data_25934
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25934
_Entry.PDB_ID 2NAB
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 25934
_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 5 5 VAL N N 5 122.612 122.612 121.013 1.599 25934
2 1 1 . 1 1 5 5 VAL HA H 5 4.134 4.134 4.356 -0.222 25934
3 1 1 . 1 1 5 5 VAL H H 5 8.326 8.326 7.507 0.819 25934
4 1 1 . 1 1 6 6 GLN N N 6 125.548 125.548 125.374 0.174 25934
5 1 1 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.368 0.086 25934
6 1 1 . 1 1 6 6 GLN H H 6 8.635 8.635 8.504 0.131 25934
7 1 1 . 1 1 7 7 THR N N 7 116.430 116.430 118.862 -2.432 25934
8 1 1 . 1 1 7 7 THR HA H 7 4.394 4.394 4.473 -0.079 25934
9 1 1 . 1 1 7 7 THR H H 7 8.307 8.307 7.948 0.359 25934
10 1 1 . 1 1 8 8 SER N N 8 118.551 118.551 121.812 -3.261 25934
11 1 1 . 1 1 8 8 SER HA H 8 4.467 4.467 4.627 -0.160 25934
12 1 1 . 1 1 8 8 SER H H 8 8.345 8.345 8.859 -0.514 25934
13 1 1 . 1 1 9 9 GLN N N 9 123.019 123.019 119.130 3.889 25934
14 1 1 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.100 0.180 25934
15 1 1 . 1 1 9 9 GLN H H 9 8.338 8.338 7.512 0.826 25934
16 1 1 . 1 1 10 10 LYS N N 10 123.679 123.679 119.421 4.258 25934
17 1 1 . 1 1 10 10 LYS HA H 10 4.199 4.199 4.526 -0.327 25934
18 1 1 . 1 1 10 10 LYS H H 10 8.258 8.258 7.259 0.999 25934
19 1 1 . 1 1 11 11 SER N N 11 115.557 115.557 116.518 -0.961 25934
20 1 1 . 1 1 11 11 SER HA H 11 4.534 4.534 4.446 0.088 25934
21 1 1 . 1 1 11 11 SER H H 11 7.659 7.659 7.967 -0.308 25934
22 1 1 . 1 1 12 12 TYR N N 12 122.532 122.532 121.995 0.537 25934
23 1 1 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.326 -0.106 25934
24 1 1 . 1 1 12 12 TYR H H 12 8.585 8.585 7.374 1.211 25934
25 1 1 . 1 1 13 13 VAL N N 13 123.674 123.674 124.364 -0.690 25934
26 1 1 . 1 1 13 13 VAL HA H 13 4.801 4.801 5.226 -0.425 25934
27 1 1 . 1 1 13 13 VAL H H 13 8.253 8.253 8.280 -0.028 25934
28 1 1 . 1 1 14 14 CYS N N 14 131.181 131.181 128.664 2.517 25934
29 1 1 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.128 -0.050 25934
30 1 1 . 1 1 14 14 CYS H H 14 9.362 9.362 8.985 0.377 25934
31 1 1 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.342 -1.884 25934
32 1 1 . 1 1 16 16 ASN N N 16 119.946 119.946 114.712 5.234 25934
33 1 1 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.700 0.189 25934
34 1 1 . 1 1 16 16 ASN H H 16 9.104 9.104 8.451 0.653 25934
35 1 1 . 1 1 17 17 CYS N N 17 117.298 117.298 116.265 1.033 25934
36 1 1 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.797 0.339 25934
37 1 1 . 1 1 17 17 CYS H H 17 8.202 8.202 7.844 0.358 25934
38 1 1 . 1 1 18 18 GLY N N 18 113.723 113.723 109.523 4.200 25934
39 1 1 . 1 1 18 18 GLY H H 18 8.092 8.092 8.652 -0.560 25934
40 1 1 . 1 1 19 19 LYS N N 19 124.529 124.529 120.131 4.398 25934
41 1 1 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.295 -0.332 25934
42 1 1 . 1 1 19 19 LYS H H 19 8.396 8.396 7.649 0.747 25934
43 1 1 . 1 1 20 20 ILE N N 20 122.902 122.902 125.166 -2.264 25934
44 1 1 . 1 1 20 20 ILE HA H 20 4.619 4.619 4.675 -0.056 25934
45 1 1 . 1 1 20 20 ILE H H 20 7.793 7.793 8.226 -0.433 25934
46 1 1 . 1 1 21 21 PHE N N 21 126.244 126.244 125.817 0.427 25934
47 1 1 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.868 -0.108 25934
48 1 1 . 1 1 21 21 PHE H H 21 9.361 9.361 8.928 0.433 25934
49 1 1 . 1 1 22 22 ARG N N 22 125.051 125.051 121.599 3.452 25934
50 1 1 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.320 0.087 25934
51 1 1 . 1 1 22 22 ARG H H 22 9.016 9.016 8.622 0.394 25934
52 1 1 . 1 1 23 23 TRP N N 23 118.871 118.871 117.245 1.626 25934
53 1 1 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.785 0.543 25934
54 1 1 . 1 1 23 23 TRP H H 23 7.986 7.986 7.744 0.242 25934
55 1 1 . 1 1 24 24 ARG N N 24 130.190 130.190 121.442 8.748 25934
56 1 1 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.636 -0.595 25934
57 1 1 . 1 1 24 24 ARG H H 24 9.358 9.358 8.790 0.568 25934
58 1 1 . 1 1 25 25 VAL N N 25 115.735 115.735 117.347 -1.612 25934
59 1 1 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.752 0.050 25934
60 1 1 . 1 1 25 25 VAL H H 25 8.598 8.598 8.221 0.377 25934
61 1 1 . 1 1 26 26 ASN N N 26 119.272 119.272 117.246 2.026 25934
62 1 1 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.494 0.119 25934
63 1 1 . 1 1 26 26 ASN H H 26 6.907 6.907 8.451 -1.544 25934
64 1 1 . 1 1 27 27 PHE N N 27 124.971 124.971 122.720 2.251 25934
65 1 1 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.216 -0.203 25934
66 1 1 . 1 1 27 27 PHE H H 27 7.487 7.487 7.203 0.284 25934
67 1 1 . 1 1 28 28 ILE N N 28 119.280 119.280 118.478 0.802 25934
68 1 1 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.476 -0.199 25934
69 1 1 . 1 1 28 28 ILE H H 28 8.458 8.458 8.566 -0.108 25934
70 1 1 . 1 1 29 29 ARG N N 29 119.668 119.668 120.275 -0.607 25934
71 1 1 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.855 0.045 25934
72 1 1 . 1 1 29 29 ARG H H 29 7.577 7.577 7.628 -0.051 25934
73 1 1 . 1 1 30 30 HIS N N 30 120.050 120.050 118.970 1.080 25934
74 1 1 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.244 0.014 25934
75 1 1 . 1 1 30 30 HIS H H 30 7.620 7.620 7.769 -0.149 25934
76 1 1 . 1 1 31 31 LEU N N 31 120.143 120.143 117.191 2.952 25934
77 1 1 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.931 -0.158 25934
78 1 1 . 1 1 31 31 LEU H H 31 8.005 8.005 7.864 0.141 25934
79 1 1 . 1 1 32 32 ARG N N 32 118.157 118.157 120.006 -1.849 25934
80 1 1 . 1 1 32 32 ARG HA H 32 4.066 4.066 4.082 -0.016 25934
81 1 1 . 1 1 32 32 ARG H H 32 7.975 7.975 8.065 -0.089 25934
82 1 1 . 1 1 33 33 SER N N 33 115.082 115.082 114.146 0.936 25934
83 1 1 . 1 1 33 33 SER HA H 33 4.327 4.327 4.463 -0.136 25934
84 1 1 . 1 1 33 33 SER H H 33 7.754 7.754 7.674 0.080 25934
85 1 1 . 1 1 34 34 ARG N N 34 121.862 121.862 121.995 -0.133 25934
86 1 1 . 1 1 34 34 ARG HA H 34 4.190 4.190 3.960 0.230 25934
87 1 1 . 1 1 34 34 ARG H H 34 7.558 7.558 7.334 0.224 25934
88 1 1 . 1 1 35 35 ARG N N 35 121.550 121.550 118.479 3.071 25934
89 1 1 . 1 1 35 35 ARG HA H 35 4.284 4.284 4.106 0.178 25934
90 1 1 . 1 1 35 35 ARG H H 35 8.030 8.030 7.390 0.640 25934
91 1 1 . 1 1 36 36 GLU N N 36 122.012 122.012 117.921 4.091 25934
92 1 1 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.360 -0.042 25934
93 1 1 . 1 1 36 36 GLU H H 36 8.274 8.274 7.650 0.624 25934
94 1 1 . 1 1 37 37 GLN N N 37 121.601 121.601 119.174 2.427 25934
95 1 1 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.475 -0.206 25934
96 1 1 . 1 1 37 37 GLN H H 37 8.238 8.238 7.514 0.724 25934
97 1 1 . 1 1 38 38 LYS N N 38 124.607 124.607 119.239 5.368 25934
98 1 1 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.767 -0.172 25934
99 1 1 . 1 1 38 38 LYS H H 38 8.348 8.348 8.303 0.045 25934
100 1 1 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.235 0.181 25934
101 1 1 . 1 1 40 40 HIS N N 40 120.882 120.882 113.468 7.414 25934
102 1 1 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.543 0.096 25934
103 1 1 . 1 1 40 40 HIS H H 40 8.565 8.565 7.813 0.752 25934
104 1 2 . 1 1 5 5 VAL N N 5 122.612 122.612 117.734 4.878 25934
105 1 2 . 1 1 5 5 VAL HA H 5 4.134 4.134 4.059 0.075 25934
106 1 2 . 1 1 5 5 VAL H H 5 8.326 8.326 7.677 0.649 25934
107 1 2 . 1 1 6 6 GLN N N 6 125.548 125.548 120.323 5.225 25934
108 1 2 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.208 0.246 25934
109 1 2 . 1 1 6 6 GLN H H 6 8.635 8.635 8.095 0.540 25934
110 1 2 . 1 1 7 7 THR N N 7 116.430 116.430 120.165 -3.735 25934
111 1 2 . 1 1 7 7 THR HA H 7 4.394 4.394 4.404 -0.010 25934
112 1 2 . 1 1 7 7 THR H H 7 8.307 8.307 8.236 0.071 25934
113 1 2 . 1 1 8 8 SER N N 8 118.551 118.551 118.479 0.072 25934
114 1 2 . 1 1 8 8 SER HA H 8 4.467 4.467 4.531 -0.064 25934
115 1 2 . 1 1 8 8 SER H H 8 8.345 8.345 8.087 0.258 25934
116 1 2 . 1 1 9 9 GLN N N 9 123.019 123.019 116.699 6.320 25934
117 1 2 . 1 1 9 9 GLN HA H 9 4.280 4.280 3.883 0.397 25934
118 1 2 . 1 1 9 9 GLN H H 9 8.338 8.338 8.553 -0.215 25934
119 1 2 . 1 1 10 10 LYS N N 10 123.679 123.679 120.566 3.113 25934
120 1 2 . 1 1 10 10 LYS HA H 10 4.199 4.199 4.152 0.047 25934
121 1 2 . 1 1 10 10 LYS H H 10 8.258 8.258 8.161 0.097 25934
122 1 2 . 1 1 11 11 SER N N 11 115.557 115.557 117.271 -1.714 25934
123 1 2 . 1 1 11 11 SER HA H 11 4.534 4.534 4.305 0.229 25934
124 1 2 . 1 1 11 11 SER H H 11 7.659 7.659 7.539 0.120 25934
125 1 2 . 1 1 12 12 TYR N N 12 122.532 122.532 126.175 -3.643 25934
126 1 2 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.267 -0.047 25934
127 1 2 . 1 1 12 12 TYR H H 12 8.585 8.585 8.846 -0.261 25934
128 1 2 . 1 1 13 13 VAL N N 13 123.674 123.674 124.982 -1.308 25934
129 1 2 . 1 1 13 13 VAL HA H 13 4.801 4.801 4.939 -0.138 25934
130 1 2 . 1 1 13 13 VAL H H 13 8.253 8.253 8.460 -0.207 25934
131 1 2 . 1 1 14 14 CYS N N 14 131.181 131.181 129.417 1.764 25934
132 1 2 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.061 0.017 25934
133 1 2 . 1 1 14 14 CYS H H 14 9.362 9.362 9.224 0.138 25934
134 1 2 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.410 -1.952 25934
135 1 2 . 1 1 16 16 ASN N N 16 119.946 119.946 116.410 3.536 25934
136 1 2 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.756 0.133 25934
137 1 2 . 1 1 16 16 ASN H H 16 9.104 9.104 8.100 1.004 25934
138 1 2 . 1 1 17 17 CYS N N 17 117.298 117.298 116.295 1.003 25934
139 1 2 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.768 0.368 25934
140 1 2 . 1 1 17 17 CYS H H 17 8.202 8.202 7.669 0.533 25934
141 1 2 . 1 1 18 18 GLY N N 18 113.723 113.723 109.315 4.408 25934
142 1 2 . 1 1 18 18 GLY H H 18 8.092 8.092 8.658 -0.566 25934
143 1 2 . 1 1 19 19 LYS N N 19 124.529 124.529 120.866 3.663 25934
144 1 2 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.237 -0.274 25934
145 1 2 . 1 1 19 19 LYS H H 19 8.396 8.396 7.918 0.478 25934
146 1 2 . 1 1 20 20 ILE N N 20 122.902 122.902 125.294 -2.392 25934
147 1 2 . 1 1 20 20 ILE HA H 20 4.619 4.619 5.116 -0.497 25934
148 1 2 . 1 1 20 20 ILE H H 20 7.793 7.793 8.043 -0.250 25934
149 1 2 . 1 1 21 21 PHE N N 21 126.244 126.244 126.167 0.077 25934
150 1 2 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.881 -0.121 25934
151 1 2 . 1 1 21 21 PHE H H 21 9.361 9.361 9.164 0.197 25934
152 1 2 . 1 1 22 22 ARG N N 22 125.051 125.051 121.991 3.060 25934
153 1 2 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.615 -0.208 25934
154 1 2 . 1 1 22 22 ARG H H 22 9.016 9.016 8.798 0.218 25934
155 1 2 . 1 1 23 23 TRP N N 23 118.871 118.871 119.448 -0.577 25934
156 1 2 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.939 0.389 25934
157 1 2 . 1 1 23 23 TRP H H 23 7.986 7.986 8.028 -0.042 25934
158 1 2 . 1 1 24 24 ARG N N 24 130.190 130.190 124.310 5.880 25934
159 1 2 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.671 -0.630 25934
160 1 2 . 1 1 24 24 ARG H H 24 9.358 9.358 8.989 0.369 25934
161 1 2 . 1 1 25 25 VAL N N 25 115.735 115.735 118.002 -2.267 25934
162 1 2 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.845 -0.043 25934
163 1 2 . 1 1 25 25 VAL H H 25 8.598 8.598 8.188 0.410 25934
164 1 2 . 1 1 26 26 ASN N N 26 119.272 119.272 117.219 2.053 25934
165 1 2 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.472 0.141 25934
166 1 2 . 1 1 26 26 ASN H H 26 6.907 6.907 8.433 -1.526 25934
167 1 2 . 1 1 27 27 PHE N N 27 124.971 124.971 122.658 2.313 25934
168 1 2 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.474 -0.461 25934
169 1 2 . 1 1 27 27 PHE H H 27 7.487 7.487 7.494 -0.007 25934
170 1 2 . 1 1 28 28 ILE N N 28 119.280 119.280 118.583 0.697 25934
171 1 2 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.455 -0.178 25934
172 1 2 . 1 1 28 28 ILE H H 28 8.458 8.458 8.614 -0.156 25934
173 1 2 . 1 1 29 29 ARG N N 29 119.668 119.668 120.581 -0.913 25934
174 1 2 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.896 0.004 25934
175 1 2 . 1 1 29 29 ARG H H 29 7.577 7.577 7.569 0.008 25934
176 1 2 . 1 1 30 30 HIS N N 30 120.050 120.050 118.520 1.530 25934
177 1 2 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.286 -0.028 25934
178 1 2 . 1 1 30 30 HIS H H 30 7.620 7.620 7.677 -0.057 25934
179 1 2 . 1 1 31 31 LEU N N 31 120.143 120.143 117.812 2.331 25934
180 1 2 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.865 -0.092 25934
181 1 2 . 1 1 31 31 LEU H H 31 8.005 8.005 8.042 -0.037 25934
182 1 2 . 1 1 32 32 ARG N N 32 118.157 118.157 121.000 -2.843 25934
183 1 2 . 1 1 32 32 ARG HA H 32 4.066 4.066 3.957 0.109 25934
184 1 2 . 1 1 32 32 ARG H H 32 7.975 7.975 8.243 -0.268 25934
185 1 2 . 1 1 33 33 SER N N 33 115.082 115.082 113.485 1.597 25934
186 1 2 . 1 1 33 33 SER HA H 33 4.327 4.327 4.538 -0.211 25934
187 1 2 . 1 1 33 33 SER H H 33 7.754 7.754 7.645 0.109 25934
188 1 2 . 1 1 34 34 ARG N N 34 121.862 121.862 120.372 1.490 25934
189 1 2 . 1 1 34 34 ARG HA H 34 4.190 4.190 4.011 0.179 25934
190 1 2 . 1 1 34 34 ARG H H 34 7.558 7.558 7.126 0.432 25934
191 1 2 . 1 1 35 35 ARG N N 35 121.550 121.550 116.761 4.789 25934
192 1 2 . 1 1 35 35 ARG HA H 35 4.284 4.284 3.879 0.405 25934
193 1 2 . 1 1 35 35 ARG H H 35 8.030 8.030 8.899 -0.869 25934
194 1 2 . 1 1 36 36 GLU N N 36 122.012 122.012 118.654 3.358 25934
195 1 2 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.516 -0.198 25934
196 1 2 . 1 1 36 36 GLU H H 36 8.274 8.274 8.070 0.204 25934
197 1 2 . 1 1 37 37 GLN N N 37 121.601 121.601 122.176 -0.575 25934
198 1 2 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.395 -0.126 25934
199 1 2 . 1 1 37 37 GLN H H 37 8.238 8.238 8.472 -0.234 25934
200 1 2 . 1 1 38 38 LYS N N 38 124.607 124.607 121.387 3.220 25934
201 1 2 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.601 -0.006 25934
202 1 2 . 1 1 38 38 LYS H H 38 8.348 8.348 8.254 0.094 25934
203 1 2 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.263 0.153 25934
204 1 2 . 1 1 40 40 HIS N N 40 120.882 120.882 121.608 -0.726 25934
205 1 2 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.573 0.066 25934
206 1 2 . 1 1 40 40 HIS H H 40 8.565 8.565 8.865 -0.300 25934
207 1 3 . 1 1 5 5 VAL N N 5 122.612 122.612 121.893 0.719 25934
208 1 3 . 1 1 5 5 VAL HA H 5 4.134 4.134 4.137 -0.003 25934
209 1 3 . 1 1 5 5 VAL H H 5 8.326 8.326 7.918 0.408 25934
210 1 3 . 1 1 6 6 GLN N N 6 125.548 125.548 125.978 -0.430 25934
211 1 3 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.254 0.200 25934
212 1 3 . 1 1 6 6 GLN H H 6 8.635 8.635 8.624 0.011 25934
213 1 3 . 1 1 7 7 THR N N 7 116.430 116.430 116.430 0.000 25934
214 1 3 . 1 1 7 7 THR HA H 7 4.394 4.394 4.467 -0.073 25934
215 1 3 . 1 1 7 7 THR H H 7 8.307 8.307 7.836 0.471 25934
216 1 3 . 1 1 8 8 SER N N 8 118.551 118.551 117.062 1.489 25934
217 1 3 . 1 1 8 8 SER HA H 8 4.467 4.467 4.496 -0.029 25934
