data_25881
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25881
_Entry.PDB_ID 2N95
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 25881
_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 -1 -1 PRO HA H -1 4.293 4.293 4.680 -0.387 25881
2 1 1 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 63.030 -0.028 25881
3 1 1 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 31.512 0.705 25881
4 1 1 . 1 1 1 1 MET HA H 1 3.967 3.967 4.438 -0.471 25881
5 1 1 . 1 1 1 1 MET CA C 1 57.335 57.335 55.673 1.662 25881
6 1 1 . 1 1 1 1 MET CB C 1 34.180 34.180 33.136 1.044 25881
7 1 1 . 1 1 2 2 VAL C C 2 175.654 175.654 175.685 -0.031 25881
8 1 1 . 1 1 2 2 VAL CA C 2 55.183 55.183 61.368 -6.185 25881
9 1 1 . 1 1 2 2 VAL CB C 2 33.173 33.173 31.455 1.718 25881
10 1 1 . 1 1 3 3 SER N N 3 121.996 121.996 117.414 4.582 25881
11 1 1 . 1 1 3 3 SER HA H 3 4.323 4.323 4.249 0.074 25881
12 1 1 . 1 1 3 3 SER C C 3 176.021 176.021 175.282 0.739 25881
13 1 1 . 1 1 3 3 SER CA C 3 62.208 62.208 58.925 3.283 25881
14 1 1 . 1 1 3 3 SER H H 3 8.103 8.103 8.148 -0.045 25881
15 1 1 . 1 1 4 4 SER N N 4 119.715 119.715 118.971 0.744 25881
16 1 1 . 1 1 4 4 SER HA H 4 4.317 4.317 4.475 -0.158 25881
17 1 1 . 1 1 4 4 SER C C 4 174.010 174.010 173.877 0.133 25881
18 1 1 . 1 1 4 4 SER CA C 4 58.177 58.177 58.722 -0.545 25881
19 1 1 . 1 1 4 4 SER CB C 4 63.763 63.763 61.670 2.093 25881
20 1 1 . 1 1 4 4 SER H H 4 8.298 8.298 8.510 -0.212 25881
21 1 1 . 1 1 5 5 ALA N N 5 126.016 126.016 123.959 2.057 25881
22 1 1 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.600 -0.431 25881
23 1 1 . 1 1 5 5 ALA C C 5 177.297 177.297 174.931 2.366 25881
24 1 1 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.628 0.756 25881
25 1 1 . 1 1 5 5 ALA CB C 5 19.106 19.106 20.908 -1.802 25881
26 1 1 . 1 1 5 5 ALA H H 5 8.119 8.119 8.019 0.100 25881
27 1 1 . 1 1 6 6 VAL N N 6 119.174 119.174 119.347 -0.173 25881
28 1 1 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.449 -0.500 25881
29 1 1 . 1 1 6 6 VAL C C 6 175.743 175.743 174.399 1.344 25881
30 1 1 . 1 1 6 6 VAL CA C 6 61.668 61.668 60.621 1.047 25881
31 1 1 . 1 1 6 6 VAL CB C 6 32.841 32.841 36.193 -3.352 25881
32 1 1 . 1 1 6 6 VAL H H 6 7.861 7.861 8.403 -0.542 25881
33 1 1 . 1 1 7 7 LYS N N 7 123.999 123.999 124.969 -0.970 25881
34 1 1 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.672 -0.505 25881
35 1 1 . 1 1 7 7 LYS C C 7 175.665 175.665 175.421 0.244 25881
36 1 1 . 1 1 7 7 LYS CA C 7 55.290 55.290 53.984 1.306 25881
37 1 1 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.450 0.091 25881
38 1 1 . 1 1 7 7 LYS H H 7 8.054 8.054 8.342 -0.288 25881
39 1 1 . 1 1 8 8 CYS N N 8 121.428 121.428 121.576 -0.148 25881
40 1 1 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.495 -0.852 25881
41 1 1 . 1 1 8 8 CYS C C 8 177.383 177.383 176.798 0.585 25881
42 1 1 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.571 0.195 25881
43 1 1 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.486 4.423 25881
44 1 1 . 1 1 8 8 CYS H H 8 8.539 8.539 8.789 -0.250 25881
45 1 1 . 1 1 9 9 GLY N N 9 118.862 118.862 116.422 2.440 25881
46 1 1 . 1 1 9 9 GLY C C 9 172.770 172.770 175.149 -2.379 25881
47 1 1 . 1 1 9 9 GLY CA C 9 46.144 46.144 46.276 -0.132 25881
48 1 1 . 1 1 9 9 GLY H H 9 9.365 9.365 9.262 0.103 25881
