.773 8.070 0.703 25948
662 1 15 . 1 1 4 4 GLY H H 4 8.650 8.650 8.693 -0.043 25948
663 1 15 . 1 1 5 5 THR HA H 5 4.278 4.278 4.407 -0.129 25948
664 1 15 . 1 1 5 5 THR H H 5 8.104 8.104 7.793 0.311 25948
665 1 15 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.786 -0.150 25948
666 1 15 . 1 1 6 6 PHE H H 6 8.457 8.457 8.908 -0.451 25948
667 1 15 . 1 1 7 7 THR HA H 7 4.267 4.267 4.013 0.254 25948
668 1 15 . 1 1 7 7 THR H H 7 8.127 8.127 7.567 0.560 25948
669 1 15 . 1 1 8 8 SER HA H 8 4.363 4.363 4.287 0.076 25948
670 1 15 . 1 1 8 8 SER H H 8 8.355 8.355 7.887 0.468 25948
671 1 15 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.770 -0.103 25948
672 1 15 . 1 1 9 9 ASP H H 9 8.589 8.589 7.634 0.955 25948
673 1 15 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.695 -0.085 25948
674 1 15 . 1 1 10 10 CYS H H 10 8.578 8.578 8.780 -0.202 25948
675 1 15 . 1 1 11 11 SER HA H 11 4.102 4.102 4.185 -0.083 25948
676 1 15 . 1 1 11 11 SER H H 11 8.492 8.492 8.723 -0.231 25948
677 1 15 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.374 -0.269 25948
678 1 15 . 1 1 12 12 LYS H H 12 7.752 7.752 8.258 -0.506 25948
679 1 15 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.127 -0.183 25948
680 1 15 . 1 1 13 13 GLN H H 13 8.230 8.230 8.605 -0.375 25948
681 1 15 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.333 0.181 25948
682 1 15 . 1 1 14 14 CYS H H 14 8.716 8.716 8.338 0.378 25948
683 1 15 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.072 0.202 25948
684 1 15 . 1 1 15 15 GLU H H 15 7.885 7.885 7.978 -0.093 25948
685 1 15 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.281 0.025 25948
686 1 15 . 1 1 16 16 GLU H H 16 7.962 7.962 8.280 -0.318 25948
687 1 15 . 1 1 17 17 GLY H H 17 7.994 7.994 7.691 0.303 25948
688 1 15 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.266 0.076 25948
689 1 15 . 1 1 18 18 ILE H H 18 7.936 7.936 8.336 -0.400 25948
690 1 15 . 1 1 19 19 GLY H H 19 8.643 8.643 8.794 -0.151 25948
691 1 15 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.369 0.121 25948
692 1 15 . 1 1 20 20 HIS H H 20 8.409 8.409 8.046 0.363 25948
693 1 15 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.623 0.450 25948
694 1 15 . 1 1 21 21 LYS H H 21 7.977 7.977 8.372 -0.395 25948
695 1 15 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.409 0.319 25948
696 1 15 . 1 1 22 22 TYR H H 22 8.145 8.145 7.043 1.102 25948
697 1 15 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.113 0.119 25948
698 1 15 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.842 -0.363 25948
699 1 15 . 1 1 24 24 PHE H H 24 7.487 7.487 6.612 0.875 25948
700 1 15 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.841 -0.012 25948
701 1 15 . 1 1 25 25 CYS H H 25 7.692 7.692 7.674 0.018 25948
702 1 15 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.849 -0.200 25948
703 1 15 . 1 1 26 26 HIS H H 26 8.651 8.651 7.994 0.657 25948
704 1 15 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.623 0.071 25948
705 1 15 . 1 1 27 27 CYS H H 27 8.739 8.739 9.346 -0.607 25948
706 1 16 . 1 1 2 2 GLY H H 2 8.944 8.944 8.109 0.835 25948
707 1 16 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.377 0.023 25948
708 1 16 . 1 1 3 3 GLU H H 3 8.773 8.773 8.396 0.377 25948
709 1 16 . 1 1 4 4 GLY H H 4 8.650 8.650 8.586 0.064 25948
710 1 16 . 1 1 5 5 THR HA H 5 4.278 4.278 4.050 0.228 25948
711 1 16 . 1 1 5 5 THR H H 5 8.104 8.104 8.152 -0.048 25948
712 1 16 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.713 -0.077 25948
713 1 16 . 1 1 6 6 PHE H H 6 8.457 8.457 8.789 -0.332 25948
714 1 16 . 1 1 7 7 THR HA H 7 4.267 4.267 4.078 0.189 25948