218 1 3 . 1 1 8 8 SER H H 8 8.345 8.345 8.507 -0.162 25934
219 1 3 . 1 1 9 9 GLN N N 9 123.019 123.019 121.461 1.558 25934
220 1 3 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.348 -0.068 25934
221 1 3 . 1 1 9 9 GLN H H 9 8.338 8.338 7.509 0.829 25934
222 1 3 . 1 1 10 10 LYS N N 10 123.679 123.679 116.509 7.170 25934
223 1 3 . 1 1 10 10 LYS HA H 10 4.199 4.199 4.948 -0.749 25934
224 1 3 . 1 1 10 10 LYS H H 10 8.258 8.258 7.188 1.070 25934
225 1 3 . 1 1 11 11 SER N N 11 115.557 115.557 115.390 0.167 25934
226 1 3 . 1 1 11 11 SER HA H 11 4.534 4.534 4.426 0.108 25934
227 1 3 . 1 1 11 11 SER H H 11 7.659 7.659 7.839 -0.180 25934
228 1 3 . 1 1 12 12 TYR N N 12 122.532 122.532 121.455 1.077 25934
229 1 3 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.333 -0.113 25934
230 1 3 . 1 1 12 12 TYR H H 12 8.585 8.585 7.135 1.450 25934
231 1 3 . 1 1 13 13 VAL N N 13 123.674 123.674 124.025 -0.351 25934
232 1 3 . 1 1 13 13 VAL HA H 13 4.801 4.801 5.081 -0.280 25934
233 1 3 . 1 1 13 13 VAL H H 13 8.253 8.253 8.370 -0.117 25934
234 1 3 . 1 1 14 14 CYS N N 14 131.181 131.181 128.910 2.271 25934
235 1 3 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.032 0.046 25934
236 1 3 . 1 1 14 14 CYS H H 14 9.362 9.362 8.982 0.380 25934
237 1 3 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.356 -1.898 25934
238 1 3 . 1 1 16 16 ASN N N 16 119.946 119.946 114.709 5.237 25934
239 1 3 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.688 0.201 25934
240 1 3 . 1 1 16 16 ASN H H 16 9.104 9.104 8.170 0.934 25934
241 1 3 . 1 1 17 17 CYS N N 17 117.298 117.298 115.687 1.611 25934
242 1 3 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.891 0.245 25934
243 1 3 . 1 1 17 17 CYS H H 17 8.202 8.202 7.708 0.494 25934
244 1 3 . 1 1 18 18 GLY N N 18 113.723 113.723 109.450 4.273 25934
245 1 3 . 1 1 18 18 GLY H H 18 8.092 8.092 8.657 -0.565 25934
246 1 3 . 1 1 19 19 LYS N N 19 124.529 124.529 120.653 3.876 25934
247 1 3 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.229 -0.266 25934
248 1 3 . 1 1 19 19 LYS H H 19 8.396 8.396 7.855 0.541 25934
249 1 3 . 1 1 20 20 ILE N N 20 122.902 122.902 124.553 -1.651 25934
250 1 3 . 1 1 20 20 ILE HA H 20 4.619 4.619 4.962 -0.343 25934
251 1 3 . 1 1 20 20 ILE H H 20 7.793 7.793 8.035 -0.242 25934
252 1 3 . 1 1 21 21 PHE N N 21 126.244 126.244 125.758 0.486 25934
253 1 3 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.813 -0.053 25934
254 1 3 . 1 1 21 21 PHE H H 21 9.361 9.361 8.546 0.815 25934
255 1 3 . 1 1 22 22 ARG N N 22 125.051 125.051 122.029 3.022 25934
256 1 3 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.528 -0.121 25934
257 1 3 . 1 1 22 22 ARG H H 22 9.016 9.016 8.641 0.375 25934
258 1 3 . 1 1 23 23 TRP N N 23 118.871 118.871 118.325 0.546 25934
259 1 3 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.800 0.528 25934
260 1 3 . 1 1 23 23 TRP H H 23 7.986 7.986 7.819 0.167 25934
261 1 3 . 1 1 24 24 ARG N N 24 130.190 130.190 123.183 7.007 25934
262 1 3 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.828 -0.787 25934
263 1 3 . 1 1 24 24 ARG H H 24 9.358 9.358 8.854 0.504 25934
264 1 3 . 1 1 25 25 VAL N N 25 115.735 115.735 119.372 -3.637 25934
265 1 3 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.795 0.007 25934
266 1 3 . 1 1 25 25 VAL H H 25 8.598 8.598 8.292 0.306 25934
267 1 3 . 1 1 26 26 ASN N N 26 119.272 119.272 118.002 1.270 25934
268 1 3 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.514 0.098 25934
269 1 3 . 1 1 26 26 ASN H H 26 6.907 6.907 8.363 -1.456 25934
270 1 3 . 1 1 27 27 PHE N N 27 124.971 124.971 122.887 2.084 25934
271 1 3 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.168 -0.155 25934
272 1 3 . 1 1 27 27 PHE H H 27 7.487 7.487 7.577 -0.090 25934
273 1 3 . 1 1 28 28 ILE N N 28 119.280 119.280 117.912 1.368 25934
274 1 3 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.475 -0.198 25934
275 1 3 . 1 1 28 28 ILE H H 28 8.458 8.458 8.692 -0.234 25934
276 1 3 . 1 1 29 29 ARG N N 29 119.668 119.668 120.109 -0.441 25934
277 1 3 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.888 0.012 25934
278 1 3 . 1 1 29 29 ARG H H 29 7.577 7.577 7.485 0.092 25934
279 1 3 . 1 1 30 30 HIS N N 30 120.050 120.050 118.563 1.487 25934
280 1 3 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.286 -0.028 25934
281 1 3 . 1 1 30 30 HIS H H 30 7.620 7.620 7.980 -0.360 25934
282 1 3 . 1 1 31 31 LEU N N 31 120.143 120.143 118.152 1.991 25934
283 1 3 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.940 -0.167 25934
284 1 3 . 1 1 31 31 LEU H H 31 8.005 8.005 7.891 0.114 25934
285 1 3 . 1 1 32 32 ARG N N 32 118.157 118.157 119.216 -1.059 25934
286 1 3 . 1 1 32 32 ARG HA H 32 4.066 4.066 4.041 0.025 25934
287 1 3 . 1 1 32 32 ARG H H 32 7.975 7.975 7.667 0.308 25934
288 1 3 . 1 1 33 33 SER N N 33 115.082 115.082 112.014 3.068 25934
289 1 3 . 1 1 33 33 SER HA H 33 4.327 4.327 4.591 -0.264 25934
290 1 3 . 1 1 33 33 SER H H 33 7.754 7.754 7.249 0.505 25934
291 1 3 . 1 1 34 34 ARG N N 34 121.862 121.862 120.233 1.629 25934
292 1 3 . 1 1 34 34 ARG HA H 34 4.190 4.190 4.115 0.075 25934
293 1 3 . 1 1 34 34 ARG H H 34 7.558 7.558 7.461 0.097 25934
294 1 3 . 1 1 35 35 ARG N N 35 121.550 121.550 120.216 1.334 25934
295 1 3 . 1 1 35 35 ARG HA H 35 4.284 4.284 4.100 0.184 25934
296 1 3 . 1 1 35 35 ARG H H 35 8.030 8.030 7.674 0.356 25934
297 1 3 . 1 1 36 36 GLU N N 36 122.012 122.012 118.505 3.507 25934
298 1 3 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.374 -0.056 25934
299 1 3 . 1 1 36 36 GLU H H 36 8.274 8.274 8.403 -0.129 25934
300 1 3 . 1 1 37 37 GLN N N 37 121.601 121.601 118.719 2.882 25934
301 1 3 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.539 -0.270 25934
302 1 3 . 1 1 37 37 GLN H H 37 8.238 8.238 7.311 0.927 25934
303 1 3 . 1 1 38 38 LYS N N 38 124.607 124.607 120.753 3.854 25934
304 1 3 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.736 -0.141 25934
305 1 3 . 1 1 38 38 LYS H H 38 8.348 8.348 8.378 -0.030 25934
306 1 3 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.227 0.189 25934
307 1 3 . 1 1 40 40 HIS N N 40 120.882 120.882 113.365 7.517 25934
308 1 3 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.552 0.087 25934
309 1 3 . 1 1 40 40 HIS H H 40 8.565 8.565 7.998 0.567 25934
310 1 4 . 1 1 5 5 VAL N N 5 122.612 122.612 122.308 0.304 25934
311 1 4 . 1 1 5 5 VAL HA H 5 4.134 4.134 4.098 0.036 25934
312 1 4 . 1 1 5 5 VAL H H 5 8.326 8.326 8.142 0.184 25934
313 1 4 . 1 1 6 6 GLN N N 6 125.548 125.548 125.172 0.376 25934
314 1 4 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.672 -0.218 25934
315 1 4 . 1 1 6 6 GLN H H 6 8.635 8.635 8.611 0.024 25934
316 1 4 . 1 1 7 7 THR N N 7 116.430 116.430 117.313 -0.883 25934
317 1 4 . 1 1 7 7 THR HA H 7 4.394 4.394 4.456 -0.062 25934
318 1 4 . 1 1 7 7 THR H H 7 8.307 8.307 8.769 -0.462 25934
319 1 4 . 1 1 8 8 SER N N 8 118.551 118.551 120.808 -2.257 25934
320 1 4 . 1 1 8 8 SER HA H 8 4.467 4.467 4.158 0.309 25934
321 1 4 . 1 1 8 8 SER H H 8 8.345 8.345 8.793 -0.449 25934
322 1 4 . 1 1 9 9 GLN N N 9 123.019 123.019 119.776 3.243 25934
323 1 4 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.321 -0.041 25934
324 1 4 . 1 1 9 9 GLN H H 9 8.338 8.338 7.758 0.580 25934
325 1 4 . 1 1 10 10 LYS N N 10 123.679 123.679 123.471 0.208 25934
326 1 4 . 1 1 10 10 LYS HA H 10 4.199 4.199 4.106 0.093 25934
327 1 4 . 1 1 10 10 LYS H H 10 8.258 8.258 8.378 -0.120 25934
328 1 4 . 1 1 11 11 SER N N 11 115.557 115.557 117.776 -2.219 25934
329 1 4 . 1 1 11 11 SER HA H 11 4.534 4.534 4.723 -0.189 25934
330 1 4 . 1 1 11 11 SER H H 11 7.659 7.659 7.615 0.044 25934
331 1 4 . 1 1 12 12 TYR N N 12 122.532 122.532 125.855 -3.323 25934
332 1 4 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.256 -0.036 25934
333 1 4 . 1 1 12 12 TYR H H 12 8.585 8.585 8.871 -0.286 25934
334 1 4 . 1 1 13 13 VAL N N 13 123.674 123.674 124.739 -1.065 25934
335 1 4 . 1 1 13 13 VAL HA H 13 4.801 4.801 4.909 -0.108 25934
336 1 4 . 1 1 13 13 VAL H H 13 8.253 8.253 8.271 -0.018 25934
337 1 4 . 1 1 14 14 CYS N N 14 131.181 131.181 129.357 1.824 25934
338 1 4 . 1 1 14 14 CYS HA H 14 5.078 5.078 4.961 0.117 25934
339 1 4 . 1 1 14 14 CYS H H 14 9.362 9.362 9.191 0.171 25934
340 1 4 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.322 -1.864 25934
341 1 4 . 1 1 16 16 ASN N N 16 119.946 119.946 115.107 4.839 25934
342 1 4 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.700 0.189 25934
343 1 4 . 1 1 16 16 ASN H H 16 9.104 9.104 8.217 0.887 25934
344 1 4 . 1 1 17 17 CYS N N 17 117.298 117.298 115.226 2.072 25934
345 1 4 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.894 0.242 25934
346 1 4 . 1 1 17 17 CYS H H 17 8.202 8.202 7.668 0.534 25934
347 1 4 . 1 1 18 18 GLY N N 18 113.723 113.723 109.813 3.910 25934
348 1 4 . 1 1 18 18 GLY H H 18 8.092 8.092 8.737 -0.645 25934
349 1 4 . 1 1 19 19 LYS N N 19 124.529 124.529 121.066 3.463 25934
350 1 4 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.355 -0.392 25934
351 1 4 . 1 1 19 19 LYS H H 19 8.396 8.396 7.721 0.675 25934
352 1 4 . 1 1 20 20 ILE N N 20 122.902 122.902 126.232 -3.330 25934
353 1 4 . 1 1 20 20 ILE HA H 20 4.619 4.619 4.934 -0.315 25934
354 1 4 . 1 1 20 20 ILE H H 20 7.793 7.793 8.277 -0.484 25934
355 1 4 . 1 1 21 21 PHE N N 21 126.244 126.244 127.418 -1.174 25934
356 1 4 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.947 -0.187 25934
357 1 4 . 1 1 21 21 PHE H H 21 9.361 9.361 9.210 0.151 25934
358 1 4 . 1 1 22 22 ARG N N 22 125.051 125.051 120.854 4.197 25934
359 1 4 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.515 -0.108 25934
360 1 4 . 1 1 22 22 ARG H H 22 9.016 9.016 8.699 0.317 25934
361 1 4 . 1 1 23 23 TRP N N 23 118.871 118.871 117.103 1.768 25934
362 1 4 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.961 0.367 25934
363 1 4 . 1 1 23 23 TRP H H 23 7.986 7.986 7.737 0.249 25934
364 1 4 . 1 1 24 24 ARG N N 24 130.190 130.190 121.891 8.299 25934
365 1 4 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.660 -0.619 25934
366 1 4 . 1 1 24 24 ARG H H 24 9.358 9.358 8.953 0.405 25934
367 1 4 . 1 1 25 25 VAL N N 25 115.735 115.735 118.028 -2.293 25934
368 1 4 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.745 0.057 25934
369 1 4 . 1 1 25 25 VAL H H 25 8.598 8.598 8.299 0.299 25934
370 1 4 . 1 1 26 26 ASN N N 26 119.272 119.272 117.926 1.346 25934
371 1 4 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.468 0.145 25934
372 1 4 . 1 1 26 26 ASN H H 26 6.907 6.907 8.487 -1.580 25934
373 1 4 . 1 1 27 27 PHE N N 27 124.971 124.971 122.854 2.117 25934
374 1 4 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.144 -0.131 25934
375 1 4 . 1 1 27 27 PHE H H 27 7.487 7.487 7.269 0.218 25934
376 1 4 . 1 1 28 28 ILE N N 28 119.280 119.280 118.715 0.565 25934
377 1 4 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.396 -0.119 25934
378 1 4 . 1 1 28 28 ILE H H 28 8.458 8.458 8.600 -0.142 25934
379 1 4 . 1 1 29 29 ARG N N 29 119.668 119.668 120.630 -0.962 25934
380 1 4 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.811 0.089 25934
381 1 4 . 1 1 29 29 ARG H H 29 7.577 7.577 8.084 -0.507 25934
382 1 4 . 1 1 30 30 HIS N N 30 120.050 120.050 119.744 0.306 25934
383 1 4 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.271 -0.013 25934
384 1 4 . 1 1 30 30 HIS H H 30 7.620 7.620 7.752 -0.132 25934
385 1 4 . 1 1 31 31 LEU N N 31 120.143 120.143 116.596 3.547 25934
386 1 4 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.740 0.033 25934
387 1 4 . 1 1 31 31 LEU H H 31 8.005 8.005 7.869 0.136 25934
388 1 4 . 1 1 32 32 ARG N N 32 118.157 118.157 118.251 -0.094 25934
389 1 4 . 1 1 32 32 ARG HA H 32 4.066 4.066 3.952 0.114 25934
390 1 4 . 1 1 32 32 ARG H H 32 7.975 7.975 8.009 -0.034 25934
391 1 4 . 1 1 33 33 SER N N 33 115.082 115.082 112.729 2.353 25934
392 1 4 . 1 1 33 33 SER HA H 33 4.327 4.327 4.466 -0.139 25934
393 1 4 . 1 1 33 33 SER H H 33 7.754 7.754 7.860 -0.106 25934
394 1 4 . 1 1 34 34 ARG N N 34 121.862 121.862 122.901 -1.039 25934
395 1 4 . 1 1 34 34 ARG HA H 34 4.190 4.190 4.024 0.166 25934
396 1 4 . 1 1 34 34 ARG H H 34 7.558 7.558 7.343 0.215 25934
397 1 4 . 1 1 35 35 ARG N N 35 121.550 121.550 124.667 -3.117 25934
398 1 4 . 1 1 35 35 ARG HA H 35 4.284 4.284 4.514 -0.230 25934
399 1 4 . 1 1 35 35 ARG H H 35 8.030 8.030 8.467 -0.437 25934
400 1 4 . 1 1 36 36 GLU N N 36 122.012 122.012 122.644 -0.632 25934
401 1 4 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.414 -0.096 25934
402 1 4 . 1 1 36 36 GLU H H 36 8.274 8.274 8.295 -0.021 25934
403 1 4 . 1 1 37 37 GLN N N 37 121.601 121.601 120.955 0.646 25934
404 1 4 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.099 0.170 25934
405 1 4 . 1 1 37 37 GLN H H 37 8.238 8.238 8.084 0.154 25934
406 1 4 . 1 1 38 38 LYS N N 38 124.607 124.607 119.738 4.869 25934
407 1 4 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.713 -0.118 25934
408 1 4 . 1 1 38 38 LYS H H 38 8.348 8.348 8.379 -0.031 25934
409 1 4 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.720 -0.304 25934
410 1 4 . 1 1 40 40 HIS N N 40 120.882 120.882 117.371 3.511 25934
411 1 4 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.072 0.567 25934
412 1 4 . 1 1 40 40 HIS H H 40 8.565 8.565 8.488 0.077 25934
413 1 5 . 1 1 5 5 VAL N N 5 122.612 122.612 121.371 1.241 25934
414 1 5 . 1 1 5 5 VAL HA H 5 4.134 4.134 3.971 0.163 25934
415 1 5 . 1 1 5 5 VAL H H 5 8.326 8.326 7.433 0.893 25934
416 1 5 . 1 1 6 6 GLN N N 6 125.548 125.548 127.140 -1.592 25934
417 1 5 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.322 0.132 25934
418 1 5 . 1 1 6 6 GLN H H 6 8.635 8.635 8.542 0.093 25934
419 1 5 . 1 1 7 7 THR N N 7 116.430 116.430 119.801 -3.371 25934
420 1 5 . 1 1 7 7 THR HA H 7 4.394 4.394 4.362 0.032 25934
421 1 5 . 1 1 7 7 THR H H 7 8.307 8.307 7.934 0.373 25934
422 1 5 . 1 1 8 8 SER N N 8 118.551 118.551 120.869 -2.318 25934
423 1 5 . 1 1 8 8 SER HA H 8 4.467 4.467 4.348 0.119 25934
424 1 5 . 1 1 8 8 SER H H 8 8.345 8.345 8.883 -0.538 25934
425 1 5 . 1 1 9 9 GLN N N 9 123.019 123.019 119.969 3.050 25934
426 1 5 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.044 0.236 25934
427 1 5 . 1 1 9 9 GLN H H 9 8.338 8.338 7.377 0.961 25934
428 1 5 . 1 1 10 10 LYS N N 10 123.679 123.679 118.323 5.356 25934
429 1 5 . 1 1 10 10 LYS HA H 10 4.199 4.199 4.111 0.088 25934
430 1 5 . 1 1 10 10 LYS H H 10 8.258 8.258 7.312 0.946 25934
431 1 5 . 1 1 11 11 SER N N 11 115.557 115.557 116.164 -0.607 25934
432 1 5 . 1 1 11 11 SER HA H 11 4.534 4.534 4.395 0.139 25934
433 1 5 . 1 1 11 11 SER H H 11 7.659 7.659 7.384 0.275 25934
434 1 5 . 1 1 12 12 TYR N N 12 122.532 122.532 121.358 1.174 25934