49 1 1 . 1 1 10 10 ILE N N 10 122.885 122.885 118.928 3.957 25881
50 1 1 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.276 -0.294 25881
51 1 1 . 1 1 10 10 ILE C C 10 175.980 175.980 175.211 0.769 25881
52 1 1 . 1 1 10 10 ILE CA C 10 63.056 63.056 63.029 0.027 25881
53 1 1 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.099 -1.155 25881
54 1 1 . 1 1 10 10 ILE H H 10 8.972 8.972 7.389 1.583 25881
55 1 1 . 1 1 11 11 CYS N N 11 118.245 118.245 113.389 4.856 25881
56 1 1 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.823 -0.174 25881
57 1 1 . 1 1 11 11 CYS C C 11 176.780 176.780 174.985 1.795 25881
58 1 1 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.442 1.652 25881
59 1 1 . 1 1 11 11 CYS CB C 11 31.972 31.972 29.625 2.347 25881
60 1 1 . 1 1 11 11 CYS H H 11 8.466 8.466 7.576 0.890 25881
61 1 1 . 1 1 12 12 ARG N N 12 116.067 116.067 120.336 -4.269 25881
62 1 1 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.102 0.114 25881
63 1 1 . 1 1 12 12 ARG C C 12 175.637 175.637 176.675 -1.038 25881
64 1 1 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.777 1.183 25881
65 1 1 . 1 1 12 12 ARG CB C 12 27.104 27.104 27.031 0.073 25881
66 1 1 . 1 1 12 12 ARG H H 12 7.255 7.255 8.544 -1.289 25881
67 1 1 . 1 1 13 13 GLY N N 13 109.951 109.951 106.786 3.165 25881
68 1 1 . 1 1 13 13 GLY C C 13 173.169 173.169 173.787 -0.618 25881
69 1 1 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.913 -1.609 25881
70 1 1 . 1 1 13 13 GLY H H 13 8.795 8.795 8.002 0.793 25881
71 1 1 . 1 1 14 14 VAL N N 14 113.644 113.644 115.262 -1.618 25881
72 1 1 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.752 -0.708 25881
73 1 1 . 1 1 14 14 VAL C C 14 174.970 174.970 174.311 0.659 25881
74 1 1 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.887 2.344 25881
75 1 1 . 1 1 14 14 VAL CB C 14 33.838 33.838 34.074 -0.236 25881
76 1 1 . 1 1 14 14 VAL H H 14 7.266 7.266 7.794 -0.528 25881
77 1 1 . 1 1 15 15 ASP N N 15 119.913 119.913 119.008 0.905 25881
78 1 1 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.667 -0.436 25881
79 1 1 . 1 1 15 15 ASP C C 15 176.279 176.279 176.649 -0.370 25881
80 1 1 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.531 0.492 25881
81 1 1 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.903 -0.956 25881
82 1 1 . 1 1 15 15 ASP H H 15 8.223 8.223 8.363 -0.140 25881
83 1 1 . 1 1 16 16 GLY N N 16 109.534 109.534 107.101 2.433 25881
84 1 1 . 1 1 16 16 GLY C C 16 173.120 173.120 174.931 -1.811 25881
85 1 1 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.181 1.915 25881
86 1 1 . 1 1 16 16 GLY H H 16 8.617 8.617 8.857 -0.240 25881
87 1 1 . 1 1 17 17 LYS N N 17 121.534 121.534 123.393 -1.859 25881
88 1 1 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.122 -0.477 25881
89 1 1 . 1 1 17 17 LYS C C 17 175.029 175.029 177.227 -2.198 25881
90 1 1 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.411 -0.900 25881
91 1 1 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.735 0.409 25881
92 1 1 . 1 1 17 17 LYS H H 17 7.318 7.318 7.728 -0.410 25881
93 1 1 . 1 1 18 18 TYR N N 18 119.391 119.391 119.938 -0.547 25881
94 1 1 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.709 -0.257 25881
95 1 1 . 1 1 18 18 TYR C C 18 174.241 174.241 174.691 -0.450 25881
96 1 1 . 1 1 18 18 TYR CA C 18 55.548 55.548 56.115 -0.567 25881