715 1 16 . 1 1 7 7 THR H H 7 8.127 8.127 8.113 0.014 25948
716 1 16 . 1 1 8 8 SER HA H 8 4.363 4.363 4.612 -0.249 25948
717 1 16 . 1 1 8 8 SER H H 8 8.355 8.355 7.766 0.589 25948
718 1 16 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.662 0.005 25948
719 1 16 . 1 1 9 9 ASP H H 9 8.589 8.589 7.763 0.826 25948
720 1 16 . 1 1 10 10 CYS HA H 10 4.610 4.610 3.920 0.690 25948
721 1 16 . 1 1 10 10 CYS H H 10 8.578 8.578 8.299 0.279 25948
722 1 16 . 1 1 11 11 SER HA H 11 4.102 4.102 4.171 -0.069 25948
723 1 16 . 1 1 11 11 SER H H 11 8.492 8.492 8.534 -0.042 25948
724 1 16 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.253 -0.147 25948
725 1 16 . 1 1 12 12 LYS H H 12 7.752 7.752 7.378 0.374 25948
726 1 16 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.177 -0.233 25948
727 1 16 . 1 1 13 13 GLN H H 13 8.230 8.230 7.814 0.416 25948
728 1 16 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.225 0.289 25948
729 1 16 . 1 1 14 14 CYS H H 14 8.716 8.716 7.818 0.898 25948
730 1 16 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.078 0.196 25948
731 1 16 . 1 1 15 15 GLU H H 15 7.885 7.885 8.008 -0.123 25948
732 1 16 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.290 0.016 25948
733 1 16 . 1 1 16 16 GLU H H 16 7.962 7.962 8.219 -0.257 25948
734 1 16 . 1 1 17 17 GLY H H 17 7.994 7.994 7.719 0.275 25948
735 1 16 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.242 0.100 25948
736 1 16 . 1 1 18 18 ILE H H 18 7.936 7.936 8.448 -0.512 25948
737 1 16 . 1 1 19 19 GLY H H 19 8.643 8.643 8.572 0.071 25948
738 1 16 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.545 -0.055 25948
739 1 16 . 1 1 20 20 HIS H H 20 8.409 8.409 7.868 0.541 25948
740 1 16 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.680 0.393 25948
741 1 16 . 1 1 21 21 LYS H H 21 7.977 7.977 8.384 -0.407 25948
742 1 16 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.458 0.270 25948
743 1 16 . 1 1 22 22 TYR H H 22 8.145 8.145 7.350 0.795 25948
744 1 16 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.114 0.118 25948
745 1 16 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.692 -0.213 25948
746 1 16 . 1 1 24 24 PHE H H 24 7.487 7.487 6.659 0.828 25948
747 1 16 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.843 -0.014 25948
748 1 16 . 1 1 25 25 CYS H H 25 7.692 7.692 7.574 0.118 25948
749 1 16 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.805 -0.156 25948
750 1 16 . 1 1 26 26 HIS H H 26 8.651 8.651 8.271 0.380 25948
751 1 16 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.714 -0.020 25948
752 1 16 . 1 1 27 27 CYS H H 27 8.739 8.739 8.690 0.049 25948
753 1 17 . 1 1 2 2 GLY H H 2 8.944 8.944 8.581 0.363 25948
754 1 17 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.657 -0.257 25948
755 1 17 . 1 1 3 3 GLU H H 3 8.773 8.773 7.911 0.862 25948
756 1 17 . 1 1 4 4 GLY H H 4 8.650 8.650 8.649 0.001 25948
757 1 17 . 1 1 5 5 THR HA H 5 4.278 4.278 4.396 -0.118 25948
758 1 17 . 1 1 5 5 THR H H 5 8.104 8.104 8.553 -0.449 25948
759 1 17 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.649 -0.013 25948
760 1 17 . 1 1 6 6 PHE H H 6 8.457 8.457 8.916 -0.459 25948
761 1 17 . 1 1 7 7 THR HA H 7 4.267 4.267 4.538 -0.271 25948
762 1 17 . 1 1 7 7 THR H H 7 8.127 8.127 8.012 0.115 25948
763 1 17 . 1 1 8 8 SER HA H 8 4.363 4.363 4.307 0.056 25948
764 1 17 . 1 1 8 8 SER H H 8 8.355 8.355 7.711 0.644 25948
765 1 17 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.951 -0.284 25948
766 1 17 . 1 1 9 9 ASP H H 9 8.589 8.589 8.149 0.440 25948
767 1 17 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.297 0.313 25948
768 1 17 . 1 1 10 10 CYS H H 10 8.578 8.578 9.119 -0.541 25948