435 1 5 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.338 -0.118 25934
436 1 5 . 1 1 12 12 TYR H H 12 8.585 8.585 6.956 1.629 25934
437 1 5 . 1 1 13 13 VAL N N 13 123.674 123.674 124.639 -0.965 25934
438 1 5 . 1 1 13 13 VAL HA H 13 4.801 4.801 5.054 -0.253 25934
439 1 5 . 1 1 13 13 VAL H H 13 8.253 8.253 8.377 -0.124 25934
440 1 5 . 1 1 14 14 CYS N N 14 131.181 131.181 129.097 2.084 25934
441 1 5 . 1 1 14 14 CYS HA H 14 5.078 5.078 4.982 0.096 25934
442 1 5 . 1 1 14 14 CYS H H 14 9.362 9.362 9.359 0.003 25934
443 1 5 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.379 -1.921 25934
444 1 5 . 1 1 16 16 ASN N N 16 119.946 119.946 114.742 5.204 25934
445 1 5 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.702 0.187 25934
446 1 5 . 1 1 16 16 ASN H H 16 9.104 9.104 8.314 0.790 25934
447 1 5 . 1 1 17 17 CYS N N 17 117.298 117.298 116.103 1.195 25934
448 1 5 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.907 0.229 25934
449 1 5 . 1 1 17 17 CYS H H 17 8.202 8.202 7.786 0.416 25934
450 1 5 . 1 1 18 18 GLY N N 18 113.723 113.723 109.256 4.467 25934
451 1 5 . 1 1 18 18 GLY H H 18 8.092 8.092 8.719 -0.627 25934
452 1 5 . 1 1 19 19 LYS N N 19 124.529 124.529 121.009 3.520 25934
453 1 5 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.346 -0.383 25934
454 1 5 . 1 1 19 19 LYS H H 19 8.396 8.396 7.784 0.613 25934
455 1 5 . 1 1 20 20 ILE N N 20 122.902 122.902 125.867 -2.965 25934
456 1 5 . 1 1 20 20 ILE HA H 20 4.619 4.619 5.074 -0.455 25934
457 1 5 . 1 1 20 20 ILE H H 20 7.793 7.793 8.209 -0.416 25934
458 1 5 . 1 1 21 21 PHE N N 21 126.244 126.244 127.263 -1.019 25934
459 1 5 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.853 -0.093 25934
460 1 5 . 1 1 21 21 PHE H H 21 9.361 9.361 9.155 0.206 25934
461 1 5 . 1 1 22 22 ARG N N 22 125.051 125.051 121.992 3.059 25934
462 1 5 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.160 0.247 25934
463 1 5 . 1 1 22 22 ARG H H 22 9.016 9.016 8.618 0.398 25934
464 1 5 . 1 1 23 23 TRP N N 23 118.871 118.871 117.387 1.484 25934
465 1 5 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.942 0.386 25934
466 1 5 . 1 1 23 23 TRP H H 23 7.986 7.986 7.900 0.086 25934
467 1 5 . 1 1 24 24 ARG N N 24 130.190 130.190 122.647 7.543 25934
468 1 5 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.842 -0.801 25934
469 1 5 . 1 1 24 24 ARG H H 24 9.358 9.358 8.976 0.382 25934
470 1 5 . 1 1 25 25 VAL N N 25 115.735 115.735 118.428 -2.693 25934
471 1 5 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.860 -0.058 25934
472 1 5 . 1 1 25 25 VAL H H 25 8.598 8.598 8.312 0.286 25934
473 1 5 . 1 1 26 26 ASN N N 26 119.272 119.272 117.687 1.585 25934
474 1 5 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.526 0.087 25934
475 1 5 . 1 1 26 26 ASN H H 26 6.907 6.907 8.460 -1.553 25934
476 1 5 . 1 1 27 27 PHE N N 27 124.971 124.971 122.661 2.310 25934
477 1 5 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.324 -0.311 25934
478 1 5 . 1 1 27 27 PHE H H 27 7.487 7.487 7.469 0.018 25934
479 1 5 . 1 1 28 28 ILE N N 28 119.280 119.280 118.464 0.816 25934
480 1 5 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.455 -0.178 25934
481 1 5 . 1 1 28 28 ILE H H 28 8.458 8.458 8.648 -0.190 25934
482 1 5 . 1 1 29 29 ARG N N 29 119.668 119.668 120.344 -0.676 25934
483 1 5 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.856 0.044 25934
484 1 5 . 1 1 29 29 ARG H H 29 7.577 7.577 7.779 -0.202 25934
485 1 5 . 1 1 30 30 HIS N N 30 120.050 120.050 119.095 0.955 25934
486 1 5 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.252 0.006 25934
487 1 5 . 1 1 30 30 HIS H H 30 7.620 7.620 7.637 -0.017 25934
488 1 5 . 1 1 31 31 LEU N N 31 120.143 120.143 117.757 2.386 25934
489 1 5 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.821 -0.048 25934
490 1 5 . 1 1 31 31 LEU H H 31 8.005 8.005 7.899 0.106 25934
491 1 5 . 1 1 32 32 ARG N N 32 118.157 118.157 119.549 -1.392 25934
492 1 5 . 1 1 32 32 ARG HA H 32 4.066 4.066 3.997 0.070 25934
493 1 5 . 1 1 32 32 ARG H H 32 7.975 7.975 8.405 -0.430 25934
494 1 5 . 1 1 33 33 SER N N 33 115.082 115.082 113.219 1.863 25934
495 1 5 . 1 1 33 33 SER HA H 33 4.327 4.327 4.388 -0.061 25934
496 1 5 . 1 1 33 33 SER H H 33 7.754 7.754 7.505 0.249 25934
497 1 5 . 1 1 34 34 ARG N N 34 121.862 121.862 121.815 0.047 25934
498 1 5 . 1 1 34 34 ARG HA H 34 4.190 4.190 4.229 -0.039 25934
499 1 5 . 1 1 34 34 ARG H H 34 7.558 7.558 7.357 0.201 25934
500 1 5 . 1 1 35 35 ARG N N 35 121.550 121.550 120.668 0.882 25934
501 1 5 . 1 1 35 35 ARG HA H 35 4.284 4.284 4.116 0.168 25934
502 1 5 . 1 1 35 35 ARG H H 35 8.030 8.030 7.548 0.482 25934
503 1 5 . 1 1 36 36 GLU N N 36 122.012 122.012 117.720 4.292 25934
504 1 5 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.469 -0.151 25934
505 1 5 . 1 1 36 36 GLU H H 36 8.274 8.274 7.840 0.434 25934
506 1 5 . 1 1 37 37 GLN N N 37 121.601 121.601 120.064 1.537 25934
507 1 5 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.504 -0.235 25934
508 1 5 . 1 1 37 37 GLN H H 37 8.238 8.238 7.587 0.651 25934
509 1 5 . 1 1 38 38 LYS N N 38 124.607 124.607 119.786 4.821 25934
510 1 5 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.736 -0.141 25934
511 1 5 . 1 1 38 38 LYS H H 38 8.348 8.348 8.290 0.058 25934
512 1 5 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.238 0.178 25934
513 1 5 . 1 1 40 40 HIS N N 40 120.882 120.882 113.387 7.495 25934
514 1 5 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.536 0.103 25934
515 1 5 . 1 1 40 40 HIS H H 40 8.565 8.565 7.875 0.690 25934
516 1 6 . 1 1 5 5 VAL N N 5 122.612 122.612 115.414 7.198 25934
517 1 6 . 1 1 5 5 VAL HA H 5 4.134 4.134 3.519 0.615 25934
518 1 6 . 1 1 5 5 VAL H H 5 8.326 8.326 8.535 -0.209 25934
519 1 6 . 1 1 6 6 GLN N N 6 125.548 125.548 119.693 5.855 25934
520 1 6 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.151 0.303 25934
521 1 6 . 1 1 6 6 GLN H H 6 8.635 8.635 8.192 0.443 25934
522 1 6 . 1 1 7 7 THR N N 7 116.430 116.430 115.540 0.890 25934
523 1 6 . 1 1 7 7 THR HA H 7 4.394 4.394 4.084 0.310 25934
524 1 6 . 1 1 7 7 THR H H 7 8.307 8.307 8.268 0.039 25934
525 1 6 . 1 1 8 8 SER N N 8 118.551 118.551 112.358 6.193 25934
526 1 6 . 1 1 8 8 SER HA H 8 4.467 4.467 4.042 0.425 25934
527 1 6 . 1 1 8 8 SER H H 8 8.345 8.345 8.268 0.077 25934
528 1 6 . 1 1 9 9 GLN N N 9 123.019 123.019 119.545 3.474 25934
529 1 6 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.139 0.141 25934
530 1 6 . 1 1 9 9 GLN H H 9 8.338 8.338 8.455 -0.117 25934
531 1 6 . 1 1 10 10 LYS N N 10 123.679 123.679 115.819 7.860 25934
532 1 6 . 1 1 10 10 LYS HA H 10 4.199 4.199 4.133 0.066 25934
533 1 6 . 1 1 10 10 LYS H H 10 8.258 8.258 7.627 0.631 25934
534 1 6 . 1 1 11 11 SER N N 11 115.557 115.557 117.565 -2.008 25934
535 1 6 . 1 1 11 11 SER HA H 11 4.534 4.534 4.448 0.086 25934
536 1 6 . 1 1 11 11 SER H H 11 7.659 7.659 7.902 -0.243 25934
537 1 6 . 1 1 12 12 TYR N N 12 122.532 122.532 126.664 -4.132 25934
538 1 6 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.271 -0.051 25934
539 1 6 . 1 1 12 12 TYR H H 12 8.585 8.585 8.666 -0.081 25934
540 1 6 . 1 1 13 13 VAL N N 13 123.674 123.674 125.326 -1.652 25934
541 1 6 . 1 1 13 13 VAL HA H 13 4.801 4.801 4.908 -0.107 25934
542 1 6 . 1 1 13 13 VAL H H 13 8.253 8.253 8.378 -0.125 25934
543 1 6 . 1 1 14 14 CYS N N 14 131.181 131.181 129.430 1.751 25934
544 1 6 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.118 -0.040 25934
545 1 6 . 1 1 14 14 CYS H H 14 9.362 9.362 9.287 0.075 25934
546 1 6 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.335 -1.877 25934
547 1 6 . 1 1 16 16 ASN N N 16 119.946 119.946 115.582 4.364 25934
548 1 6 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.704 0.185 25934
549 1 6 . 1 1 16 16 ASN H H 16 9.104 9.104 8.570 0.534 25934
550 1 6 . 1 1 17 17 CYS N N 17 117.298 117.298 116.492 0.806 25934
551 1 6 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.690 0.446 25934
552 1 6 . 1 1 17 17 CYS H H 17 8.202 8.202 8.067 0.135 25934
553 1 6 . 1 1 18 18 GLY N N 18 113.723 113.723 109.710 4.013 25934
554 1 6 . 1 1 18 18 GLY H H 18 8.092 8.092 8.602 -0.510 25934
555 1 6 . 1 1 19 19 LYS N N 19 124.529 124.529 120.885 3.644 25934
556 1 6 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.329 -0.366 25934
557 1 6 . 1 1 19 19 LYS H H 19 8.396 8.396 7.680 0.716 25934
558 1 6 . 1 1 20 20 ILE N N 20 122.902 122.902 126.232 -3.330 25934
559 1 6 . 1 1 20 20 ILE HA H 20 4.619 4.619 5.112 -0.493 25934
560 1 6 . 1 1 20 20 ILE H H 20 7.793 7.793 8.171 -0.378 25934
561 1 6 . 1 1 21 21 PHE N N 21 126.244 126.244 128.207 -1.963 25934
562 1 6 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.940 -0.180 25934
563 1 6 . 1 1 21 21 PHE H H 21 9.361 9.361 9.361 -0.000 25934
564 1 6 . 1 1 22 22 ARG N N 22 125.051 125.051 120.645 4.406 25934
565 1 6 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.439 -0.032 25934
566 1 6 . 1 1 22 22 ARG H H 22 9.016 9.016 8.587 0.429 25934
567 1 6 . 1 1 23 23 TRP N N 23 118.871 118.871 117.190 1.681 25934
568 1 6 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.985 0.343 25934
569 1 6 . 1 1 23 23 TRP H H 23 7.986 7.986 7.577 0.409 25934
570 1 6 . 1 1 24 24 ARG N N 24 130.190 130.190 123.485 6.705 25934
571 1 6 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.461 -0.420 25934
572 1 6 . 1 1 24 24 ARG H H 24 9.358 9.358 9.001 0.357 25934
573 1 6 . 1 1 25 25 VAL N N 25 115.735 115.735 118.426 -2.691 25934
574 1 6 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.785 0.017 25934
575 1 6 . 1 1 25 25 VAL H H 25 8.598 8.598 8.223 0.375 25934
576 1 6 . 1 1 26 26 ASN N N 26 119.272 119.272 117.608 1.664 25934
577 1 6 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.470 0.143 25934
578 1 6 . 1 1 26 26 ASN H H 26 6.907 6.907 8.387 -1.480 25934
579 1 6 . 1 1 27 27 PHE N N 27 124.971 124.971 122.881 2.090 25934
580 1 6 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.129 -0.116 25934
581 1 6 . 1 1 27 27 PHE H H 27 7.487 7.487 7.451 0.036 25934
582 1 6 . 1 1 28 28 ILE N N 28 119.280 119.280 118.446 0.834 25934
583 1 6 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.412 -0.135 25934
584 1 6 . 1 1 28 28 ILE H H 28 8.458 8.458 8.490 -0.032 25934
585 1 6 . 1 1 29 29 ARG N N 29 119.668 119.668 120.257 -0.589 25934
586 1 6 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.814 0.086 25934
587 1 6 . 1 1 29 29 ARG H H 29 7.577 7.577 7.647 -0.070 25934
588 1 6 . 1 1 30 30 HIS N N 30 120.050 120.050 119.222 0.828 25934
589 1 6 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.294 -0.036 25934
590 1 6 . 1 1 30 30 HIS H H 30 7.620 7.620 7.664 -0.044 25934
591 1 6 . 1 1 31 31 LEU N N 31 120.143 120.143 117.245 2.898 25934
592 1 6 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.750 0.023 25934
593 1 6 . 1 1 31 31 LEU H H 31 8.005 8.005 7.861 0.144 25934
594 1 6 . 1 1 32 32 ARG N N 32 118.157 118.157 116.821 1.336 25934
595 1 6 . 1 1 32 32 ARG HA H 32 4.066 4.066 4.074 -0.008 25934
596 1 6 . 1 1 32 32 ARG H H 32 7.975 7.975 7.885 0.090 25934
597 1 6 . 1 1 33 33 SER N N 33 115.082 115.082 111.693 3.389 25934
598 1 6 . 1 1 33 33 SER HA H 33 4.327 4.327 4.463 -0.136 25934
599 1 6 . 1 1 33 33 SER H H 33 7.754 7.754 7.561 0.193 25934
600 1 6 . 1 1 34 34 ARG N N 34 121.862 121.862 117.695 4.167 25934
601 1 6 . 1 1 34 34 ARG HA H 34 4.190 4.190 3.563 0.627 25934
602 1 6 . 1 1 34 34 ARG H H 34 7.558 7.558 8.168 -0.610 25934
603 1 6 . 1 1 35 35 ARG N N 35 121.550 121.550 121.383 0.167 25934
604 1 6 . 1 1 35 35 ARG HA H 35 4.284 4.284 4.445 -0.161 25934
605 1 6 . 1 1 35 35 ARG H H 35 8.030 8.030 7.951 0.079 25934
606 1 6 . 1 1 36 36 GLU N N 36 122.012 122.012 125.238 -3.226 25934
607 1 6 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.339 -0.021 25934
608 1 6 . 1 1 36 36 GLU H H 36 8.274 8.274 8.894 -0.620 25934
609 1 6 . 1 1 37 37 GLN N N 37 121.601 121.601 118.451 3.150 25934
610 1 6 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.560 -0.291 25934
611 1 6 . 1 1 37 37 GLN H H 37 8.238 8.238 8.043 0.195 25934
612 1 6 . 1 1 38 38 LYS N N 38 124.607 124.607 123.441 1.166 25934
613 1 6 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.513 0.082 25934
614 1 6 . 1 1 38 38 LYS H H 38 8.348 8.348 8.641 -0.293 25934
615 1 6 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.321 0.095 25934
616 1 6 . 1 1 40 40 HIS N N 40 120.882 120.882 118.529 2.353 25934
617 1 6 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.642 -0.003 25934
618 1 6 . 1 1 40 40 HIS H H 40 8.565 8.565 8.094 0.471 25934
619 1 7 . 1 1 5 5 VAL N N 5 122.612 122.612 120.660 1.952 25934
620 1 7 . 1 1 5 5 VAL HA H 5 4.134 4.134 4.105 0.029 25934
621 1 7 . 1 1 5 5 VAL H H 5 8.326 8.326 7.885 0.441 25934
622 1 7 . 1 1 6 6 GLN N N 6 125.548 125.548 125.478 0.070 25934
623 1 7 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.543 -0.089 25934
624 1 7 . 1 1 6 6 GLN H H 6 8.635 8.635 8.562 0.073 25934
625 1 7 . 1 1 7 7 THR N N 7 116.430 116.430 117.663 -1.233 25934
626 1 7 . 1 1 7 7 THR HA H 7 4.394 4.394 4.540 -0.146 25934
627 1 7 . 1 1 7 7 THR H H 7 8.307 8.307 8.524 -0.217 25934
628 1 7 . 1 1 8 8 SER N N 8 118.551 118.551 118.911 -0.360 25934
629 1 7 . 1 1 8 8 SER HA H 8 4.467 4.467 4.478 -0.011 25934
630 1 7 . 1 1 8 8 SER H H 8 8.345 8.345 8.089 0.256 25934
631 1 7 . 1 1 9 9 GLN N N 9 123.019 123.019 125.230 -2.211 25934
632 1 7 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.085 0.195 25934
633 1 7 . 1 1 9 9 GLN H H 9 8.338 8.338 8.589 -0.251 25934
634 1 7 . 1 1 10 10 LYS N N 10 123.679 123.679 116.614 7.065 25934
635 1 7 . 1 1 10 10 LYS HA H 10 4.199 4.199 4.217 -0.018 25934
636 1 7 . 1 1 10 10 LYS H H 10 8.258 8.258 7.892 0.366 25934
637 1 7 . 1 1 11 11 SER N N 11 115.557 115.557 114.246 1.311 25934
638 1 7 . 1 1 11 11 SER HA H 11 4.534 4.534 4.753 -0.219 25934
639 1 7 . 1 1 11 11 SER H H 11 7.659 7.659 7.330 0.329 25934
640 1 7 . 1 1 12 12 TYR N N 12 122.532 122.532 124.289 -1.757 25934
641 1 7 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.367 -0.147 25934
642 1 7 . 1 1 12 12 TYR H H 12 8.585 8.585 8.963 -0.378 25934
643 1 7 . 1 1 13 13 VAL N N 13 123.674 123.674 124.347 -0.673 25934
644 1 7 . 1 1 13 13 VAL HA H 13 4.801 4.801 5.224 -0.423 25934
645 1 7 . 1 1 13 13 VAL H H 13 8.253 8.253 8.331 -0.078 25934
646 1 7 . 1 1 14 14 CYS N N 14 131.181 131.181 129.160 2.021 25934
647 1 7 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.067 0.011 25934
648 1 7 . 1 1 14 14 CYS H H 14 9.362 9.362 9.233 0.129 25934
649 1 7 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.359 -1.901 25934
650 1 7 . 1 1 16 16 ASN N N 16 119.946 119.946 114.070 5.876 25934
651 1 7 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.692 0.197 25934