97 1 1 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.151 -1.655 25881
98 1 1 . 1 1 18 18 TYR H H 18 7.661 7.661 8.138 -0.477 25881
99 1 1 . 1 1 19 19 LYS N N 19 120.140 120.140 121.508 -1.368 25881
100 1 1 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.567 0.374 25881
101 1 1 . 1 1 19 19 LYS C C 19 176.321 176.321 174.571 1.750 25881
102 1 1 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.145 0.419 25881
103 1 1 . 1 1 19 19 LYS CB C 19 36.018 36.018 36.190 -0.172 25881
104 1 1 . 1 1 19 19 LYS H H 19 8.395 8.395 8.411 -0.016 25881
105 1 1 . 1 1 20 20 CYS N N 20 131.127 131.127 124.476 6.651 25881
106 1 1 . 1 1 20 20 CYS HA H 20 4.931 4.931 4.986 -0.055 25881
107 1 1 . 1 1 20 20 CYS C C 20 176.321 176.321 173.967 2.354 25881
108 1 1 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.531 1.762 25881
109 1 1 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.882 3.984 25881
110 1 1 . 1 1 20 20 CYS H H 20 9.391 9.391 8.552 0.839 25881
111 1 1 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.408 -0.008 25881
112 1 1 . 1 1 21 21 PRO C C 21 176.764 176.764 176.580 0.184 25881
113 1 1 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.305 0.130 25881
114 1 1 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.496 0.829 25881
115 1 1 . 1 1 22 22 LYS N N 22 120.217 120.217 118.781 1.436 25881
116 1 1 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.341 -0.143 25881
117 1 1 . 1 1 22 22 LYS C C 22 176.798 176.798 177.423 -0.625 25881
118 1 1 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.517 0.110 25881
119 1 1 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.599 0.663 25881
120 1 1 . 1 1 22 22 LYS H H 22 8.550 8.550 8.487 0.063 25881
121 1 1 . 1 1 23 23 CYS N N 23 115.450 115.450 113.759 1.691 25881
122 1 1 . 1 1 23 23 CYS HA H 23 4.987 4.987 5.002 -0.015 25881
123 1 1 . 1 1 23 23 CYS C C 23 176.434 176.434 176.184 0.250 25881
124 1 1 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.434 -0.279 25881
125 1 1 . 1 1 23 23 CYS CB C 23 32.482 32.482 30.927 1.555 25881
126 1 1 . 1 1 23 23 CYS H H 23 7.886 7.886 8.231 -0.345 25881
127 1 1 . 1 1 24 24 GLY N N 24 112.961 112.961 110.659 2.302 25881
128 1 1 . 1 1 24 24 GLY C C 24 173.369 173.369 173.726 -0.357 25881
129 1 1 . 1 1 24 24 GLY CA C 24 46.152 46.152 44.930 1.222 25881
130 1 1 . 1 1 24 24 GLY H H 24 7.958 7.958 8.236 -0.278 25881
131 1 1 . 1 1 25 25 VAL N N 25 123.968 123.968 119.985 3.983 25881
132 1 1 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.155 -0.176 25881
133 1 1 . 1 1 25 25 VAL C C 25 173.934 173.934 174.475 -0.541 25881
134 1 1 . 1 1 25 25 VAL CA C 25 63.136 63.136 60.998 2.139 25881
135 1 1 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.665 -1.706 25881
136 1 1 . 1 1 25 25 VAL H H 25 8.348 8.348 7.402 0.946 25881
137 1 1 . 1 1 26 26 ARG N N 26 125.641 125.641 124.731 0.910 25881
138 1 1 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.652 0.608 25881
139 1 1 . 1 1 26 26 ARG C C 26 177.008 177.008 175.384 1.624 25881
140 1 1 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.755 -0.427 25881
141 1 1 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.210 -1.887 25881
142 1 1 . 1 1 26 26 ARG H H 26 8.379 8.379 8.303 0.076 25881
143 1 1 . 1 1 27 27 TYR N N 27 117.706 117.706 119.243 -1.537 25881