769 1 17 . 1 1 11 11 SER HA H 11 4.102 4.102 4.219 -0.117 25948
770 1 17 . 1 1 11 11 SER H H 11 8.492 8.492 8.273 0.219 25948
771 1 17 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.030 0.075 25948
772 1 17 . 1 1 12 12 LYS H H 12 7.752 7.752 7.884 -0.132 25948
773 1 17 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.114 -0.170 25948
774 1 17 . 1 1 13 13 GLN H H 13 8.230 8.230 8.460 -0.230 25948
775 1 17 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.193 0.321 25948
776 1 17 . 1 1 14 14 CYS H H 14 8.716 8.716 8.484 0.232 25948
777 1 17 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.141 0.133 25948
778 1 17 . 1 1 15 15 GLU H H 15 7.885 7.885 8.060 -0.175 25948
779 1 17 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.212 0.094 25948
780 1 17 . 1 1 16 16 GLU H H 16 7.962 7.962 8.321 -0.359 25948
781 1 17 . 1 1 17 17 GLY H H 17 7.994 7.994 7.684 0.310 25948
782 1 17 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.227 0.115 25948
783 1 17 . 1 1 18 18 ILE H H 18 7.936 7.936 8.877 -0.941 25948
784 1 17 . 1 1 19 19 GLY H H 19 8.643 8.643 8.633 0.010 25948
785 1 17 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.515 -0.025 25948
786 1 17 . 1 1 20 20 HIS H H 20 8.409 8.409 7.843 0.566 25948
787 1 17 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.532 0.541 25948
788 1 17 . 1 1 21 21 LYS H H 21 7.977 7.977 8.433 -0.456 25948
789 1 17 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.387 0.341 25948
790 1 17 . 1 1 22 22 TYR H H 22 8.145 8.145 7.370 0.775 25948
791 1 17 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.263 -0.031 25948
792 1 17 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.898 -0.419 25948
793 1 17 . 1 1 24 24 PHE H H 24 7.487 7.487 6.873 0.614 25948
794 1 17 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.797 0.032 25948
795 1 17 . 1 1 25 25 CYS H H 25 7.692 7.692 7.526 0.166 25948
796 1 17 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.771 -0.122 25948
797 1 17 . 1 1 26 26 HIS H H 26 8.651 8.651 8.817 -0.166 25948
798 1 17 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.864 -0.170 25948
799 1 17 . 1 1 27 27 CYS H H 27 8.739 8.739 8.887 -0.148 25948
800 1 18 . 1 1 2 2 GLY H H 2 8.944 8.944 7.897 1.047 25948
801 1 18 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.074 0.326 25948
802 1 18 . 1 1 3 3 GLU H H 3 8.773 8.773 7.861 0.912 25948
803 1 18 . 1 1 4 4 GLY H H 4 8.650 8.650 8.754 -0.104 25948
804 1 18 . 1 1 5 5 THR HA H 5 4.278 4.278 4.253 0.025 25948
805 1 18 . 1 1 5 5 THR H H 5 8.104 8.104 7.892 0.212 25948
806 1 18 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.748 -0.112 25948
807 1 18 . 1 1 6 6 PHE H H 6 8.457 8.457 8.051 0.406 25948
808 1 18 . 1 1 7 7 THR HA H 7 4.267 4.267 4.361 -0.094 25948
809 1 18 . 1 1 7 7 THR H H 7 8.127 8.127 7.785 0.342 25948
810 1 18 . 1 1 8 8 SER HA H 8 4.363 4.363 3.469 0.894 25948
811 1 18 . 1 1 8 8 SER H H 8 8.355 8.355 6.305 2.050 25948
812 1 18 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.392 0.275 25948
813 1 18 . 1 1 9 9 ASP H H 9 8.589 8.589 7.649 0.940 25948
814 1 18 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.341 0.269 25948
815 1 18 . 1 1 10 10 CYS H H 10 8.578 8.578 8.871 -0.293 25948
816 1 18 . 1 1 11 11 SER HA H 11 4.102 4.102 4.183 -0.081 25948
817 1 18 . 1 1 11 11 SER H H 11 8.492 8.492 8.728 -0.236 25948
818 1 18 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.051 0.054 25948
819 1 18 . 1 1 12 12 LYS H H 12 7.752 7.752 7.797 -0.045 25948
820 1 18 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.141 -0.197 25948
821 1 18 . 1 1 13 13 GLN H H 13 8.230 8.230 7.826 0.404 25948