652 1 7 . 1 1 16 16 ASN H H 16 9.104 9.104 8.200 0.904 25934
653 1 7 . 1 1 17 17 CYS N N 17 117.298 117.298 115.665 1.633 25934
654 1 7 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.920 0.216 25934
655 1 7 . 1 1 17 17 CYS H H 17 8.202 8.202 7.805 0.397 25934
656 1 7 . 1 1 18 18 GLY N N 18 113.723 113.723 109.385 4.338 25934
657 1 7 . 1 1 18 18 GLY H H 18 8.092 8.092 8.703 -0.611 25934
658 1 7 . 1 1 19 19 LYS N N 19 124.529 124.529 120.999 3.530 25934
659 1 7 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.341 -0.378 25934
660 1 7 . 1 1 19 19 LYS H H 19 8.396 8.396 7.850 0.546 25934
661 1 7 . 1 1 20 20 ILE N N 20 122.902 122.902 121.490 1.412 25934
662 1 7 . 1 1 20 20 ILE HA H 20 4.619 4.619 5.386 -0.767 25934
663 1 7 . 1 1 20 20 ILE H H 20 7.793 7.793 7.862 -0.069 25934
664 1 7 . 1 1 21 21 PHE N N 21 126.244 126.244 125.254 0.990 25934
665 1 7 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.962 -0.202 25934
666 1 7 . 1 1 21 21 PHE H H 21 9.361 9.361 9.122 0.239 25934
667 1 7 . 1 1 22 22 ARG N N 22 125.051 125.051 121.944 3.107 25934
668 1 7 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.569 -0.162 25934
669 1 7 . 1 1 22 22 ARG H H 22 9.016 9.016 8.746 0.270 25934
670 1 7 . 1 1 23 23 TRP N N 23 118.871 118.871 117.449 1.422 25934
671 1 7 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.983 0.345 25934
672 1 7 . 1 1 23 23 TRP H H 23 7.986 7.986 7.931 0.055 25934
673 1 7 . 1 1 24 24 ARG N N 24 130.190 130.190 123.234 6.956 25934
674 1 7 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.499 -0.458 25934
675 1 7 . 1 1 24 24 ARG H H 24 9.358 9.358 8.977 0.381 25934
676 1 7 . 1 1 25 25 VAL N N 25 115.735 115.735 117.320 -1.585 25934
677 1 7 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.752 0.050 25934
678 1 7 . 1 1 25 25 VAL H H 25 8.598 8.598 8.247 0.351 25934
679 1 7 . 1 1 26 26 ASN N N 26 119.272 119.272 117.908 1.364 25934
680 1 7 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.482 0.131 25934
681 1 7 . 1 1 26 26 ASN H H 26 6.907 6.907 8.431 -1.524 25934
682 1 7 . 1 1 27 27 PHE N N 27 124.971 124.971 122.857 2.114 25934
683 1 7 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.188 -0.175 25934
684 1 7 . 1 1 27 27 PHE H H 27 7.487 7.487 7.432 0.055 25934
685 1 7 . 1 1 28 28 ILE N N 28 119.280 119.280 118.345 0.935 25934
686 1 7 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.394 -0.117 25934
687 1 7 . 1 1 28 28 ILE H H 28 8.458 8.458 8.546 -0.088 25934
688 1 7 . 1 1 29 29 ARG N N 29 119.668 119.668 120.408 -0.740 25934
689 1 7 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.830 0.070 25934
690 1 7 . 1 1 29 29 ARG H H 29 7.577 7.577 7.842 -0.265 25934
691 1 7 . 1 1 30 30 HIS N N 30 120.050 120.050 118.891 1.159 25934
692 1 7 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.322 -0.064 25934
693 1 7 . 1 1 30 30 HIS H H 30 7.620 7.620 7.916 -0.296 25934
694 1 7 . 1 1 31 31 LEU N N 31 120.143 120.143 117.978 2.165 25934
695 1 7 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.808 -0.035 25934
696 1 7 . 1 1 31 31 LEU H H 31 8.005 8.005 7.852 0.153 25934
697 1 7 . 1 1 32 32 ARG N N 32 118.157 118.157 117.776 0.381 25934
698 1 7 . 1 1 32 32 ARG HA H 32 4.066 4.066 4.021 0.045 25934
699 1 7 . 1 1 32 32 ARG H H 32 7.975 7.975 7.898 0.077 25934
700 1 7 . 1 1 33 33 SER N N 33 115.082 115.082 113.436 1.646 25934
701 1 7 . 1 1 33 33 SER HA H 33 4.327 4.327 4.271 0.056 25934
702 1 7 . 1 1 33 33 SER H H 33 7.754 7.754 7.414 0.340 25934
703 1 7 . 1 1 34 34 ARG N N 34 121.862 121.862 119.994 1.868 25934
704 1 7 . 1 1 34 34 ARG HA H 34 4.190 4.190 4.512 -0.322 25934
705 1 7 . 1 1 34 34 ARG H H 34 7.558 7.558 7.298 0.260 25934
706 1 7 . 1 1 35 35 ARG N N 35 121.550 121.550 124.664 -3.114 25934
707 1 7 . 1 1 35 35 ARG HA H 35 4.284 4.284 4.245 0.039 25934
708 1 7 . 1 1 35 35 ARG H H 35 8.030 8.030 8.462 -0.432 25934
709 1 7 . 1 1 36 36 GLU N N 36 122.012 122.012 118.080 3.932 25934
710 1 7 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.230 0.088 25934
711 1 7 . 1 1 36 36 GLU H H 36 8.274 8.274 7.577 0.697 25934
712 1 7 . 1 1 37 37 GLN N N 37 121.601 121.601 119.673 1.928 25934
713 1 7 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.285 -0.016 25934
714 1 7 . 1 1 37 37 GLN H H 37 8.238 8.238 7.713 0.525 25934
715 1 7 . 1 1 38 38 LYS N N 38 124.607 124.607 122.526 2.081 25934
716 1 7 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.506 0.089 25934
717 1 7 . 1 1 38 38 LYS H H 38 8.348 8.348 8.571 -0.223 25934
718 1 7 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.435 -0.019 25934
719 1 7 . 1 1 40 40 HIS N N 40 120.882 120.882 119.424 1.458 25934
720 1 7 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.420 0.219 25934
721 1 7 . 1 1 40 40 HIS H H 40 8.565 8.565 8.637 -0.072 25934
722 1 8 . 1 1 5 5 VAL N N 5 122.612 122.612 121.470 1.142 25934
723 1 8 . 1 1 5 5 VAL HA H 5 4.134 4.134 3.968 0.166 25934
724 1 8 . 1 1 5 5 VAL H H 5 8.326 8.326 7.552 0.774 25934
725 1 8 . 1 1 6 6 GLN N N 6 125.548 125.548 128.176 -2.628 25934
726 1 8 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.215 0.239 25934
727 1 8 . 1 1 6 6 GLN H H 6 8.635 8.635 8.704 -0.069 25934
728 1 8 . 1 1 7 7 THR N N 7 116.430 116.430 118.082 -1.652 25934
729 1 8 . 1 1 7 7 THR HA H 7 4.394 4.394 4.467 -0.073 25934
730 1 8 . 1 1 7 7 THR H H 7 8.307 8.307 7.833 0.474 25934
731 1 8 . 1 1 8 8 SER N N 8 118.551 118.551 119.544 -0.993 25934
732 1 8 . 1 1 8 8 SER HA H 8 4.467 4.467 4.568 -0.101 25934
733 1 8 . 1 1 8 8 SER H H 8 8.345 8.345 8.811 -0.466 25934
734 1 8 . 1 1 9 9 GLN N N 9 123.019 123.019 120.930 2.089 25934
735 1 8 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.113 0.167 25934
736 1 8 . 1 1 9 9 GLN H H 9 8.338 8.338 7.345 0.993 25934
737 1 8 . 1 1 10 10 LYS N N 10 123.679 123.679 117.435 6.244 25934
738 1 8 . 1 1 10 10 LYS HA H 10 4.199 4.199 4.102 0.097 25934
739 1 8 . 1 1 10 10 LYS H H 10 8.258 8.258 7.668 0.590 25934
740 1 8 . 1 1 11 11 SER N N 11 115.557 115.557 115.668 -0.111 25934
741 1 8 . 1 1 11 11 SER HA H 11 4.534 4.534 4.420 0.114 25934
742 1 8 . 1 1 11 11 SER H H 11 7.659 7.659 7.474 0.185 25934
743 1 8 . 1 1 12 12 TYR N N 12 122.532 122.532 120.706 1.826 25934
744 1 8 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.371 -0.151 25934
745 1 8 . 1 1 12 12 TYR H H 12 8.585 8.585 7.007 1.578 25934
746 1 8 . 1 1 13 13 VAL N N 13 123.674 123.674 124.191 -0.517 25934
747 1 8 . 1 1 13 13 VAL HA H 13 4.801 4.801 5.011 -0.210 25934
748 1 8 . 1 1 13 13 VAL H H 13 8.253 8.253 8.436 -0.183 25934
749 1 8 . 1 1 14 14 CYS N N 14 131.181 131.181 129.106 2.075 25934
750 1 8 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.048 0.030 25934
751 1 8 . 1 1 14 14 CYS H H 14 9.362 9.362 9.258 0.104 25934
752 1 8 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.390 -1.932 25934
753 1 8 . 1 1 16 16 ASN N N 16 119.946 119.946 115.921 4.025 25934
754 1 8 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.690 0.199 25934
755 1 8 . 1 1 16 16 ASN H H 16 9.104 9.104 8.305 0.799 25934
756 1 8 . 1 1 17 17 CYS N N 17 117.298 117.298 116.657 0.641 25934
757 1 8 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.825 0.311 25934
758 1 8 . 1 1 17 17 CYS H H 17 8.202 8.202 7.825 0.377 25934
759 1 8 . 1 1 18 18 GLY N N 18 113.723 113.723 109.650 4.073 25934
760 1 8 . 1 1 18 18 GLY H H 18 8.092 8.092 8.618 -0.526 25934
761 1 8 . 1 1 19 19 LYS N N 19 124.529 124.529 120.874 3.655 25934
762 1 8 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.447 -0.484 25934
763 1 8 . 1 1 19 19 LYS H H 19 8.396 8.396 7.652 0.744 25934
764 1 8 . 1 1 20 20 ILE N N 20 122.902 122.902 125.945 -3.043 25934
765 1 8 . 1 1 20 20 ILE HA H 20 4.619 4.619 5.110 -0.491 25934
766 1 8 . 1 1 20 20 ILE H H 20 7.793 7.793 8.331 -0.538 25934
767 1 8 . 1 1 21 21 PHE N N 21 126.244 126.244 127.040 -0.796 25934
768 1 8 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.873 -0.113 25934
769 1 8 . 1 1 21 21 PHE H H 21 9.361 9.361 9.198 0.163 25934
770 1 8 . 1 1 22 22 ARG N N 22 125.051 125.051 122.131 2.920 25934
771 1 8 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.078 0.329 25934
772 1 8 . 1 1 22 22 ARG H H 22 9.016 9.016 8.648 0.368 25934
773 1 8 . 1 1 23 23 TRP N N 23 118.871 118.871 116.928 1.943 25934
774 1 8 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.947 0.381 25934
775 1 8 . 1 1 23 23 TRP H H 23 7.986 7.986 7.779 0.207 25934
776 1 8 . 1 1 24 24 ARG N N 24 130.190 130.190 122.042 8.148 25934
777 1 8 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.693 -0.652 25934
778 1 8 . 1 1 24 24 ARG H H 24 9.358 9.358 8.931 0.427 25934
779 1 8 . 1 1 25 25 VAL N N 25 115.735 115.735 118.149 -2.414 25934
780 1 8 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.737 0.065 25934
781 1 8 . 1 1 25 25 VAL H H 25 8.598 8.598 8.301 0.297 25934
782 1 8 . 1 1 26 26 ASN N N 26 119.272 119.272 117.819 1.453 25934
783 1 8 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.468 0.145 25934
784 1 8 . 1 1 26 26 ASN H H 26 6.907 6.907 8.427 -1.520 25934
785 1 8 . 1 1 27 27 PHE N N 27 124.971 124.971 122.799 2.172 25934
786 1 8 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.362 -0.349 25934
787 1 8 . 1 1 27 27 PHE H H 27 7.487 7.487 7.425 0.062 25934
788 1 8 . 1 1 28 28 ILE N N 28 119.280 119.280 118.189 1.091 25934
789 1 8 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.485 -0.208 25934
790 1 8 . 1 1 28 28 ILE H H 28 8.458 8.458 8.661 -0.203 25934
791 1 8 . 1 1 29 29 ARG N N 29 119.668 119.668 120.319 -0.651 25934
792 1 8 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.864 0.036 25934
793 1 8 . 1 1 29 29 ARG H H 29 7.577 7.577 7.631 -0.054 25934
794 1 8 . 1 1 30 30 HIS N N 30 120.050 120.050 118.376 1.674 25934
795 1 8 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.299 -0.041 25934
796 1 8 . 1 1 30 30 HIS H H 30 7.620 7.620 7.966 -0.346 25934
797 1 8 . 1 1 31 31 LEU N N 31 120.143 120.143 119.845 0.298 25934
798 1 8 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.893 -0.120 25934
799 1 8 . 1 1 31 31 LEU H H 31 8.005 8.005 8.201 -0.196 25934
800 1 8 . 1 1 32 32 ARG N N 32 118.157 118.157 119.123 -0.966 25934
801 1 8 . 1 1 32 32 ARG HA H 32 4.066 4.066 3.999 0.067 25934
802 1 8 . 1 1 32 32 ARG H H 32 7.975 7.975 7.593 0.382 25934
803 1 8 . 1 1 33 33 SER N N 33 115.082 115.082 113.948 1.134 25934
804 1 8 . 1 1 33 33 SER HA H 33 4.327 4.327 4.490 -0.163 25934
805 1 8 . 1 1 33 33 SER H H 33 7.754 7.754 7.413 0.341 25934
806 1 8 . 1 1 34 34 ARG N N 34 121.862 121.862 121.774 0.088 25934
807 1 8 . 1 1 34 34 ARG HA H 34 4.190 4.190 4.160 0.030 25934
808 1 8 . 1 1 34 34 ARG H H 34 7.558 7.558 7.461 0.097 25934
809 1 8 . 1 1 35 35 ARG N N 35 121.550 121.550 119.141 2.409 25934
810 1 8 . 1 1 35 35 ARG HA H 35 4.284 4.284 4.137 0.147 25934
811 1 8 . 1 1 35 35 ARG H H 35 8.030 8.030 7.401 0.629 25934
812 1 8 . 1 1 36 36 GLU N N 36 122.012 122.012 118.667 3.345 25934
813 1 8 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.449 -0.131 25934
814 1 8 . 1 1 36 36 GLU H H 36 8.274 8.274 7.613 0.661 25934
815 1 8 . 1 1 37 37 GLN N N 37 121.601 121.601 119.327 2.274 25934
816 1 8 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.345 -0.076 25934
817 1 8 . 1 1 37 37 GLN H H 37 8.238 8.238 7.632 0.606 25934
818 1 8 . 1 1 38 38 LYS N N 38 124.607 124.607 120.292 4.315 25934
819 1 8 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.770 -0.175 25934
820 1 8 . 1 1 38 38 LYS H H 38 8.348 8.348 8.248 0.100 25934
821 1 8 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.282 0.134 25934
822 1 8 . 1 1 40 40 HIS N N 40 120.882 120.882 114.805 6.077 25934
823 1 8 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.543 0.096 25934
824 1 8 . 1 1 40 40 HIS H H 40 8.565 8.565 7.843 0.722 25934
825 1 9 . 1 1 5 5 VAL N N 5 122.612 122.612 126.196 -3.584 25934
826 1 9 . 1 1 5 5 VAL HA H 5 4.134 4.134 4.024 0.110 25934
827 1 9 . 1 1 5 5 VAL H H 5 8.326 8.326 8.704 -0.378 25934
828 1 9 . 1 1 6 6 GLN N N 6 125.548 125.548 129.081 -3.533 25934
829 1 9 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.338 0.116 25934
830 1 9 . 1 1 6 6 GLN H H 6 8.635 8.635 8.718 -0.083 25934
831 1 9 . 1 1 7 7 THR N N 7 116.430 116.430 115.572 0.858 25934
832 1 9 . 1 1 7 7 THR HA H 7 4.394 4.394 4.354 0.040 25934
833 1 9 . 1 1 7 7 THR H H 7 8.307 8.307 7.649 0.658 25934
834 1 9 . 1 1 8 8 SER N N 8 118.551 118.551 118.568 -0.017 25934
835 1 9 . 1 1 8 8 SER HA H 8 4.467 4.467 4.681 -0.214 25934
836 1 9 . 1 1 8 8 SER H H 8 8.345 8.345 8.560 -0.215 25934
837 1 9 . 1 1 9 9 GLN N N 9 123.019 123.019 119.019 4.000 25934
838 1 9 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.367 -0.087 25934
839 1 9 . 1 1 9 9 GLN H H 9 8.338 8.338 7.913 0.425 25934
840 1 9 . 1 1 10 10 LYS N N 10 123.679 123.679 124.380 -0.701 25934
841 1 9 . 1 1 10 10 LYS HA H 10 4.199 4.199 3.889 0.310 25934
842 1 9 . 1 1 10 10 LYS H H 10 8.258 8.258 7.708 0.550 25934
843 1 9 . 1 1 11 11 SER N N 11 115.557 115.557 116.727 -1.170 25934
844 1 9 . 1 1 11 11 SER HA H 11 4.534 4.534 4.720 -0.186 25934
845 1 9 . 1 1 11 11 SER H H 11 7.659 7.659 7.582 0.077 25934
846 1 9 . 1 1 12 12 TYR N N 12 122.532 122.532 124.031 -1.499 25934
847 1 9 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.201 0.019 25934
848 1 9 . 1 1 12 12 TYR H H 12 8.585 8.585 8.913 -0.328 25934
849 1 9 . 1 1 13 13 VAL N N 13 123.674 123.674 124.757 -1.083 25934
850 1 9 . 1 1 13 13 VAL HA H 13 4.801 4.801 5.210 -0.409 25934
851 1 9 . 1 1 13 13 VAL H H 13 8.253 8.253 8.400 -0.147 25934
852 1 9 . 1 1 14 14 CYS N N 14 131.181 131.181 129.430 1.751 25934
853 1 9 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.011 0.067 25934
854 1 9 . 1 1 14 14 CYS H H 14 9.362 9.362 9.340 0.022 25934
855 1 9 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.379 -1.921 25934
856 1 9 . 1 1 16 16 ASN N N 16 119.946 119.946 115.665 4.281 25934
857 1 9 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.681 0.208 25934
858 1 9 . 1 1 16 16 ASN H H 16 9.104 9.104 8.512 0.592 25934
859 1 9 . 1 1 17 17 CYS N N 17 117.298 117.298 115.596 1.702 25934
860 1 9 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.899 0.237 25934
861 1 9 . 1 1 17 17 CYS H H 17 8.202 8.202 7.806 0.396 25934
862 1 9 . 1 1 18 18 GLY N N 18 113.723 113.723 108.789 4.934 25934
863 1 9 . 1 1 18 18 GLY H H 18 8.092 8.092 8.642 -0.550 25934
864 1 9 . 1 1 19 19 LYS N N 19 124.529 124.529 120.809 3.720 25934
865 1 9 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.353 -0.390 25934
866 1 9 . 1 1 19 19 LYS H H 19 8.396 8.396 7.645 0.751 25934
867 1 9 . 1 1 20 20 ILE N N 20 122.902 122.902 125.545 -2.643 25934
868 1 9 . 1 1 20 20 ILE HA H 20 4.619 4.619 5.000 -0.381 25934