144 1 1 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.070 1.623 25881
145 1 1 . 1 1 27 27 TYR C C 27 175.404 175.404 176.416 -1.012 25881
146 1 1 . 1 1 27 27 TYR CA C 27 55.476 55.476 53.930 1.546 25881
147 1 1 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.662 2.241 25881
148 1 1 . 1 1 27 27 TYR H H 27 8.631 8.631 7.990 0.641 25881
149 1 1 . 1 1 28 28 CYS N N 28 118.515 118.515 116.009 2.506 25881
150 1 1 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.932 -0.027 25881
151 1 1 . 1 1 28 28 CYS C C 28 176.186 176.186 175.113 1.073 25881
152 1 1 . 1 1 28 28 CYS CA C 28 58.614 58.614 57.626 0.988 25881
153 1 1 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.497 7.330 25881
154 1 1 . 1 1 28 28 CYS H H 28 8.817 8.817 8.293 0.524 25881
155 1 1 . 1 1 29 29 SER N N 29 114.067 114.067 112.224 1.843 25881
156 1 1 . 1 1 29 29 SER HA H 29 4.877 4.877 3.650 1.227 25881
157 1 1 . 1 1 29 29 SER C C 29 178.077 178.077 173.301 4.776 25881
158 1 1 . 1 1 29 29 SER CA C 29 57.260 57.260 56.882 0.378 25881
159 1 1 . 1 1 29 29 SER CB C 29 65.051 65.051 64.078 0.973 25881
160 1 1 . 1 1 29 29 SER H H 29 7.400 7.400 7.204 0.196 25881
161 1 1 . 1 1 30 30 LEU HA H 30 4.039 4.039 4.247 -0.208 25881
162 1 1 . 1 1 30 30 LEU C C 30 178.077 178.077 177.255 0.822 25881
163 1 1 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.220 0.231 25881
164 1 1 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.584 -0.355 25881
165 1 1 . 1 1 30 30 LEU H H 30 6.951 6.951 8.432 -1.481 25881
166 1 1 . 1 1 31 31 LYS N N 31 118.534 118.534 119.684 -1.150 25881
167 1 1 . 1 1 31 31 LYS HA H 31 3.790 3.790 3.982 -0.192 25881
168 1 1 . 1 1 31 31 LYS C C 31 179.162 179.162 177.877 1.285 25881
169 1 1 . 1 1 31 31 LYS CA C 31 59.867 59.867 59.055 0.812 25881
170 1 1 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.007 0.900 25881
171 1 1 . 1 1 31 31 LYS H H 31 8.030 8.030 8.610 -0.580 25881
172 1 1 . 1 1 32 32 CYS N N 32 118.700 118.700 116.739 1.961 25881
173 1 1 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.500 -0.515 25881
174 1 1 . 1 1 32 32 CYS C C 32 176.766 176.766 176.925 -0.159 25881
175 1 1 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.642 6.037 25881
176 1 1 . 1 1 32 32 CYS CB C 32 29.549 29.549 26.724 2.825 25881
177 1 1 . 1 1 32 32 CYS H H 32 7.424 7.424 7.962 -0.538 25881
178 1 1 . 1 1 33 33 TYR N N 33 118.151 118.151 123.189 -5.038 25881
179 1 1 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.277 -0.167 25881
180 1 1 . 1 1 33 33 TYR C C 33 178.549 178.549 176.833 1.716 25881
181 1 1 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.476 2.711 25881
182 1 1 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.644 1.202 25881
183 1 1 . 1 1 33 33 TYR H H 33 7.918 7.918 7.568 0.350 25881
184 1 1 . 1 1 34 34 LYS N N 34 114.631 114.631 119.467 -4.836 25881
185 1 1 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.245 -0.323 25881
186 1 1 . 1 1 34 34 LYS C C 34 174.991 174.991 175.259 -0.268 25881
187 1 1 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.983 -0.032 25881
188 1 1 . 1 1 34 34 LYS CB C 34 32.145 32.145 30.934 1.211 25881
189 1 1 . 1 1 34 34 LYS H H 34 7.939 7.939 7.767 0.172 25881
190 1 1 . 1 1 35 35 ASP N N 35 121.194 121.194 120.379 0.815 25881
191 1 1 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.750 -0.456 25881