822 1 18 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.420 0.094 25948
823 1 18 . 1 1 14 14 CYS H H 14 8.716 8.716 8.618 0.098 25948
824 1 18 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.114 0.160 25948
825 1 18 . 1 1 15 15 GLU H H 15 7.885 7.885 7.770 0.115 25948
826 1 18 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.316 -0.010 25948
827 1 18 . 1 1 16 16 GLU H H 16 7.962 7.962 7.898 0.064 25948
828 1 18 . 1 1 17 17 GLY H H 17 7.994 7.994 7.735 0.259 25948
829 1 18 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.295 0.047 25948
830 1 18 . 1 1 18 18 ILE H H 18 7.936 7.936 8.498 -0.562 25948
831 1 18 . 1 1 19 19 GLY H H 19 8.643 8.643 8.684 -0.041 25948
832 1 18 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.430 0.060 25948
833 1 18 . 1 1 20 20 HIS H H 20 8.409 8.409 7.847 0.562 25948
834 1 18 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.730 0.343 25948
835 1 18 . 1 1 21 21 LYS H H 21 7.977 7.977 8.877 -0.900 25948
836 1 18 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.517 0.211 25948
837 1 18 . 1 1 22 22 TYR H H 22 8.145 8.145 7.432 0.713 25948
838 1 18 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.205 0.027 25948
839 1 18 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.858 -0.379 25948
840 1 18 . 1 1 24 24 PHE H H 24 7.487 7.487 6.704 0.783 25948
841 1 18 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.843 -0.014 25948
842 1 18 . 1 1 25 25 CYS H H 25 7.692 7.692 7.547 0.145 25948
843 1 18 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.744 -0.095 25948
844 1 18 . 1 1 26 26 HIS H H 26 8.651 8.651 8.811 -0.160 25948
845 1 18 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.643 0.051 25948
846 1 18 . 1 1 27 27 CYS H H 27 8.739 8.739 8.792 -0.053 25948
847 1 19 . 1 1 2 2 GLY H H 2 8.944 8.944 8.672 0.272 25948
848 1 19 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.616 -0.216 25948
849 1 19 . 1 1 3 3 GLU H H 3 8.773 8.773 8.410 0.363 25948
850 1 19 . 1 1 4 4 GLY H H 4 8.650 8.650 8.706 -0.056 25948
851 1 19 . 1 1 5 5 THR HA H 5 4.278 4.278 4.268 0.010 25948
852 1 19 . 1 1 5 5 THR H H 5 8.104 8.104 8.261 -0.157 25948
853 1 19 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.692 -0.056 25948
854 1 19 . 1 1 6 6 PHE H H 6 8.457 8.457 8.288 0.169 25948
855 1 19 . 1 1 7 7 THR HA H 7 4.267 4.267 4.566 -0.299 25948
856 1 19 . 1 1 7 7 THR H H 7 8.127 8.127 8.024 0.103 25948
857 1 19 . 1 1 8 8 SER HA H 8 4.363 4.363 4.248 0.115 25948
858 1 19 . 1 1 8 8 SER H H 8 8.355 8.355 7.056 1.299 25948
859 1 19 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.729 -0.062 25948
860 1 19 . 1 1 9 9 ASP H H 9 8.589 8.589 7.689 0.900 25948
861 1 19 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.143 0.467 25948
862 1 19 . 1 1 10 10 CYS H H 10 8.578 8.578 8.395 0.183 25948
863 1 19 . 1 1 11 11 SER HA H 11 4.102 4.102 4.143 -0.041 25948
864 1 19 . 1 1 11 11 SER H H 11 8.492 8.492 8.689 -0.197 25948
865 1 19 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.143 -0.038 25948
866 1 19 . 1 1 12 12 LYS H H 12 7.752 7.752 7.443 0.309 25948
867 1 19 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.242 -0.298 25948
868 1 19 . 1 1 13 13 GLN H H 13 8.230 8.230 8.012 0.218 25948
869 1 19 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.298 0.216 25948
870 1 19 . 1 1 14 14 CYS H H 14 8.716 8.716 8.296 0.420 25948
871 1 19 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.039 0.235 25948
872 1 19 . 1 1 15 15 GLU H H 15 7.885 7.885 8.138 -0.253 25948
873 1 19 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.393 -0.087 25948
874 1 19 . 1 1 16 16 GLU H H 16 7.962 7.962 7.651 0.311 25948