869 1 9 . 1 1 20 20 ILE H H 20 7.793 7.793 8.197 -0.404 25934
870 1 9 . 1 1 21 21 PHE N N 21 126.244 126.244 127.360 -1.116 25934
871 1 9 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.957 -0.197 25934
872 1 9 . 1 1 21 21 PHE H H 21 9.361 9.361 9.282 0.079 25934
873 1 9 . 1 1 22 22 ARG N N 22 125.051 125.051 120.809 4.242 25934
874 1 9 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.496 -0.089 25934
875 1 9 . 1 1 22 22 ARG H H 22 9.016 9.016 8.589 0.427 25934
876 1 9 . 1 1 23 23 TRP N N 23 118.871 118.871 117.199 1.672 25934
877 1 9 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.870 0.458 25934
878 1 9 . 1 1 23 23 TRP H H 23 7.986 7.986 7.543 0.443 25934
879 1 9 . 1 1 24 24 ARG N N 24 130.190 130.190 123.242 6.948 25934
880 1 9 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.662 -0.621 25934
881 1 9 . 1 1 24 24 ARG H H 24 9.358 9.358 8.806 0.552 25934
882 1 9 . 1 1 25 25 VAL N N 25 115.735 115.735 118.205 -2.470 25934
883 1 9 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.773 0.029 25934
884 1 9 . 1 1 25 25 VAL H H 25 8.598 8.598 8.232 0.366 25934
885 1 9 . 1 1 26 26 ASN N N 26 119.272 119.272 117.620 1.652 25934
886 1 9 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.465 0.148 25934
887 1 9 . 1 1 26 26 ASN H H 26 6.907 6.907 8.435 -1.528 25934
888 1 9 . 1 1 27 27 PHE N N 27 124.971 124.971 122.912 2.059 25934
889 1 9 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.112 -0.099 25934
890 1 9 . 1 1 27 27 PHE H H 27 7.487 7.487 7.352 0.135 25934
891 1 9 . 1 1 28 28 ILE N N 28 119.280 119.280 118.068 1.212 25934
892 1 9 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.390 -0.113 25934
893 1 9 . 1 1 28 28 ILE H H 28 8.458 8.458 8.538 -0.080 25934
894 1 9 . 1 1 29 29 ARG N N 29 119.668 119.668 119.885 -0.217 25934
895 1 9 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.877 0.023 25934
896 1 9 . 1 1 29 29 ARG H H 29 7.577 7.577 7.521 0.056 25934
897 1 9 . 1 1 30 30 HIS N N 30 120.050 120.050 118.434 1.616 25934
898 1 9 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.360 -0.102 25934
899 1 9 . 1 1 30 30 HIS H H 30 7.620 7.620 7.865 -0.245 25934
900 1 9 . 1 1 31 31 LEU N N 31 120.143 120.143 119.029 1.114 25934
901 1 9 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.767 0.006 25934
902 1 9 . 1 1 31 31 LEU H H 31 8.005 8.005 7.876 0.129 25934
903 1 9 . 1 1 32 32 ARG N N 32 118.157 118.157 116.466 1.691 25934
904 1 9 . 1 1 32 32 ARG HA H 32 4.066 4.066 4.049 0.017 25934
905 1 9 . 1 1 32 32 ARG H H 32 7.975 7.975 7.235 0.740 25934
906 1 9 . 1 1 33 33 SER N N 33 115.082 115.082 114.727 0.355 25934
907 1 9 . 1 1 33 33 SER HA H 33 4.327 4.327 5.012 -0.685 25934
908 1 9 . 1 1 33 33 SER H H 33 7.754 7.754 7.772 -0.018 25934
909 1 9 . 1 1 34 34 ARG N N 34 121.862 121.862 122.332 -0.470 25934
910 1 9 . 1 1 34 34 ARG HA H 34 4.190 4.190 4.441 -0.251 25934
911 1 9 . 1 1 34 34 ARG H H 34 7.558 7.558 7.508 0.050 25934
912 1 9 . 1 1 35 35 ARG N N 35 121.550 121.550 117.925 3.625 25934
913 1 9 . 1 1 35 35 ARG HA H 35 4.284 4.284 4.519 -0.235 25934
914 1 9 . 1 1 35 35 ARG H H 35 8.030 8.030 8.392 -0.362 25934
915 1 9 . 1 1 36 36 GLU N N 36 122.012 122.012 120.818 1.194 25934
916 1 9 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.240 0.078 25934
917 1 9 . 1 1 36 36 GLU H H 36 8.274 8.274 8.711 -0.437 25934
918 1 9 . 1 1 37 37 GLN N N 37 121.601 121.601 118.167 3.434 25934
919 1 9 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.529 -0.260 25934
920 1 9 . 1 1 37 37 GLN H H 37 8.238 8.238 8.144 0.094 25934
921 1 9 . 1 1 38 38 LYS N N 38 124.607 124.607 121.658 2.949 25934
922 1 9 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.723 -0.128 25934
923 1 9 . 1 1 38 38 LYS H H 38 8.348 8.348 7.935 0.413 25934
924 1 9 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.330 0.086 25934
925 1 9 . 1 1 40 40 HIS N N 40 120.882 120.882 124.257 -3.375 25934
926 1 9 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.759 -0.120 25934
927 1 9 . 1 1 40 40 HIS H H 40 8.565 8.565 8.702 -0.137 25934
928 1 10 . 1 1 5 5 VAL N N 5 122.612 122.612 121.874 0.738 25934
929 1 10 . 1 1 5 5 VAL HA H 5 4.134 4.134 4.028 0.106 25934
930 1 10 . 1 1 5 5 VAL H H 5 8.326 8.326 7.944 0.382 25934
931 1 10 . 1 1 6 6 GLN N N 6 125.548 125.548 128.359 -2.811 25934
932 1 10 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.272 0.182 25934
933 1 10 . 1 1 6 6 GLN H H 6 8.635 8.635 8.696 -0.061 25934
934 1 10 . 1 1 7 7 THR N N 7 116.430 116.430 118.451 -2.021 25934
935 1 10 . 1 1 7 7 THR HA H 7 4.394 4.394 4.400 -0.006 25934
936 1 10 . 1 1 7 7 THR H H 7 8.307 8.307 7.946 0.361 25934
937 1 10 . 1 1 8 8 SER N N 8 118.551 118.551 120.356 -1.805 25934
938 1 10 . 1 1 8 8 SER HA H 8 4.467 4.467 4.598 -0.131 25934
939 1 10 . 1 1 8 8 SER H H 8 8.345 8.345 8.886 -0.541 25934
940 1 10 . 1 1 9 9 GLN N N 9 123.019 123.019 125.389 -2.370 25934
941 1 10 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.404 -0.124 25934
942 1 10 . 1 1 9 9 GLN H H 9 8.338 8.338 7.938 0.400 25934
943 1 10 . 1 1 10 10 LYS N N 10 123.679 123.679 121.364 2.315 25934
944 1 10 . 1 1 10 10 LYS HA H 10 4.199 4.199 4.392 -0.193 25934
945 1 10 . 1 1 10 10 LYS H H 10 8.258 8.258 8.125 0.133 25934
946 1 10 . 1 1 11 11 SER N N 11 115.557 115.557 116.292 -0.735 25934
947 1 10 . 1 1 11 11 SER HA H 11 4.534 4.534 4.374 0.160 25934
948 1 10 . 1 1 11 11 SER H H 11 7.659 7.659 7.659 -0.000 25934
949 1 10 . 1 1 12 12 TYR N N 12 122.532 122.532 121.575 0.957 25934
950 1 10 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.309 -0.089 25934
951 1 10 . 1 1 12 12 TYR H H 12 8.585 8.585 7.084 1.501 25934
952 1 10 . 1 1 13 13 VAL N N 13 123.674 123.674 124.700 -1.026 25934
953 1 10 . 1 1 13 13 VAL HA H 13 4.801 4.801 5.094 -0.293 25934
954 1 10 . 1 1 13 13 VAL H H 13 8.253 8.253 8.339 -0.086 25934
955 1 10 . 1 1 14 14 CYS N N 14 131.181 131.181 128.854 2.327 25934
956 1 10 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.043 0.035 25934
957 1 10 . 1 1 14 14 CYS H H 14 9.362 9.362 9.281 0.081 25934
958 1 10 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.365 -1.907 25934
959 1 10 . 1 1 16 16 ASN N N 16 119.946 119.946 115.115 4.831 25934
960 1 10 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.700 0.189 25934
961 1 10 . 1 1 16 16 ASN H H 16 9.104 9.104 8.261 0.844 25934
962 1 10 . 1 1 17 17 CYS N N 17 117.298 117.298 116.665 0.633 25934
963 1 10 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.827 0.309 25934
964 1 10 . 1 1 17 17 CYS H H 17 8.202 8.202 7.833 0.369 25934
965 1 10 . 1 1 18 18 GLY N N 18 113.723 113.723 109.535 4.188 25934
966 1 10 . 1 1 18 18 GLY H H 18 8.092 8.092 8.686 -0.594 25934
967 1 10 . 1 1 19 19 LYS N N 19 124.529 124.529 120.594 3.935 25934
968 1 10 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.396 -0.433 25934
969 1 10 . 1 1 19 19 LYS H H 19 8.396 8.396 7.712 0.684 25934
970 1 10 . 1 1 20 20 ILE N N 20 122.902 122.902 125.968 -3.066 25934
971 1 10 . 1 1 20 20 ILE HA H 20 4.619 4.619 5.151 -0.532 25934
972 1 10 . 1 1 20 20 ILE H H 20 7.793 7.793 8.228 -0.435 25934
973 1 10 . 1 1 21 21 PHE N N 21 126.244 126.244 127.458 -1.214 25934
974 1 10 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.887 -0.127 25934
975 1 10 . 1 1 21 21 PHE H H 21 9.361 9.361 9.257 0.104 25934
976 1 10 . 1 1 22 22 ARG N N 22 125.051 125.051 122.632 2.419 25934
977 1 10 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.207 0.200 25934
978 1 10 . 1 1 22 22 ARG H H 22 9.016 9.016 8.677 0.339 25934
979 1 10 . 1 1 23 23 TRP N N 23 118.871 118.871 118.130 0.741 25934
980 1 10 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.807 0.521 25934
981 1 10 . 1 1 23 23 TRP H H 23 7.986 7.986 7.853 0.133 25934
982 1 10 . 1 1 24 24 ARG N N 24 130.190 130.190 122.451 7.739 25934
983 1 10 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.714 -0.673 25934
984 1 10 . 1 1 24 24 ARG H H 24 9.358 9.358 8.880 0.478 25934
985 1 10 . 1 1 25 25 VAL N N 25 115.735 115.735 119.085 -3.350 25934
986 1 10 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.800 0.002 25934
987 1 10 . 1 1 25 25 VAL H H 25 8.598 8.598 8.296 0.302 25934
988 1 10 . 1 1 26 26 ASN N N 26 119.272 119.272 117.936 1.336 25934
989 1 10 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.510 0.103 25934
990 1 10 . 1 1 26 26 ASN H H 26 6.907 6.907 8.417 -1.510 25934
991 1 10 . 1 1 27 27 PHE N N 27 124.971 124.971 123.091 1.880 25934
992 1 10 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.275 -0.262 25934
993 1 10 . 1 1 27 27 PHE H H 27 7.487 7.487 7.421 0.066 25934
994 1 10 . 1 1 28 28 ILE N N 28 119.280 119.280 118.076 1.204 25934
995 1 10 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.451 -0.174 25934
996 1 10 . 1 1 28 28 ILE H H 28 8.458 8.458 8.583 -0.125 25934
997 1 10 . 1 1 29 29 ARG N N 29 119.668 119.668 120.026 -0.358 25934
998 1 10 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.884 0.016 25934
999 1 10 . 1 1 29 29 ARG H H 29 7.577 7.577 7.477 0.100 25934
1000 1 10 . 1 1 30 30 HIS N N 30 120.050 120.050 118.886 1.164 25934
1001 1 10 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.249 0.009 25934
1002 1 10 . 1 1 30 30 HIS H H 30 7.620 7.620 7.987 -0.367 25934
1003 1 10 . 1 1 31 31 LEU N N 31 120.143 120.143 119.659 0.484 25934
1004 1 10 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.856 -0.083 25934
1005 1 10 . 1 1 31 31 LEU H H 31 8.005 8.005 8.149 -0.144 25934
1006 1 10 . 1 1 32 32 ARG N N 32 118.157 118.157 119.552 -1.395 25934
1007 1 10 . 1 1 32 32 ARG HA H 32 4.066 4.066 3.978 0.088 25934
1008 1 10 . 1 1 32 32 ARG H H 32 7.975 7.975 7.772 0.203 25934
1009 1 10 . 1 1 33 33 SER N N 33 115.082 115.082 113.379 1.703 25934
1010 1 10 . 1 1 33 33 SER HA H 33 4.327 4.327 4.474 -0.147 25934
1011 1 10 . 1 1 33 33 SER H H 33 7.754 7.754 7.560 0.194 25934
1012 1 10 . 1 1 34 34 ARG N N 34 121.862 121.862 121.754 0.108 25934
1013 1 10 . 1 1 34 34 ARG HA H 34 4.190 4.190 4.014 0.176 25934
1014 1 10 . 1 1 34 34 ARG H H 34 7.558 7.558 7.393 0.165 25934
1015 1 10 . 1 1 35 35 ARG N N 35 121.550 121.550 117.921 3.629 25934
1016 1 10 . 1 1 35 35 ARG HA H 35 4.284 4.284 4.183 0.101 25934
1017 1 10 . 1 1 35 35 ARG H H 35 8.030 8.030 7.422 0.608 25934
1018 1 10 . 1 1 36 36 GLU N N 36 122.012 122.012 118.709 3.303 25934
1019 1 10 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.417 -0.099 25934
1020 1 10 . 1 1 36 36 GLU H H 36 8.274 8.274 7.621 0.653 25934
1021 1 10 . 1 1 37 37 GLN N N 37 121.601 121.601 118.811 2.790 25934
1022 1 10 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.462 -0.193 25934
1023 1 10 . 1 1 37 37 GLN H H 37 8.238 8.238 7.466 0.772 25934
1024 1 10 . 1 1 38 38 LYS N N 38 124.607 124.607 120.794 3.813 25934
1025 1 10 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.701 -0.106 25934
1026 1 10 . 1 1 38 38 LYS H H 38 8.348 8.348 8.348 -0.000 25934
1027 1 10 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.259 0.157 25934
1028 1 10 . 1 1 40 40 HIS N N 40 120.882 120.882 113.353 7.529 25934
1029 1 10 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.535 0.104 25934
1030 1 10 . 1 1 40 40 HIS H H 40 8.565 8.565 7.982 0.583 25934
1031 1 11 . 1 1 5 5 VAL N N 5 122.612 122.612 118.809 3.803 25934
1032 1 11 . 1 1 5 5 VAL HA H 5 4.134 4.134 4.405 -0.271 25934
1033 1 11 . 1 1 5 5 VAL H H 5 8.326 8.326 8.289 0.037 25934
1034 1 11 . 1 1 6 6 GLN N N 6 125.548 125.548 123.188 2.360 25934
1035 1 11 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.573 -0.119 25934
1036 1 11 . 1 1 6 6 GLN H H 6 8.635 8.635 8.701 -0.066 25934
1037 1 11 . 1 1 7 7 THR N N 7 116.430 116.430 112.188 4.242 25934
1038 1 11 . 1 1 7 7 THR HA H 7 4.394 4.394 4.447 -0.053 25934
1039 1 11 . 1 1 7 7 THR H H 7 8.307 8.307 7.455 0.852 25934
1040 1 11 . 1 1 8 8 SER N N 8 118.551 118.551 121.742 -3.191 25934
1041 1 11 . 1 1 8 8 SER HA H 8 4.467 4.467 4.269 0.198 25934
1042 1 11 . 1 1 8 8 SER H H 8 8.345 8.345 8.791 -0.446 25934
1043 1 11 . 1 1 9 9 GLN N N 9 123.019 123.019 117.440 5.579 25934
1044 1 11 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.335 -0.055 25934
1045 1 11 . 1 1 9 9 GLN H H 9 8.338 8.338 8.524 -0.186 25934
1046 1 11 . 1 1 10 10 LYS N N 10 123.679 123.679 121.674 2.005 25934
1047 1 11 . 1 1 10 10 LYS HA H 10 4.199 4.199 4.445 -0.246 25934
1048 1 11 . 1 1 10 10 LYS H H 10 8.258 8.258 7.976 0.282 25934
1049 1 11 . 1 1 11 11 SER N N 11 115.557 115.557 117.831 -2.274 25934
1050 1 11 . 1 1 11 11 SER HA H 11 4.534 4.534 4.904 -0.370 25934
1051 1 11 . 1 1 11 11 SER H H 11 7.659 7.659 8.267 -0.608 25934
1052 1 11 . 1 1 12 12 TYR N N 12 122.532 122.532 124.360 -1.828 25934
1053 1 11 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.281 -0.061 25934
1054 1 11 . 1 1 12 12 TYR H H 12 8.585 8.585 9.206 -0.621 25934
1055 1 11 . 1 1 13 13 VAL N N 13 123.674 123.674 125.339 -1.665 25934
1056 1 11 . 1 1 13 13 VAL HA H 13 4.801 4.801 4.756 0.045 25934
1057 1 11 . 1 1 13 13 VAL H H 13 8.253 8.253 8.325 -0.072 25934
1058 1 11 . 1 1 14 14 CYS N N 14 131.181 131.181 129.345 1.836 25934
1059 1 11 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.117 -0.039 25934
1060 1 11 . 1 1 14 14 CYS H H 14 9.362 9.362 9.368 -0.006 25934
1061 1 11 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.399 -1.941 25934
1062 1 11 . 1 1 16 16 ASN N N 16 119.946 119.946 115.988 3.958 25934
1063 1 11 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.797 0.092 25934
1064 1 11 . 1 1 16 16 ASN H H 16 9.104 9.104 8.031 1.073 25934
1065 1 11 . 1 1 17 17 CYS N N 17 117.298 117.298 116.091 1.207 25934
1066 1 11 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.776 0.360 25934
1067 1 11 . 1 1 17 17 CYS H H 17 8.202 8.202 7.726 0.476 25934
1068 1 11 . 1 1 18 18 GLY N N 18 113.723 113.723 109.790 3.933 25934
1069 1 11 . 1 1 18 18 GLY H H 18 8.092 8.092 8.670 -0.578 25934
1070 1 11 . 1 1 19 19 LYS N N 19 124.529 124.529 121.481 3.048 25934
1071 1 11 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.370 -0.407 25934
1072 1 11 . 1 1 19 19 LYS H H 19 8.396 8.396 7.804 0.592 25934
1073 1 11 . 1 1 20 20 ILE N N 20 122.902 122.902 122.421 0.481 25934
1074 1 11 . 1 1 20 20 ILE HA H 20 4.619 4.619 5.533 -0.914 25934
1075 1 11 . 1 1 20 20 ILE H H 20 7.793 7.793 7.985 -0.192 25934
1076 1 11 . 1 1 21 21 PHE N N 21 126.244 126.244 125.149 1.095 25934
1077 1 11 . 1 1 21 21 PHE HA H 21 4.760 4.760 5.004 -0.244 25934
1078 1 11 . 1 1 21 21 PHE H H 21 9.361 9.361 9.096 0.265 25934
1079 1 11 . 1 1 22 22 ARG N N 22 125.051 125.051 122.310 2.741 25934
1080 1 11 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.402 0.005 25934
1081 1 11 . 1 1 22 22 ARG H H 22 9.016 9.016 8.826 0.190 25934
1082 1 11 . 1 1 23 23 TRP N N 23 118.871 118.871 117.464 1.407 25934
1083 1 11 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.851 0.477 25934
1084 1 11 . 1 1 23 23 TRP H H 23 7.986 7.986 7.849 0.137 25934
1085 1 11 . 1 1 24 24 ARG N N 24 130.190 130.190 123.244 6.946 25934
1086 1 11 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.455 -0.414 25934
1087 1 11 . 1 1 24 24 ARG H H 24 9.358 9.358 8.766 0.592 25934
1088 1 11 . 1 1 25 25 VAL N N 25 115.735 115.735 118.045 -2.310 25934
1089 1 11 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.827 -0.025 25934
1090 1 11 . 1 1 25 25 VAL H H 25 8.598 8.598 8.252 0.346 25934
1091 1 11 . 1 1 26 26 ASN N N 26 119.272 119.272 117.632 1.640 25934
1092 1 11 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.440 0.173 25934
1093 1 11 . 1 1 26 26 ASN H H 26 6.907 6.907 8.429 -1.522 25934
1094 1 11 . 1 1 27 27 PHE N N 27 124.971 124.971 122.350 2.621 25934
1095 1 11 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.420 -0.407 25934
1096 1 11 . 1 1 27 27 PHE H H 27 7.487 7.487 7.185 0.302 25934
1097 1 11 . 1 1 28 28 ILE N N 28 119.280 119.280 118.604 0.676 25934
1098 1 11 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.438 -0.161 25934
1099 1 11 . 1 1 28 28 ILE H H 28 8.458 8.458 8.245 0.213 25934
1100 1 11 . 1 1 29 29 ARG N N 29 119.668 119.668 120.354 -0.686 25934
1101 1 11 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.753 0.147 25934
1102 1 11 . 1 1 29 29 ARG H H 29 7.577 7.577 7.586 -0.009 25934
1103 1 11 . 1 1 30 30 HIS N N 30 120.050 120.050 119.018 1.032 25934
1104 1 11 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.246 0.012 25934
1105 1 11 . 1 1 30 30 HIS H H 30 7.620 7.620 7.533 0.087 25934
1106 1 11 . 1 1 31 31 LEU N N 31 120.143 120.143 117.100 3.043 25934
1107 1 11 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.910 -0.137 25934
1108 1 11 . 1 1 31 31 LEU H H 31 8.005 8.005 7.720 0.285 25934
1109 1 11 . 1 1 32 32 ARG N N 32 118.157 118.157 120.734 -2.577 25934
1110 1 11 . 1 1 32 32 ARG HA H 32 4.066 4.066 4.000 0.066 25934
1111 1 11 . 1 1 32 32 ARG H H 32 7.975 7.975 7.916 0.059 25934
1112 1 11 . 1 1 33 33 SER N N 33 115.082 115.082 116.013 -0.931 25934
1113 1 11 . 1 1 33 33 SER HA H 33 4.327 4.327 4.374 -0.047 25934
1114 1 11 . 1 1 33 33 SER H H 33 7.754 7.754 7.649 0.105 25934
1115 1 11 . 1 1 34 34 ARG N N 34 121.862 121.862 120.538 1.324 25934
1116 1 11 . 1 1 34 34 ARG HA H 34 4.190 4.190 3.989 0.201 25934
1117 1 11 . 1 1 34 34 ARG H H 34 7.558 7.558 7.390 0.168 25934
1118 1 11 . 1 1 35 35 ARG N N 35 121.550 121.550 122.084 -0.534 25934
1119 1 11 . 1 1 35 35 ARG HA H 35 4.284 4.284 3.970 0.314 25934
1120 1 11 . 1 1 35 35 ARG H H 35 8.030 8.030 8.897 -0.867 25934
1121 1 11 . 1 1 36 36 GLU N N 36 122.012 122.012 119.122 2.890 25934
1122 1 11 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.111 0.207 25934
1123 1 11 . 1 1 36 36 GLU H H 36 8.274 8.274 8.559 -0.285 25934
1124 1 11 . 1 1 37 37 GLN N N 37 121.601 121.601 114.082 7.519 25934
1125 1 11 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.022 0.247 25934
1126 1 11 . 1 1 37 37 GLN H H 37 8.238 8.238 8.330 -0.092 25934
1127 1 11 . 1 1 38 38 LYS N N 38 124.607 124.607 120.152 4.455 25934
1128 1 11 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.560 0.035 25934
1129 1 11 . 1 1 38 38 LYS H H 38 8.348 8.348 8.560 -0.212 25934
1130 1 11 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.404 0.012 25934
1131 1 11 . 1 1 40 40 HIS N N 40 120.882 120.882 118.835 2.047 25934
1132 1 11 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.759 -0.120 25934
1133 1 11 . 1 1 40 40 HIS H H 40 8.565 8.565 8.071 0.494 25934
1134 1 12 . 1 1 5 5 VAL N N 5 122.612 122.612 124.885 -2.273 25934
1135 1 12 . 1 1 5 5 VAL HA H 5 4.134 4.134 3.809 0.325 25934
1136 1 12 . 1 1 5 5 VAL H H 5 8.326 8.326 8.573 -0.247 25934
1137 1 12 . 1 1 6 6 GLN N N 6 125.548 125.548 124.610 0.938 25934
1138 1 12 . 1 1 6 6 GLN HA H 6 4.454 4.454 3.956 0.498 25934
1139 1 12 . 1 1 6 6 GLN H H 6 8.635 8.635 8.608 0.027 25934
1140 1 12 . 1 1 7 7 THR N N 7 116.430 116.430 118.497 -2.067 25934
1141 1 12 . 1 1 7 7 THR HA H 7 4.394 4.394 4.169 0.225 25934
1142 1 12 . 1 1 7 7 THR H H 7 8.307 8.307 8.490 -0.183 25934
1143 1 12 . 1 1 8 8 SER N N 8 118.551 118.551 118.462 0.089 25934
1144 1 12 . 1 1 8 8 SER HA H 8 4.467 4.467 3.970 0.497 25934
1145 1 12 . 1 1 8 8 SER H H 8 8.345 8.345 8.593 -0.248 25934
1146 1 12 . 1 1 9 9 GLN N N 9 123.019 123.019 119.993 3.026 25934
1147 1 12 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.209 0.071 25934
1148 1 12 . 1 1 9 9 GLN H H 9 8.338 8.338 8.223 0.115 25934
1149 1 12 . 1 1 10 10 LYS N N 10 123.679 123.679 120.603 3.076 25934
1150 1 12 . 1 1 10 10 LYS HA H 10 4.199 4.199 4.345 -0.146 25934
1151 1 12 . 1 1 10 10 LYS H H 10 8.258 8.258 7.825 0.433 25934
1152 1 12 . 1 1 11 11 SER N N 11 115.557 115.557 115.123 0.434 25934
1153 1 12 . 1 1 11 11 SER HA H 11 4.534 4.534 4.940 -0.406 25934
1154 1 12 . 1 1 11 11 SER H H 11 7.659 7.659 7.899 -0.240 25934
1155 1 12 . 1 1 12 12 TYR N N 12 122.532 122.532 124.706 -2.174 25934
1156 1 12 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.421 -0.201 25934
1157 1 12 . 1 1 12 12 TYR H H 12 8.585 8.585 9.148 -0.563 25934
1158 1 12 . 1 1 13 13 VAL N N 13 123.674 123.674 125.135 -1.461 25934
1159 1 12 . 1 1 13 13 VAL HA H 13 4.801 4.801 5.109 -0.308 25934
1160 1 12 . 1 1 13 13 VAL H H 13 8.253 8.253 8.348 -0.095 25934
1161 1 12 . 1 1 14 14 CYS N N 14 131.181 131.181 129.590 1.591 25934
1162 1 12 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.094 -0.016 25934
1163 1 12 . 1 1 14 14 CYS H H 14 9.362 9.362 9.302 0.060 25934
1164 1 12 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.399 -1.941 25934
1165 1 12 . 1 1 16 16 ASN N N 16 119.946 119.946 115.386 4.560 25934
1166 1 12 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.691 0.198 25934
1167 1 12 . 1 1 16 16 ASN H H 16 9.104 9.104 8.240 0.864 25934
1168 1 12 . 1 1 17 17 CYS N N 17 117.298 117.298 115.683 1.615 25934
1169 1 12 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.899 0.237 25934
1170 1 12 . 1 1 17 17 CYS H H 17 8.202 8.202 7.736 0.466 25934
1171 1 12 . 1 1 18 18 GLY N N 18 113.723 113.723 109.498 4.225 25934
1172 1 12 . 1 1 18 18 GLY H H 18 8.092 8.092 8.679 -0.587 25934
1173 1 12 . 1 1 19 19 LYS N N 19 124.529 124.529 120.365 4.164 25934
1174 1 12 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.412 -0.450 25934
1175 1 12 . 1 1 19 19 LYS H H 19 8.396 8.396 7.654 0.742 25934
1176 1 12 . 1 1 20 20 ILE N N 20 122.902 122.902 125.693 -2.791 25934
1177 1 12 . 1 1 20 20 ILE HA H 20 4.619 4.619 4.879 -0.260 25934
1178 1 12 . 1 1 20 20 ILE H H 20 7.793 7.793 8.185 -0.392 25934
1179 1 12 . 1 1 21 21 PHE N N 21 126.244 126.244 127.831 -1.587 25934
1180 1 12 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.828 -0.068 25934
1181 1 12 . 1 1 21 21 PHE H H 21 9.361 9.361 9.319 0.042 25934
1182 1 12 . 1 1 22 22 ARG N N 22 125.051 125.051 122.325 2.726 25934
1183 1 12 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.324 0.083 25934
1184 1 12 . 1 1 22 22 ARG H H 22 9.016 9.016 8.781 0.235 25934
1185 1 12 . 1 1 23 23 TRP N N 23 118.871 118.871 118.175 0.696 25934
1186 1 12 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.944 0.384 25934
1187 1 12 . 1 1 23 23 TRP H H 23 7.986 7.986 7.990 -0.004 25934
1188 1 12 . 1 1 24 24 ARG N N 24 130.190 130.190 123.533 6.657 25934
1189 1 12 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.542 -0.501 25934
1190 1 12 . 1 1 24 24 ARG H H 24 9.358 9.358 8.963 0.395 25934
1191 1 12 . 1 1 25 25 VAL N N 25 115.735 115.735 117.860 -2.125 25934
1192 1 12 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.832 -0.030 25934
1193 1 12 . 1 1 25 25 VAL H H 25 8.598 8.598 8.325 0.273 25934
1194 1 12 . 1 1 26 26 ASN N N 26 119.272 119.272 117.837 1.435 25934
1195 1 12 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.478 0.135 25934
1196 1 12 . 1 1 26 26 ASN H H 26 6.907 6.907 8.454 -1.547 25934
1197 1 12 . 1 1 27 27 PHE N N 27 124.971 124.971 122.591 2.380 25934
1198 1 12 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.414 -0.401 25934
1199 1 12 . 1 1 27 27 PHE H H 27 7.487 7.487 7.314 0.173 25934
1200 1 12 . 1 1 28 28 ILE N N 28 119.280 119.280 118.661 0.619 25934
1201 1 12 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.438 -0.161 25934
1202 1 12 . 1 1 28 28 ILE H H 28 8.458 8.458 8.401 0.057 25934
1203 1 12 . 1 1 29 29 ARG N N 29 119.668 119.668 120.371 -0.703 25934
1204 1 12 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.787 0.113 25934
1205 1 12 . 1 1 29 29 ARG H H 29 7.577 7.577 7.942 -0.365 25934
1206 1 12 . 1 1 30 30 HIS N N 30 120.050 120.050 119.109 0.941 25934
1207 1 12 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.293 -0.035 25934
1208 1 12 . 1 1 30 30 HIS H H 30 7.620 7.620 7.789 -0.169 25934
1209 1 12 . 1 1 31 31 LEU N N 31 120.143 120.143 118.187 1.956 25934
1210 1 12 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.896 -0.123 25934
1211 1 12 . 1 1 31 31 LEU H H 31 8.005 8.005 7.829 0.176 25934
1212 1 12 . 1 1 32 32 ARG N N 32 118.157 118.157 118.419 -0.262 25934
1213 1 12 . 1 1 32 32 ARG HA H 32 4.066 4.066 4.025 0.041 25934
1214 1 12 . 1 1 32 32 ARG H H 32 7.975 7.975 8.158 -0.183 25934
1215 1 12 . 1 1 33 33 SER N N 33 115.082 115.082 113.137 1.945 25934
1216 1 12 . 1 1 33 33 SER HA H 33 4.327 4.327 4.429 -0.102 25934
1217 1 12 . 1 1 33 33 SER H H 33 7.754 7.754 7.672 0.082 25934
1218 1 12 . 1 1 34 34 ARG N N 34 121.862 121.862 117.077 4.785 25934
1219 1 12 . 1 1 34 34 ARG HA H 34 4.190 4.190 3.727 0.463 25934
1220 1 12 . 1 1 34 34 ARG H H 34 7.558 7.558 7.845 -0.287 25934
1221 1 12 . 1 1 35 35 ARG N N 35 121.550 121.550 119.493 2.057 25934
1222 1 12 . 1 1 35 35 ARG HA H 35 4.284 4.284 4.361 -0.077 25934
1223 1 12 . 1 1 35 35 ARG H H 35 8.030 8.030 8.293 -0.263 25934
1224 1 12 . 1 1 36 36 GLU N N 36 122.012 122.012 119.166 2.846 25934
1225 1 12 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.101 0.217 25934
1226 1 12 . 1 1 36 36 GLU H H 36 8.274 8.274 8.632 -0.358 25934
1227 1 12 . 1 1 37 37 GLN N N 37 121.601 121.601 114.870 6.731 25934
1228 1 12 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.395 -0.126 25934
1229 1 12 . 1 1 37 37 GLN H H 37 8.238 8.238 7.854 0.384 25934
1230 1 12 . 1 1 38 38 LYS N N 38 124.607 124.607 124.849 -0.242 25934
1231 1 12 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.209 0.386 25934
1232 1 12 . 1 1 38 38 LYS H H 38 8.348 8.348 8.690 -0.342 25934
1233 1 12 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.522 -0.106 25934
1234 1 12 . 1 1 40 40 HIS N N 40 120.882 120.882 110.122 10.760 25934
1235 1 12 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.594 0.045 25934
1236 1 12 . 1 1 40 40 HIS H H 40 8.565 8.565 7.848 0.717 25934
1237 1 13 . 1 1 5 5 VAL N N 5 122.612 122.612 124.497 -1.885 25934
1238 1 13 . 1 1 5 5 VAL HA H 5 4.134 4.134 3.715 0.419 25934
1239 1 13 . 1 1 5 5 VAL H H 5 8.326 8.326 8.835 -0.509 25934
1240 1 13 . 1 1 6 6 GLN N N 6 125.548 125.548 117.650 7.898 25934
1241 1 13 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.321 0.133 25934
1242 1 13 . 1 1 6 6 GLN H H 6 8.635 8.635 8.329 0.306 25934
1243 1 13 . 1 1 7 7 THR N N 7 116.430 116.430 113.507 2.923 25934
1244 1 13 . 1 1 7 7 THR HA H 7 4.394 4.394 4.137 0.257 25934
1245 1 13 . 1 1 7 7 THR H H 7 8.307 8.307 7.729 0.578 25934
1246 1 13 . 1 1 8 8 SER N N 8 118.551 118.551 114.529 4.022 25934
1247 1 13 . 1 1 8 8 SER HA H 8 4.467 4.467 4.589 -0.122 25934
1248 1 13 . 1 1 8 8 SER H H 8 8.345 8.345 8.490 -0.145 25934
1249 1 13 . 1 1 9 9 GLN N N 9 123.019 123.019 118.227 4.792 25934
1250 1 13 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.658 -0.378 25934
1251 1 13 . 1 1 9 9 GLN H H 9 8.338 8.338 7.979 0.359 25934
1252 1 13 . 1 1 10 10 LYS N N 10 123.679 123.679 119.915 3.764 25934
1253 1 13 . 1 1 10 10 LYS HA H 10 4.199 4.199 3.886 0.313 25934
1254 1 13 . 1 1 10 10 LYS H H 10 8.258 8.258 7.179 1.079 25934
1255 1 13 . 1 1 11 11 SER N N 11 115.557 115.557 114.162 1.395 25934
1256 1 13 . 1 1 11 11 SER HA H 11 4.534 4.534 3.961 0.573 25934
1257 1 13 . 1 1 11 11 SER H H 11 7.659 7.659 8.233 -0.574 25934
1258 1 13 . 1 1 12 12 TYR N N 12 122.532 122.532 119.472 3.060 25934
1259 1 13 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.146 0.074 25934
1260 1 13 . 1 1 12 12 TYR H H 12 8.585 8.585 7.884 0.701 25934
1261 1 13 . 1 1 13 13 VAL N N 13 123.674 123.674 124.429 -0.755 25934
1262 1 13 . 1 1 13 13 VAL HA H 13 4.801 4.801 4.928 -0.127 25934
1263 1 13 . 1 1 13 13 VAL H H 13 8.253 8.253 8.168 0.085 25934
1264 1 13 . 1 1 14 14 CYS N N 14 131.181 131.181 129.511 1.670 25934
1265 1 13 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.077 0.001 25934
1266 1 13 . 1 1 14 14 CYS H H 14 9.362 9.362 9.372 -0.010 25934
1267 1 13 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.441 -1.983 25934
1268 1 13 . 1 1 16 16 ASN N N 16 119.946 119.946 116.773 3.173 25934
1269 1 13 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.673 0.216 25934
1270 1 13 . 1 1 16 16 ASN H H 16 9.104 9.104 8.132 0.972 25934
1271 1 13 . 1 1 17 17 CYS N N 17 117.298 117.298 116.138 1.160 25934
1272 1 13 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.817 0.319 25934
1273 1 13 . 1 1 17 17 CYS H H 17 8.202 8.202 7.881 0.321 25934
1274 1 13 . 1 1 18 18 GLY N N 18 113.723 113.723 109.293 4.430 25934
1275 1 13 . 1 1 18 18 GLY H H 18 8.092 8.092 8.573 -0.481 25934
1276 1 13 . 1 1 19 19 LYS N N 19 124.529 124.529 120.467 4.062 25934
1277 1 13 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.455 -0.492 25934
1278 1 13 . 1 1 19 19 LYS H H 19 8.396 8.396 7.781 0.615 25934
1279 1 13 . 1 1 20 20 ILE N N 20 122.902 122.902 123.951 -1.049 25934
1280 1 13 . 1 1 20 20 ILE HA H 20 4.619 4.619 5.051 -0.432 25934
1281 1 13 . 1 1 20 20 ILE H H 20 7.793 7.793 8.186 -0.393 25934
1282 1 13 . 1 1 21 21 PHE N N 21 126.244 126.244 126.283 -0.039 25934
1283 1 13 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.926 -0.166 25934
1284 1 13 . 1 1 21 21 PHE H H 21 9.361 9.361 9.155 0.206 25934
1285 1 13 . 1 1 22 22 ARG N N 22 125.051 125.051 122.444 2.607 25934
1286 1 13 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.235 0.172 25934
1287 1 13 . 1 1 22 22 ARG H H 22 9.016 9.016 8.753 0.263 25934
1288 1 13 . 1 1 23 23 TRP N N 23 118.871 118.871 118.440 0.431 25934
1289 1 13 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.939 0.389 25934
1290 1 13 . 1 1 23 23 TRP H H 23 7.986 7.986 7.865 0.121 25934
1291 1 13 . 1 1 24 24 ARG N N 24 130.190 130.190 122.525 7.665 25934
1292 1 13 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.336 -0.295 25934
1293 1 13 . 1 1 24 24 ARG H H 24 9.358 9.358 9.053 0.305 25934