875 1 19 . 1 1 17 17 GLY H H 17 7.994 7.994 7.651 0.343 25948
876 1 19 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.008 0.334 25948
877 1 19 . 1 1 18 18 ILE H H 18 7.936 7.936 8.585 -0.649 25948
878 1 19 . 1 1 19 19 GLY H H 19 8.643 8.643 8.451 0.192 25948
879 1 19 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.149 0.341 25948
880 1 19 . 1 1 20 20 HIS H H 20 8.409 8.409 7.927 0.482 25948
881 1 19 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.688 0.385 25948
882 1 19 . 1 1 21 21 LYS H H 21 7.977 7.977 8.114 -0.137 25948
883 1 19 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.165 0.563 25948
884 1 19 . 1 1 22 22 TYR H H 22 8.145 8.145 7.413 0.732 25948
885 1 19 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.246 -0.014 25948
886 1 19 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.759 -0.280 25948
887 1 19 . 1 1 24 24 PHE H H 24 7.487 7.487 6.887 0.600 25948
888 1 19 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.853 -0.024 25948
889 1 19 . 1 1 25 25 CYS H H 25 7.692 7.692 7.231 0.461 25948
890 1 19 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.741 -0.092 25948
891 1 19 . 1 1 26 26 HIS H H 26 8.651 8.651 8.298 0.353 25948
892 1 19 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.794 -0.100 25948
893 1 19 . 1 1 27 27 CYS H H 27 8.739 8.739 8.659 0.080 25948
894 1 20 . 1 1 2 2 GLY H H 2 8.944 8.944 8.103 0.841 25948
895 1 20 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.442 -0.042 25948
896 1 20 . 1 1 3 3 GLU H H 3 8.773 8.773 8.211 0.562 25948
897 1 20 . 1 1 4 4 GLY H H 4 8.650 8.650 8.917 -0.267 25948
898 1 20 . 1 1 5 5 THR HA H 5 4.278 4.278 4.420 -0.142 25948
899 1 20 . 1 1 5 5 THR H H 5 8.104 8.104 8.107 -0.003 25948
900 1 20 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.836 -0.200 25948
901 1 20 . 1 1 6 6 PHE H H 6 8.457 8.457 8.012 0.445 25948
902 1 20 . 1 1 7 7 THR HA H 7 4.267 4.267 4.257 0.010 25948
903 1 20 . 1 1 7 7 THR H H 7 8.127 8.127 8.658 -0.531 25948
904 1 20 . 1 1 8 8 SER HA H 8 4.363 4.363 3.892 0.471 25948
905 1 20 . 1 1 8 8 SER H H 8 8.355 8.355 6.983 1.372 25948
906 1 20 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.446 0.221 25948
907 1 20 . 1 1 9 9 ASP H H 9 8.589 8.589 7.193 1.396 25948
908 1 20 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.209 0.401 25948
909 1 20 . 1 1 10 10 CYS H H 10 8.578 8.578 8.867 -0.289 25948
910 1 20 . 1 1 11 11 SER HA H 11 4.102 4.102 4.132 -0.030 25948
911 1 20 . 1 1 11 11 SER H H 11 8.492 8.492 8.145 0.347 25948
912 1 20 . 1 1 12 12 LYS HA H 12 4.105 4.105 3.976 0.129 25948
913 1 20 . 1 1 12 12 LYS H H 12 7.752 7.752 7.858 -0.106 25948
914 1 20 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.102 -0.158 25948
915 1 20 . 1 1 13 13 GLN H H 13 8.230 8.230 8.506 -0.276 25948
916 1 20 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.362 0.152 25948
917 1 20 . 1 1 14 14 CYS H H 14 8.716 8.716 7.941 0.775 25948
918 1 20 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.198 0.076 25948
919 1 20 . 1 1 15 15 GLU H H 15 7.885 7.885 8.007 -0.122 25948
920 1 20 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.271 0.035 25948
921 1 20 . 1 1 16 16 GLU H H 16 7.962 7.962 8.330 -0.368 25948
922 1 20 . 1 1 17 17 GLY H H 17 7.994 7.994 7.678 0.316 25948
923 1 20 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.379 -0.037 25948
924 1 20 . 1 1 18 18 ILE H H 18 7.936 7.936 8.574 -0.638 25948
925 1 20 . 1 1 19 19 GLY H H 19 8.643 8.643 8.687 -0.044 25948
926 1 20 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.477 0.013 25948
927 1 20 . 1 1 20 20 HIS H H 20 8.409 8.409 7.577 0.832 25948
928 1 20 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.652 0.421 25948
929 1 20 . 1 1 21 21 LYS H H 21 7.977 7.977 8.378 -0.401 25948
930 1 20 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.442 0.286 25948
931 1 20 . 1 1 22 22 TYR H H 22 8.145 8.145 7.447 0.698 25948
932 1 20 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.413 -0.181 25948
933 1 20 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.871 -0.392 25948
934 1 20 . 1 1 24 24 PHE H H 24 7.487 7.487 7.088 0.399 25948
935 1 20 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.808 0.021 25948
936 1 20 . 1 1 25 25 CYS H H 25 7.692 7.692 7.529 0.163 25948
937 1 20 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.719 -0.070 25948
938 1 20 . 1 1 26 26 HIS H H 26 8.651 8.651 8.766 -0.115 25948
939 1 20 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.716 -0.022 25948
940 1 20 . 1 1 27 27 CYS H H 27 8.739 8.739 8.868 -0.129 25948
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 25948
2 1 1 "Average Difference" HA 30 0.224 -0.019 0.227 25948
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25948
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25948
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25948
6 1 1 "Average Difference" HN 25 0.427 -0.127 0.417 25948
7 1 2 "Average Difference" N 0 0.000 0.000 0.000 25948
8 1 2 "Average Difference" HA 30 0.224 -0.060 0.219 25948
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25948
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25948
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25948
12 1 2 "Average Difference" HN 25 0.478 -0.113 0.474 25948
13 1 3 "Average Difference" N 0 0.000 0.000 0.000 25948
14 1 3 "Average Difference" HA 30 0.224 -0.066 0.218 25948
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25948
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25948
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25948
18 1 3 "Average Difference" HN 25 0.520 -0.207 0.486 25948
19 1 4 "Average Difference" N 0 0.000 0.000 0.000 25948
20 1 4 "Average Difference" HA 30 0.195 -0.017 0.198 25948
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25948
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25948
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25948
24 1 4 "Average Difference" HN 25 0.514 -0.169 0.495 25948
25 1 5 "Average Difference" N 0 0.000 0.000 0.000 25948
26 1 5 "Average Difference" HA 30 0.216 -0.092 0.199 25948
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25948
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25948
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25948
30 1 5 "Average Difference" HN 25 0.554 -0.231 0.515 25948
31 1 6 "Average Difference" N 0 0.000 0.000 0.000 25948
32 1 6 "Average Difference" HA 30 0.200 -0.092 0.181 25948
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25948
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25948
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25948
36 1 6 "Average Difference" HN 25 0.459 -0.117 0.454 25948
37 1 7 "Average Difference" N 0 0.000 0.000 0.000 25948
38 1 7 "Average Difference" HA 30 0.203 -0.037 0.203 25948
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25948
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25948
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25948
42 1 7 "Average Difference" HN 25 0.618 -0.143 0.614 25948
43 1 8 "Average Difference" N 0 0.000 0.000 0.000 25948
44 1 8 "Average Difference" HA 30 0.241 -0.026 0.243 25948
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25948
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25948
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25948