1294 1 13 . 1 1 25 25 VAL N N 25 115.735 115.735 115.301 0.434 25934
1295 1 13 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.686 0.116 25934
1296 1 13 . 1 1 25 25 VAL H H 25 8.598 8.598 8.152 0.446 25934
1297 1 13 . 1 1 26 26 ASN N N 26 119.272 119.272 117.444 1.828 25934
1298 1 13 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.492 0.121 25934
1299 1 13 . 1 1 26 26 ASN H H 26 6.907 6.907 8.660 -1.753 25934
1300 1 13 . 1 1 27 27 PHE N N 27 124.971 124.971 122.018 2.953 25934
1301 1 13 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.290 -0.277 25934
1302 1 13 . 1 1 27 27 PHE H H 27 7.487 7.487 7.154 0.333 25934
1303 1 13 . 1 1 28 28 ILE N N 28 119.280 119.280 119.115 0.165 25934
1304 1 13 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.394 -0.117 25934
1305 1 13 . 1 1 28 28 ILE H H 28 8.458 8.458 8.311 0.147 25934
1306 1 13 . 1 1 29 29 ARG N N 29 119.668 119.668 120.157 -0.489 25934
1307 1 13 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.809 0.091 25934
1308 1 13 . 1 1 29 29 ARG H H 29 7.577 7.577 8.251 -0.674 25934
1309 1 13 . 1 1 30 30 HIS N N 30 120.050 120.050 119.589 0.461 25934
1310 1 13 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.271 -0.013 25934
1311 1 13 . 1 1 30 30 HIS H H 30 7.620 7.620 7.703 -0.083 25934
1312 1 13 . 1 1 31 31 LEU N N 31 120.143 120.143 118.722 1.421 25934
1313 1 13 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.816 -0.043 25934
1314 1 13 . 1 1 31 31 LEU H H 31 8.005 8.005 7.826 0.179 25934
1315 1 13 . 1 1 32 32 ARG N N 32 118.157 118.157 119.337 -1.180 25934
1316 1 13 . 1 1 32 32 ARG HA H 32 4.066 4.066 3.954 0.112 25934
1317 1 13 . 1 1 32 32 ARG H H 32 7.975 7.975 8.474 -0.499 25934
1318 1 13 . 1 1 33 33 SER N N 33 115.082 115.082 114.104 0.978 25934
1319 1 13 . 1 1 33 33 SER HA H 33 4.327 4.327 4.224 0.103 25934
1320 1 13 . 1 1 33 33 SER H H 33 7.754 7.754 8.311 -0.557 25934
1321 1 13 . 1 1 34 34 ARG N N 34 121.862 121.862 119.462 2.400 25934
1322 1 13 . 1 1 34 34 ARG HA H 34 4.190 4.190 4.160 0.030 25934
1323 1 13 . 1 1 34 34 ARG H H 34 7.558 7.558 7.347 0.211 25934
1324 1 13 . 1 1 35 35 ARG N N 35 121.550 121.550 119.983 1.567 25934
1325 1 13 . 1 1 35 35 ARG HA H 35 4.284 4.284 3.956 0.328 25934
1326 1 13 . 1 1 35 35 ARG H H 35 8.030 8.030 7.838 0.193 25934
1327 1 13 . 1 1 36 36 GLU N N 36 122.012 122.012 124.169 -2.157 25934
1328 1 13 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.327 -0.009 25934
1329 1 13 . 1 1 36 36 GLU H H 36 8.274 8.274 8.620 -0.346 25934
1330 1 13 . 1 1 37 37 GLN N N 37 121.601 121.601 119.807 1.794 25934
1331 1 13 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.679 -0.410 25934
1332 1 13 . 1 1 37 37 GLN H H 37 8.238 8.238 7.815 0.423 25934
1333 1 13 . 1 1 38 38 LYS N N 38 124.607 124.607 122.455 2.152 25934
1334 1 13 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.642 -0.047 25934
1335 1 13 . 1 1 38 38 LYS H H 38 8.348 8.348 8.543 -0.195 25934
1336 1 13 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.274 0.142 25934
1337 1 13 . 1 1 40 40 HIS N N 40 120.882 120.882 113.765 7.117 25934
1338 1 13 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.559 0.080 25934
1339 1 13 . 1 1 40 40 HIS H H 40 8.565 8.565 8.037 0.528 25934
1340 1 14 . 1 1 5 5 VAL N N 5 122.612 122.612 119.714 2.898 25934
1341 1 14 . 1 1 5 5 VAL HA H 5 4.134 4.134 3.721 0.413 25934
1342 1 14 . 1 1 5 5 VAL H H 5 8.326 8.326 7.997 0.329 25934
1343 1 14 . 1 1 6 6 GLN N N 6 125.548 125.548 120.902 4.646 25934
1344 1 14 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.815 -0.361 25934
1345 1 14 . 1 1 6 6 GLN H H 6 8.635 8.635 8.057 0.578 25934
1346 1 14 . 1 1 7 7 THR N N 7 116.430 116.430 116.201 0.229 25934
1347 1 14 . 1 1 7 7 THR HA H 7 4.394 4.394 4.317 0.077 25934
1348 1 14 . 1 1 7 7 THR H H 7 8.307 8.307 8.273 0.034 25934
1349 1 14 . 1 1 8 8 SER N N 8 118.551 118.551 117.164 1.387 25934
1350 1 14 . 1 1 8 8 SER HA H 8 4.467 4.467 3.980 0.487 25934
1351 1 14 . 1 1 8 8 SER H H 8 8.345 8.345 7.940 0.405 25934
1352 1 14 . 1 1 9 9 GLN N N 9 123.019 123.019 125.487 -2.468 25934
1353 1 14 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.076 0.204 25934
1354 1 14 . 1 1 9 9 GLN H H 9 8.338 8.338 8.763 -0.425 25934
1355 1 14 . 1 1 10 10 LYS N N 10 123.679 123.679 120.299 3.380 25934
1356 1 14 . 1 1 10 10 LYS HA H 10 4.199 4.199 3.586 0.613 25934
1357 1 14 . 1 1 10 10 LYS H H 10 8.258 8.258 8.275 -0.017 25934
1358 1 14 . 1 1 11 11 SER N N 11 115.557 115.557 113.666 1.891 25934
1359 1 14 . 1 1 11 11 SER HA H 11 4.534 4.534 4.750 -0.216 25934
1360 1 14 . 1 1 11 11 SER H H 11 7.659 7.659 7.149 0.510 25934
1361 1 14 . 1 1 12 12 TYR N N 12 122.532 122.532 123.998 -1.466 25934
1362 1 14 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.231 -0.011 25934
1363 1 14 . 1 1 12 12 TYR H H 12 8.585 8.585 8.898 -0.313 25934
1364 1 14 . 1 1 13 13 VAL N N 13 123.674 123.674 125.387 -1.713 25934
1365 1 14 . 1 1 13 13 VAL HA H 13 4.801 4.801 4.702 0.099 25934
1366 1 14 . 1 1 13 13 VAL H H 13 8.253 8.253 8.334 -0.081 25934
1367 1 14 . 1 1 14 14 CYS N N 14 131.181 131.181 129.473 1.708 25934
1368 1 14 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.086 -0.008 25934
1369 1 14 . 1 1 14 14 CYS H H 14 9.362 9.362 9.379 -0.017 25934
1370 1 14 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.397 -1.939 25934
1371 1 14 . 1 1 16 16 ASN N N 16 119.946 119.946 115.435 4.511 25934
1372 1 14 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.694 0.195 25934
1373 1 14 . 1 1 16 16 ASN H H 16 9.104 9.104 8.199 0.905 25934
1374 1 14 . 1 1 17 17 CYS N N 17 117.298 117.298 115.877 1.421 25934
1375 1 14 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.889 0.247 25934
1376 1 14 . 1 1 17 17 CYS H H 17 8.202 8.202 7.799 0.403 25934
1377 1 14 . 1 1 18 18 GLY N N 18 113.723 113.723 109.625 4.098 25934
1378 1 14 . 1 1 18 18 GLY H H 18 8.092 8.092 8.704 -0.612 25934
1379 1 14 . 1 1 19 19 LYS N N 19 124.529 124.529 121.170 3.359 25934
1380 1 14 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.290 -0.327 25934
1381 1 14 . 1 1 19 19 LYS H H 19 8.396 8.396 7.794 0.602 25934
1382 1 14 . 1 1 20 20 ILE N N 20 122.902 122.902 126.113 -3.211 25934
1383 1 14 . 1 1 20 20 ILE HA H 20 4.619 4.619 5.242 -0.623 25934
1384 1 14 . 1 1 20 20 ILE H H 20 7.793 7.793 8.157 -0.364 25934
1385 1 14 . 1 1 21 21 PHE N N 21 126.244 126.244 125.621 0.623 25934
1386 1 14 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.928 -0.168 25934
1387 1 14 . 1 1 21 21 PHE H H 21 9.361 9.361 9.187 0.174 25934
1388 1 14 . 1 1 22 22 ARG N N 22 125.051 125.051 122.362 2.689 25934
1389 1 14 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.618 -0.211 25934
1390 1 14 . 1 1 22 22 ARG H H 22 9.016 9.016 8.804 0.212 25934
1391 1 14 . 1 1 23 23 TRP N N 23 118.871 118.871 118.141 0.730 25934
1392 1 14 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.922 0.406 25934
1393 1 14 . 1 1 23 23 TRP H H 23 7.986 7.986 7.811 0.175 25934
1394 1 14 . 1 1 24 24 ARG N N 24 130.190 130.190 122.908 7.282 25934
1395 1 14 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.415 -0.374 25934
1396 1 14 . 1 1 24 24 ARG H H 24 9.358 9.358 9.005 0.353 25934
1397 1 14 . 1 1 25 25 VAL N N 25 115.735 115.735 116.593 -0.858 25934
1398 1 14 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.751 0.051 25934
1399 1 14 . 1 1 25 25 VAL H H 25 8.598 8.598 8.221 0.377 25934
1400 1 14 . 1 1 26 26 ASN N N 26 119.272 119.272 117.334 1.938 25934
1401 1 14 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.433 0.180 25934
1402 1 14 . 1 1 26 26 ASN H H 26 6.907 6.907 8.390 -1.483 25934
1403 1 14 . 1 1 27 27 PHE N N 27 124.971 124.971 122.542 2.429 25934
1404 1 14 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.343 -0.330 25934
1405 1 14 . 1 1 27 27 PHE H H 27 7.487 7.487 7.234 0.253 25934
1406 1 14 . 1 1 28 28 ILE N N 28 119.280 119.280 118.452 0.828 25934
1407 1 14 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.403 -0.126 25934
1408 1 14 . 1 1 28 28 ILE H H 28 8.458 8.458 8.232 0.226 25934
1409 1 14 . 1 1 29 29 ARG N N 29 119.668 119.668 120.395 -0.727 25934
1410 1 14 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.772 0.128 25934
1411 1 14 . 1 1 29 29 ARG H H 29 7.577 7.577 7.626 -0.049 25934
1412 1 14 . 1 1 30 30 HIS N N 30 120.050 120.050 119.032 1.018 25934
1413 1 14 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.272 -0.014 25934
1414 1 14 . 1 1 30 30 HIS H H 30 7.620 7.620 7.559 0.060 25934
1415 1 14 . 1 1 31 31 LEU N N 31 120.143 120.143 117.257 2.886 25934
1416 1 14 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.932 -0.159 25934
1417 1 14 . 1 1 31 31 LEU H H 31 8.005 8.005 7.792 0.213 25934
1418 1 14 . 1 1 32 32 ARG N N 32 118.157 118.157 121.170 -3.013 25934
1419 1 14 . 1 1 32 32 ARG HA H 32 4.066 4.066 3.999 0.067 25934
1420 1 14 . 1 1 32 32 ARG H H 32 7.975 7.975 8.318 -0.343 25934
1421 1 14 . 1 1 33 33 SER N N 33 115.082 115.082 117.164 -2.082 25934
1422 1 14 . 1 1 33 33 SER HA H 33 4.327 4.327 4.445 -0.118 25934
1423 1 14 . 1 1 33 33 SER H H 33 7.754 7.754 8.000 -0.246 25934
1424 1 14 . 1 1 34 34 ARG N N 34 121.862 121.862 123.981 -2.119 25934
1425 1 14 . 1 1 34 34 ARG HA H 34 4.190 4.190 4.144 0.046 25934
1426 1 14 . 1 1 34 34 ARG H H 34 7.558 7.558 8.009 -0.451 25934
1427 1 14 . 1 1 35 35 ARG N N 35 121.550 121.550 119.739 1.811 25934
1428 1 14 . 1 1 35 35 ARG HA H 35 4.284 4.284 4.543 -0.259 25934
1429 1 14 . 1 1 35 35 ARG H H 35 8.030 8.030 8.268 -0.238 25934
1430 1 14 . 1 1 36 36 GLU N N 36 122.012 122.012 120.357 1.655 25934
1431 1 14 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.201 0.117 25934
1432 1 14 . 1 1 36 36 GLU H H 36 8.274 8.274 8.533 -0.259 25934
1433 1 14 . 1 1 37 37 GLN N N 37 121.601 121.601 117.722 3.879 25934
1434 1 14 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.345 -0.076 25934
1435 1 14 . 1 1 37 37 GLN H H 37 8.238 8.238 7.975 0.263 25934
1436 1 14 . 1 1 38 38 LYS N N 38 124.607 124.607 121.234 3.373 25934
1437 1 14 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.117 0.478 25934
1438 1 14 . 1 1 38 38 LYS H H 38 8.348 8.348 8.295 0.053 25934
1439 1 14 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.562 -0.146 25934
1440 1 14 . 1 1 40 40 HIS N N 40 120.882 120.882 121.074 -0.192 25934
1441 1 14 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.543 0.096 25934
1442 1 14 . 1 1 40 40 HIS H H 40 8.565 8.565 8.560 0.005 25934
1443 1 15 . 1 1 5 5 VAL N N 5 122.612 122.612 123.065 -0.453 25934
1444 1 15 . 1 1 5 5 VAL HA H 5 4.134 4.134 4.024 0.110 25934
1445 1 15 . 1 1 5 5 VAL H H 5 8.326 8.326 8.566 -0.240 25934
1446 1 15 . 1 1 6 6 GLN N N 6 125.548 125.548 119.912 5.636 25934
1447 1 15 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.304 0.150 25934
1448 1 15 . 1 1 6 6 GLN H H 6 8.635 8.635 8.271 0.364 25934
1449 1 15 . 1 1 7 7 THR N N 7 116.430 116.430 115.060 1.370 25934
1450 1 15 . 1 1 7 7 THR HA H 7 4.394 4.394 4.408 -0.014 25934
1451 1 15 . 1 1 7 7 THR H H 7 8.307 8.307 7.808 0.499 25934
1452 1 15 . 1 1 8 8 SER N N 8 118.551 118.551 116.535 2.016 25934
1453 1 15 . 1 1 8 8 SER HA H 8 4.467 4.467 4.301 0.166 25934
1454 1 15 . 1 1 8 8 SER H H 8 8.345 8.345 8.414 -0.069 25934
1455 1 15 . 1 1 9 9 GLN N N 9 123.019 123.019 121.224 1.795 25934
1456 1 15 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.213 0.067 25934
1457 1 15 . 1 1 9 9 GLN H H 9 8.338 8.338 8.739 -0.401 25934
1458 1 15 . 1 1 10 10 LYS N N 10 123.679 123.679 117.776 5.903 25934
1459 1 15 . 1 1 10 10 LYS HA H 10 4.199 4.199 4.305 -0.106 25934
1460 1 15 . 1 1 10 10 LYS H H 10 8.258 8.258 7.577 0.681 25934
1461 1 15 . 1 1 11 11 SER N N 11 115.557 115.557 117.264 -1.707 25934
1462 1 15 . 1 1 11 11 SER HA H 11 4.534 4.534 4.992 -0.458 25934
1463 1 15 . 1 1 11 11 SER H H 11 7.659 7.659 7.857 -0.198 25934
1464 1 15 . 1 1 12 12 TYR N N 12 122.532 122.532 122.899 -0.367 25934
1465 1 15 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.496 -0.276 25934
1466 1 15 . 1 1 12 12 TYR H H 12 8.585 8.585 8.926 -0.341 25934
1467 1 15 . 1 1 13 13 VAL N N 13 123.674 123.674 123.787 -0.113 25934
1468 1 15 . 1 1 13 13 VAL HA H 13 4.801 4.801 5.006 -0.205 25934
1469 1 15 . 1 1 13 13 VAL H H 13 8.253 8.253 8.294 -0.041 25934
1470 1 15 . 1 1 14 14 CYS N N 14 131.181 131.181 129.463 1.718 25934
1471 1 15 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.024 0.054 25934
1472 1 15 . 1 1 14 14 CYS H H 14 9.362 9.362 9.253 0.109 25934
1473 1 15 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.403 -1.945 25934
1474 1 15 . 1 1 16 16 ASN N N 16 119.946 119.946 116.200 3.746 25934
1475 1 15 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.687 0.202 25934
1476 1 15 . 1 1 16 16 ASN H H 16 9.104 9.104 8.266 0.838 25934
1477 1 15 . 1 1 17 17 CYS N N 17 117.298 117.298 116.714 0.584 25934
1478 1 15 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.825 0.311 25934
1479 1 15 . 1 1 17 17 CYS H H 17 8.202 8.202 7.834 0.368 25934
1480 1 15 . 1 1 18 18 GLY N N 18 113.723 113.723 109.545 4.178 25934
1481 1 15 . 1 1 18 18 GLY H H 18 8.092 8.092 8.657 -0.565 25934
1482 1 15 . 1 1 19 19 LYS N N 19 124.529 124.529 120.718 3.811 25934
1483 1 15 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.396 -0.433 25934
1484 1 15 . 1 1 19 19 LYS H H 19 8.396 8.396 7.794 0.602 25934
1485 1 15 . 1 1 20 20 ILE N N 20 122.902 122.902 121.587 1.315 25934
1486 1 15 . 1 1 20 20 ILE HA H 20 4.619 4.619 5.406 -0.787 25934
1487 1 15 . 1 1 20 20 ILE H H 20 7.793 7.793 7.898 -0.105 25934
1488 1 15 . 1 1 21 21 PHE N N 21 126.244 126.244 125.106 1.138 25934
1489 1 15 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.973 -0.213 25934
1490 1 15 . 1 1 21 21 PHE H H 21 9.361 9.361 9.048 0.313 25934
1491 1 15 . 1 1 22 22 ARG N N 22 125.051 125.051 122.829 2.222 25934
1492 1 15 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.411 -0.004 25934
1493 1 15 . 1 1 22 22 ARG H H 22 9.016 9.016 8.755 0.261 25934
1494 1 15 . 1 1 23 23 TRP N N 23 118.871 118.871 118.040 0.831 25934
1495 1 15 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.921 0.407 25934
1496 1 15 . 1 1 23 23 TRP H H 23 7.986 7.986 7.885 0.101 25934
1497 1 15 . 1 1 24 24 ARG N N 24 130.190 130.190 122.420 7.770 25934
1498 1 15 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.829 -0.788 25934
1499 1 15 . 1 1 24 24 ARG H H 24 9.358 9.358 9.111 0.247 25934
1500 1 15 . 1 1 25 25 VAL N N 25 115.735 115.735 118.043 -2.308 25934
1501 1 15 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.821 -0.019 25934
1502 1 15 . 1 1 25 25 VAL H H 25 8.598 8.598 8.281 0.317 25934
1503 1 15 . 1 1 26 26 ASN N N 26 119.272 119.272 117.943 1.329 25934
1504 1 15 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.504 0.109 25934
1505 1 15 . 1 1 26 26 ASN H H 26 6.907 6.907 8.474 -1.567 25934
1506 1 15 . 1 1 27 27 PHE N N 27 124.971 124.971 122.860 2.111 25934
1507 1 15 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.364 -0.351 25934
1508 1 15 . 1 1 27 27 PHE H H 27 7.487 7.487 7.627 -0.140 25934
1509 1 15 . 1 1 28 28 ILE N N 28 119.280 119.280 118.251 1.029 25934
1510 1 15 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.434 -0.157 25934
1511 1 15 . 1 1 28 28 ILE H H 28 8.458 8.458 8.572 -0.114 25934
1512 1 15 . 1 1 29 29 ARG N N 29 119.668 119.668 120.680 -1.012 25934
1513 1 15 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.777 0.123 25934
1514 1 15 . 1 1 29 29 ARG H H 29 7.577 7.577 7.939 -0.362 25934
1515 1 15 . 1 1 30 30 HIS N N 30 120.050 120.050 119.517 0.533 25934
1516 1 15 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.216 0.042 25934
1517 1 15 . 1 1 30 30 HIS H H 30 7.620 7.620 7.805 -0.185 25934
1518 1 15 . 1 1 31 31 LEU N N 31 120.143 120.143 115.876 4.267 25934
1519 1 15 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.899 -0.126 25934
1520 1 15 . 1 1 31 31 LEU H H 31 8.005 8.005 7.660 0.345 25934
1521 1 15 . 1 1 32 32 ARG N N 32 118.157 118.157 120.660 -2.503 25934
1522 1 15 . 1 1 32 32 ARG HA H 32 4.066 4.066 3.997 0.069 25934
1523 1 15 . 1 1 32 32 ARG H H 32 7.975 7.975 8.316 -0.341 25934
1524 1 15 . 1 1 33 33 SER N N 33 115.082 115.082 113.514 1.568 25934
1525 1 15 . 1 1 33 33 SER HA H 33 4.327 4.327 4.413 -0.086 25934
1526 1 15 . 1 1 33 33 SER H H 33 7.754 7.754 7.580 0.174 25934
1527 1 15 . 1 1 34 34 ARG N N 34 121.862 121.862 121.429 0.433 25934
1528 1 15 . 1 1 34 34 ARG HA H 34 4.190 4.190 4.096 0.094 25934
1529 1 15 . 1 1 34 34 ARG H H 34 7.558 7.558 7.243 0.315 25934
1530 1 15 . 1 1 35 35 ARG N N 35 121.550 121.550 117.206 4.344 25934
1531 1 15 . 1 1 35 35 ARG HA H 35 4.284 4.284 4.022 0.262 25934
1532 1 15 . 1 1 35 35 ARG H H 35 8.030 8.030 8.531 -0.501 25934
1533 1 15 . 1 1 36 36 GLU N N 36 122.012 122.012 117.232 4.780 25934
1534 1 15 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.822 -0.504 25934
1535 1 15 . 1 1 36 36 GLU H H 36 8.274 8.274 8.547 -0.273 25934
1536 1 15 . 1 1 37 37 GLN N N 37 121.601 121.601 118.517 3.084 25934
1537 1 15 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.146 0.123 25934
1538 1 15 . 1 1 37 37 GLN H H 37 8.238 8.238 8.184 0.054 25934
1539 1 15 . 1 1 38 38 LYS N N 38 124.607 124.607 117.673 6.934 25934
1540 1 15 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.696 -0.101 25934
1541 1 15 . 1 1 38 38 LYS H H 38 8.348 8.348 8.058 0.290 25934
1542 1 15 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.419 -0.003 25934
1543 1 15 . 1 1 40 40 HIS N N 40 120.882 120.882 119.746 1.136 25934
1544 1 15 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.738 -0.099 25934
1545 1 15 . 1 1 40 40 HIS H H 40 8.565 8.565 7.946 0.619 25934
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 34 3.277 -1.785 2.789 25934
2 1 1 "Average Difference" HA 37 0.390 0.061 0.391 25934
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25934
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25934
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25934
6 1 1 "Average Difference" HN 34 0.580 -0.242 0.535 25934
7 1 2 "Average Difference" N 34 3.040 -1.344 2.768 25934
8 1 2 "Average Difference" HA 37 0.407 0.044 0.410 25934
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25934
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25934
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25934
12 1 2 "Average Difference" HN 34 0.449 -0.028 0.455 25934
13 1 3 "Average Difference" N 34 3.079 -1.910 2.452 25934
14 1 3 "Average Difference" HA 37 0.407 0.094 0.401 25934
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25934
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25934
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25934
18 1 3 "Average Difference" HN 34 0.582 -0.240 0.539 25934
19 1 4 "Average Difference" N 34 2.833 -0.923 2.718 25934
20 1 4 "Average Difference" HA 37 0.386 0.053 0.388 25934
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25934
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25934
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25934
24 1 4 "Average Difference" HN 34 0.443 0.004 0.450 25934
25 1 5 "Average Difference" N 34 3.135 -1.493 2.798 25934
26 1 5 "Average Difference" HA 37 0.398 0.049 0.401 25934
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25934
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25934
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25934
30 1 5 "Average Difference" HN 34 0.596 -0.210 0.566 25934
31 1 6 "Average Difference" N 34 3.596 -1.862 3.123 25934
32 1 6 "Average Difference" HA 37 0.407 -0.005 0.413 25934
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25934
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25934
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25934
36 1 6 "Average Difference" HN 34 0.419 -0.018 0.424 25934
37 1 7 "Average Difference" N 34 2.760 -1.501 2.351 25934
38 1 7 "Average Difference" HA 37 0.394 0.085 0.390 25934
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25934
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25934
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25934
42 1 7 "Average Difference" HN 34 0.439 -0.069 0.440 25934
43 1 8 "Average Difference" N 34 2.948 -1.510 2.570 25934
44 1 8 "Average Difference" HA 37 0.398 0.057 0.399 25934
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25934
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25934
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25934
48 1 8 "Average Difference" HN 34 0.590 -0.223 0.555 25934
49 1 9 "Average Difference" N 34 2.740 -0.974 2.599 25934
50 1 9 "Average Difference" HA 37 0.410 0.102 0.403 25934
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25934
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25934
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25934
54 1 9 "Average Difference" HN 34 0.458 -0.060 0.460 25934
55 1 10 "Average Difference" N 34 2.952 -1.165 2.753 25934
56 1 10 "Average Difference" HA 37 0.395 0.068 0.395 25934
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25934
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25934
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25934
60 1 10 "Average Difference" HN 34 0.533 -0.164 0.514 25934
61 1 11 "Average Difference" N 34 3.085 -1.644 2.650 25934
62 1 11 "Average Difference" HA 37 0.420 0.075 0.419 25934
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25934
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25934
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25934
66 1 11 "Average Difference" HN 34 0.492 -0.023 0.498 25934
67 1 12 "Average Difference" N 34 3.333 -1.605 2.965 25934
68 1 12 "Average Difference" HA 37 0.422 0.021 0.427 25934
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25934
70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25934
71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25934
72 1 12 "Average Difference" HN 34 0.446 0.024 0.452 25934
73 1 13 "Average Difference" N 34 3.187 -2.023 2.500 25934
74 1 13 "Average Difference" HA 37 0.415 0.009 0.420 25934
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25934
76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 25934
77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 25934
78 1 13 "Average Difference" HN 34 0.543 -0.063 0.547 25934
79 1 14 "Average Difference" N 34 2.735 -1.259 2.464 25934
80 1 14 "Average Difference" HA 37 0.422 0.025 0.427 25934
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25934
82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 25934
83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 25934
84 1 14 "Average Difference" HN 34 0.431 -0.036 0.436 25934
85 1 15 "Average Difference" N 34 3.158 -1.974 2.502 25934
86 1 15 "Average Difference" HA 37 0.429 0.102 0.422 25934
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25934
88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 25934
89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 25934
90 1 15 "Average Difference" HN 34 0.451 -0.031 0.457 25934
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 25934
_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 5 5 VAL N N 5 122.612 122.612 121.394 1.218 25934
2 1 . 1 1 5 5 VAL HA H 5 4.134 4.134 3.996 0.138 25934
3 1 . 1 1 5 5 VAL H H 5 8.326 8.326 8.104 0.222 25934
4 1 . 1 1 6 6 GLN N N 6 125.548 125.548 124.069 1.479 25934
5 1 . 1 1 6 6 GLN HA H 6 4.454 4.454 4.354 0.100 25934
6 1 . 1 1 6 6 GLN H H 6 8.635 8.635 8.481 0.154 25934
7 1 . 1 1 7 7 THR N N 7 116.430 116.430 116.889 -0.459 25934
8 1 . 1 1 7 7 THR HA H 7 4.394 4.394 4.366 0.028 25934
9 1 . 1 1 7 7 THR H H 7 8.307 8.307 8.047 0.260 25934
10 1 . 1 1 8 8 SER N N 8 118.551 118.551 118.480 0.071 25934
11 1 . 1 1 8 8 SER HA H 8 4.467 4.467 4.376 0.091 25934
12 1 . 1 1 8 8 SER H H 8 8.345 8.345 8.531 -0.186 25934
13 1 . 1 1 9 9 GLN N N 9 123.019 123.019 120.635 2.384 25934
14 1 . 1 1 9 9 GLN HA H 9 4.280 4.280 4.220 0.060 25934
15 1 . 1 1 9 9 GLN H H 9 8.338 8.338 8.078 0.260 25934
16 1 . 1 1 10 10 LYS N N 10 123.679 123.679 119.611 4.068 25934
17 1 . 1 1 10 10 LYS HA H 10 4.199 4.199 4.210 -0.011 25934
18 1 . 1 1 10 10 LYS H H 10 8.258 8.258 7.743 0.515 25934
19 1 . 1 1 11 11 SER N N 11 115.557 115.557 116.111 -0.554 25934
20 1 . 1 1 11 11 SER HA H 11 4.534 4.534 4.570 -0.036 25934
21 1 . 1 1 11 11 SER H H 11 7.659 7.659 7.713 -0.054 25934
22 1 . 1 1 12 12 TYR N N 12 122.532 122.532 123.303 -0.771 25934
23 1 . 1 1 12 12 TYR HA H 12 4.220 4.220 4.308 -0.088 25934
24 1 . 1 1 12 12 TYR H H 12 8.585 8.585 8.258 0.327 25934
25 1 . 1 1 13 13 VAL N N 13 123.674 123.674 124.676 -1.002 25934
26 1 . 1 1 13 13 VAL HA H 13 4.801 4.801 5.010 -0.209 25934
27 1 . 1 1 13 13 VAL H H 13 8.253 8.253 8.341 -0.088 25934
28 1 . 1 1 14 14 CYS N N 14 131.181 131.181 129.254 1.927 25934
29 1 . 1 1 14 14 CYS HA H 14 5.078 5.078 5.057 0.021 25934
30 1 . 1 1 14 14 CYS H H 14 9.362 9.362 9.254 0.108 25934
31 1 . 1 1 15 15 PRO HA H 15 2.458 2.458 4.378 -1.920 25934
32 1 . 1 1 16 16 ASN N N 16 119.946 119.946 115.454 4.492 25934
33 1 . 1 1 16 16 ASN HA H 16 4.889 4.889 4.704 0.185 25934
34 1 . 1 1 16 16 ASN H H 16 9.104 9.104 8.265 0.840 25934
35 1 . 1 1 17 17 CYS N N 17 117.298 117.298 116.077 1.221 25934
36 1 . 1 1 17 17 CYS HA H 17 5.136 5.136 4.842 0.294 25934
37 1 . 1 1 17 17 CYS H H 17 8.202 8.202 7.799 0.403 25934
38 1 . 1 1 18 18 GLY N N 18 113.723 113.723 109.478 4.245 25934
39 1 . 1 1 18 18 GLY H H 18 8.092 8.092 8.664 -0.572 25934
40 1 . 1 1 19 19 LYS N N 19 124.529 124.529 120.806 3.723 25934
41 1 . 1 1 19 19 LYS HA H 19 3.963 3.963 4.350 -0.387 25934
42 1 . 1 1 19 19 LYS H H 19 8.396 8.396 7.753 0.643 25934
43 1 . 1 1 20 20 ILE N N 20 122.902 122.902 124.804 -1.902 25934
44 1 . 1 1 20 20 ILE HA H 20 4.619 4.619 5.109 -0.490 25934
45 1 . 1 1 20 20 ILE H H 20 7.793 7.793 8.133 -0.340 25934
46 1 . 1 1 21 21 PHE N N 21 126.244 126.244 126.515 -0.271 25934
47 1 . 1 1 21 21 PHE HA H 21 4.760 4.760 4.909 -0.149 25934
48 1 . 1 1 21 21 PHE H H 21 9.361 9.361 9.135 0.226 25934
49 1 . 1 1 22 22 ARG N N 22 125.051 125.051 121.926 3.125 25934
50 1 . 1 1 22 22 ARG HA H 22 4.407 4.407 4.394 0.013 25934
51 1 . 1 1 22 22 ARG H H 22 9.016 9.016 8.703 0.313 25934
52 1 . 1 1 23 23 TRP N N 23 118.871 118.871 117.778 1.093 25934
53 1 . 1 1 23 23 TRP HA H 23 5.328 5.328 4.906 0.422 25934
54 1 . 1 1 23 23 TRP H H 23 7.986 7.986 7.821 0.165 25934
55 1 . 1 1 24 24 ARG N N 24 130.190 130.190 122.837 7.353 25934
56 1 . 1 1 24 24 ARG HA H 24 3.041 3.041 3.616 -0.575 25934
57 1 . 1 1 24 24 ARG H H 24 9.358 9.358 8.937 0.421 25934
58 1 . 1 1 25 25 VAL N N 25 115.735 115.735 117.880 -2.145 25934
59 1 . 1 1 25 25 VAL HA H 25 3.802 3.802 3.784 0.018 25934
60 1 . 1 1 25 25 VAL H H 25 8.598 8.598 8.256 0.342 25934
61 1 . 1 1 26 26 ASN N N 26 119.272 119.272 117.677 1.595 25934
62 1 . 1 1 26 26 ASN HA H 26 4.613 4.613 4.481 0.132 25934
63 1 . 1 1 26 26 ASN H H 26 6.907 6.907 8.447 -1.540 25934
64 1 . 1 1 27 27 PHE N N 27 124.971 124.971 122.712 2.259 25934
65 1 . 1 1 27 27 PHE HA H 27 3.013 3.013 3.282 -0.269 25934
66 1 . 1 1 27 27 PHE H H 27 7.487 7.487 7.374 0.113 25934
67 1 . 1 1 28 28 ILE N N 28 119.280 119.280 118.424 0.856 25934
68 1 . 1 1 28 28 ILE HA H 28 3.277 3.277 3.433 -0.156 25934
69 1 . 1 1 28 28 ILE H H 28 8.458 8.458 8.513 -0.055 25934
70 1 . 1 1 29 29 ARG N N 29 119.668 119.668 120.319 -0.651 25934
71 1 . 1 1 29 29 ARG HA H 29 3.900 3.900 3.832 0.068 25934
72 1 . 1 1 29 29 ARG H H 29 7.577 7.577 7.734 -0.157 25934
73 1 . 1 1 30 30 HIS N N 30 120.050 120.050 118.998 1.052 25934
74 1 . 1 1 30 30 HIS HA H 30 4.258 4.258 4.277 -0.019 25934
75 1 . 1 1 30 30 HIS H H 30 7.620 7.620 7.773 -0.154 25934
76 1 . 1 1 31 31 LEU N N 31 120.143 120.143 117.894 2.249 25934
77 1 . 1 1 31 31 LEU HA H 31 3.773 3.773 3.855 -0.082 25934
78 1 . 1 1 31 31 LEU H H 31 8.005 8.005 7.889 0.116 25934
79 1 . 1 1 32 32 ARG N N 32 118.157 118.157 119.205 -1.048 25934
80 1 . 1 1 32 32 ARG HA H 32 4.066 4.066 4.008 0.058 25934
81 1 . 1 1 32 32 ARG H H 32 7.975 7.975 7.997 -0.022 25934
82 1 . 1 1 33 33 SER N N 33 115.082 115.082 113.781 1.301 25934
83 1 . 1 1 33 33 SER HA H 33 4.327 4.327 4.469 -0.142 25934
84 1 . 1 1 33 33 SER H H 33 7.754 7.754 7.658 0.096 25934
85 1 . 1 1 34 34 ARG N N 34 121.862 121.862 120.890 0.972 25934
86 1 . 1 1 34 34 ARG HA H 34 4.190 4.190 4.076 0.114 25934
87 1 . 1 1 34 34 ARG H H 34 7.558 7.558 7.486 0.072 25934
88 1 . 1 1 35 35 ARG N N 35 121.550 121.550 120.022 1.528 25934
89 1 . 1 1 35 35 ARG HA H 35 4.284 4.284 4.206 0.078 25934
90 1 . 1 1 35 35 ARG H H 35 8.030 8.030 8.096 -0.065 25934
91 1 . 1 1 36 36 GLU N N 36 122.012 122.012 119.800 2.212 25934
92 1 . 1 1 36 36 GLU HA H 36 4.318 4.318 4.358 -0.040 25934
93 1 . 1 1 36 36 GLU H H 36 8.274 8.274 8.238 0.036 25934
94 1 . 1 1 37 37 GLN N N 37 121.601 121.601 118.701 2.900 25934
95 1 . 1 1 37 37 GLN HA H 37 4.269 4.269 4.385 -0.116 25934
96 1 . 1 1 37 37 GLN H H 37 8.238 8.238 7.875 0.363 25934
97 1 . 1 1 38 38 LYS N N 38 124.607 124.607 121.065 3.542 25934
98 1 . 1 1 38 38 LYS HA H 38 4.595 4.595 4.599 -0.004 25934
99 1 . 1 1 38 38 LYS H H 38 8.348 8.348 8.366 -0.018 25934
100 1 . 1 1 39 39 PRO HA H 39 4.416 4.416 4.366 0.050 25934
101 1 . 1 1 40 40 HIS N N 40 120.882 120.882 116.874 4.008 25934
102 1 . 1 1 40 40 HIS HA H 40 4.639 4.639 4.558 0.081 25934
103 1 . 1 1 40 40 HIS H H 40 8.565 8.565 8.184 0.381 25934
stop_
save_