48 1 8 "Average Difference" HN 25 0.494 -0.138 0.484 25948
49 1 9 "Average Difference" N 0 0.000 0.000 0.000 25948
50 1 9 "Average Difference" HA 30 0.225 -0.064 0.219 25948
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25948
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25948
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25948
54 1 9 "Average Difference" HN 25 0.497 -0.247 0.439 25948
55 1 10 "Average Difference" N 0 0.000 0.000 0.000 25948
56 1 10 "Average Difference" HA 30 0.210 -0.074 0.200 25948
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25948
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25948
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25948
60 1 10 "Average Difference" HN 25 0.494 -0.246 0.437 25948
61 1 11 "Average Difference" N 0 0.000 0.000 0.000 25948
62 1 11 "Average Difference" HA 30 0.232 -0.076 0.223 25948
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25948
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25948
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25948
66 1 11 "Average Difference" HN 25 0.498 -0.226 0.453 25948
67 1 12 "Average Difference" N 0 0.000 0.000 0.000 25948
68 1 12 "Average Difference" HA 30 0.246 -0.003 0.250 25948
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25948
70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25948
71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25948
72 1 12 "Average Difference" HN 25 0.435 -0.219 0.383 25948
73 1 13 "Average Difference" N 0 0.000 0.000 0.000 25948
74 1 13 "Average Difference" HA 30 0.233 -0.111 0.208 25948
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25948
76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 25948
77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 25948
78 1 13 "Average Difference" HN 25 0.498 -0.100 0.498 25948
79 1 14 "Average Difference" N 0 0.000 0.000 0.000 25948
80 1 14 "Average Difference" HA 30 0.190 -0.056 0.185 25948
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25948
82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 25948
83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 25948
84 1 14 "Average Difference" HN 25 0.424 -0.178 0.392 25948
85 1 15 "Average Difference" N 0 0.000 0.000 0.000 25948
86 1 15 "Average Difference" HA 30 0.208 -0.021 0.210 25948
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25948
88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 25948
89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 25948
90 1 15 "Average Difference" HN 25 0.514 -0.138 0.506 25948
91 1 16 "Average Difference" N 0 0.000 0.000 0.000 25948
92 1 16 "Average Difference" HA 30 0.226 -0.063 0.220 25948
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25948
94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 25948
95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 25948
96 1 16 "Average Difference" HN 25 0.471 -0.240 0.413 25948
97 1 17 "Average Difference" N 0 0.000 0.000 0.000 25948
98 1 17 "Average Difference" HA 30 0.249 -0.011 0.253 25948
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25948
100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 25948
101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 25948
102 1 17 "Average Difference" HN 25 0.452 -0.050 0.458 25948
103 1 18 "Average Difference" N 0 0.000 0.000 0.000 25948
104 1 18 "Average Difference" HA 30 0.279 -0.076 0.273 25948
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25948
106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 25948
107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 25948
108 1 18 "Average Difference" HN 25 0.644 -0.266 0.598 25948
109 1 19 "Average Difference" N 0 0.000 0.000 0.000 25948
110 1 19 "Average Difference" HA 30 0.239 -0.049 0.238 25948
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25948
112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 25948
113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 25948
114 1 19 "Average Difference" HN 25 0.464 -0.254 0.397 25948
115 1 20 "Average Difference" N 0 0.000 0.000 0.000 25948
116 1 20 "Average Difference" HA 30 0.241 -0.094 0.226 25948
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25948
118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 25948
119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 25948
120 1 20 "Average Difference" HN 25 0.584 -0.194 0.562 25948
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 25948
_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 GLY H H 2 8.944 8.944 8.408 0.536 25948
2 1 . 1 1 3 3 GLU HA H 3 4.400 4.400 4.404 -0.004 25948
3 1 . 1 1 3 3 GLU H H 3 8.773 8.773 8.291 0.482 25948
4 1 . 1 1 4 4 GLY H H 4 8.650 8.650 8.546 0.104 25948
5 1 . 1 1 5 5 THR HA H 5 4.278 4.278 4.275 0.003 25948
6 1 . 1 1 5 5 THR H H 5 8.104 8.104 8.093 0.011 25948
7 1 . 1 1 6 6 PHE HA H 6 4.636 4.636 4.723 -0.087 25948
8 1 . 1 1 6 6 PHE H H 6 8.457 8.457 8.216 0.241 25948
9 1 . 1 1 7 7 THR HA H 7 4.267 4.267 4.334 -0.067 25948
10 1 . 1 1 7 7 THR H H 7 8.127 8.127 8.187 -0.060 25948
11 1 . 1 1 8 8 SER HA H 8 4.363 4.363 4.249 0.114 25948
12 1 . 1 1 8 8 SER H H 8 8.355 8.355 7.513 0.842 25948
13 1 . 1 1 9 9 ASP HA H 9 4.667 4.667 4.741 -0.074 25948
14 1 . 1 1 9 9 ASP H H 9 8.589 8.589 7.693 0.896 25948
15 1 . 1 1 10 10 CYS HA H 10 4.610 4.610 4.268 0.342 25948
16 1 . 1 1 10 10 CYS H H 10 8.578 8.578 8.876 -0.298 25948
17 1 . 1 1 11 11 SER HA H 11 4.102 4.102 4.172 -0.070 25948
18 1 . 1 1 11 11 SER H H 11 8.492 8.492 8.611 -0.119 25948
19 1 . 1 1 12 12 LYS HA H 12 4.105 4.105 4.088 0.017 25948
20 1 . 1 1 12 12 LYS H H 12 7.752 7.752 7.778 -0.026 25948
21 1 . 1 1 13 13 GLN HA H 13 3.944 3.944 4.117 -0.173 25948
22 1 . 1 1 13 13 GLN H H 13 8.230 8.230 8.151 0.079 25948
23 1 . 1 1 14 14 CYS HA H 14 4.514 4.514 4.311 0.203 25948
24 1 . 1 1 14 14 CYS H H 14 8.716 8.716 8.156 0.560 25948
25 1 . 1 1 15 15 GLU HA H 15 4.274 4.274 4.127 0.147 25948
26 1 . 1 1 15 15 GLU H H 15 7.885 7.885 8.101 -0.216 25948
27 1 . 1 1 16 16 GLU HA H 16 4.306 4.306 4.290 0.016 25948
28 1 . 1 1 16 16 GLU H H 16 7.962 7.962 8.160 -0.198 25948
29 1 . 1 1 17 17 GLY H H 17 7.994 7.994 7.698 0.296 25948
30 1 . 1 1 18 18 ILE HA H 18 4.342 4.342 4.261 0.081 25948
31 1 . 1 1 18 18 ILE H H 18 7.936 7.936 8.442 -0.506 25948
32 1 . 1 1 19 19 GLY H H 19 8.643 8.643 8.616 0.027 25948
33 1 . 1 1 20 20 HIS HA H 20 4.490 4.490 4.380 0.110 25948
34 1 . 1 1 20 20 HIS H H 20 8.409 8.409 7.883 0.526 25948
35 1 . 1 1 21 21 LYS HA H 21 4.073 4.073 3.635 0.438 25948
36 1 . 1 1 21 21 LYS H H 21 7.977 7.977 8.426 -0.449 25948
37 1 . 1 1 22 22 TYR HA H 22 4.728 4.728 4.373 0.355 25948
38 1 . 1 1 22 22 TYR H H 22 8.145 8.145 7.321 0.824 25948
39 1 . 1 1 23 23 PRO HA H 23 4.232 4.232 4.218 0.014 25948
40 1 . 1 1 24 24 PHE HA H 24 4.479 4.479 4.811 -0.332 25948
41 1 . 1 1 24 24 PHE H H 24 7.487 7.487 6.759 0.728 25948
42 1 . 1 1 25 25 CYS HA H 25 4.829 4.829 4.803 0.026 25948
43 1 . 1 1 25 25 CYS H H 25 7.692 7.692 7.424 0.268 25948
44 1 . 1 1 26 26 HIS HA H 26 4.649 4.649 4.759 -0.110 25948
45 1 . 1 1 26 26 HIS H H 26 8.651 8.651 8.570 0.081 25948
46 1 . 1 1 27 27 CYS HA H 27 4.694 4.694 4.738 -0.044 25948
47 1 . 1 1 27 27 CYS H H 27 8.739 8.739 8.859 -0.120 25948
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