192 1 1 . 1 1 35 35 ASP C C 35 175.480 175.480 174.638 0.842 25881
193 1 1 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.233 1.105 25881
194 1 1 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.721 -3.360 25881
195 1 1 . 1 1 35 35 ASP H H 35 7.115 7.115 8.040 -0.925 25881
196 1 1 . 1 1 36 36 ALA N N 36 130.311 130.311 125.881 4.430 25881
197 1 1 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.914 -1.027 25881
198 1 1 . 1 1 36 36 ALA C C 36 177.717 177.717 176.277 1.440 25881
199 1 1 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.653 1.873 25881
200 1 1 . 1 1 36 36 ALA CB C 36 18.711 18.711 18.952 -0.241 25881
201 1 1 . 1 1 36 36 ALA H H 36 8.073 8.073 8.608 -0.535 25881
202 1 1 . 1 1 37 37 ALA N N 37 117.133 117.133 122.345 -5.212 25881
203 1 1 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.472 -0.386 25881
204 1 1 . 1 1 37 37 ALA C C 37 178.989 178.989 178.302 0.687 25881
205 1 1 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.239 -0.028 25881
206 1 1 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.450 -1.303 25881
207 1 1 . 1 1 37 37 ALA H H 37 7.839 7.839 8.996 -1.157 25881
208 1 1 . 1 1 38 38 LYS N N 38 114.127 114.127 116.684 -2.557 25881
209 1 1 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.510 -0.215 25881
210 1 1 . 1 1 38 38 LYS C C 38 175.690 175.690 176.890 -1.200 25881
211 1 1 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.818 -0.615 25881
212 1 1 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.551 1.597 25881
213 1 1 . 1 1 38 38 LYS H H 38 7.292 7.292 9.245 -1.953 25881
214 1 1 . 1 1 39 39 HIS N N 39 122.110 122.110 122.310 -0.200 25881
215 1 1 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.513 0.250 25881
216 1 1 . 1 1 39 39 HIS C C 39 171.783 171.783 173.736 -1.953 25881
217 1 1 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.482 -2.847 25881
218 1 1 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.449 -1.820 25881
219 1 1 . 1 1 39 39 HIS H H 39 8.393 8.393 8.535 -0.142 25881
220 1 1 . 1 1 40 40 VAL N N 40 123.393 123.393 126.298 -2.905 25881
221 1 1 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.077 -0.330 25881
222 1 1 . 1 1 40 40 VAL C C 40 175.292 175.292 175.446 -0.154 25881
223 1 1 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.813 -0.649 25881
224 1 1 . 1 1 40 40 VAL CB C 40 34.132 34.132 32.691 1.441 25881
225 1 1 . 1 1 40 40 VAL H H 40 7.811 7.811 7.771 0.040 25881
226 1 1 . 1 1 41 41 HIS N N 41 125.669 125.669 125.577 0.092 25881
227 1 1 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.709 0.169 25881
228 1 1 . 1 1 41 41 HIS C C 41 174.640 174.640 174.950 -0.310 25881
229 1 1 . 1 1 41 41 HIS CA C 41 52.900 52.900 55.086 -2.186 25881
230 1 1 . 1 1 41 41 HIS CB C 41 30.067 30.067 29.506 0.561 25881
231 1 1 . 1 1 41 41 HIS H H 41 8.512 8.512 8.675 -0.163 25881
232 1 1 . 1 1 42 42 LYS N N 42 123.564 123.564 122.343 1.221 25881
233 1 1 . 1 1 42 42 LYS C C 42 176.739 176.739 177.405 -0.666 25881
234 1 1 . 1 1 42 42 LYS CA C 42 56.320 56.320 57.369 -1.049 25881
235 1 1 . 1 1 42 42 LYS CB C 42 33.229 33.229 33.135 0.094 25881
236 1 1 . 1 1 42 42 LYS H H 42 8.668 8.668 8.413 0.255 25881
237 1 1 . 1 1 43 43 GLU N N 43 122.633 122.633 117.846 4.787 25881
238 1 1 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.039 0.071 25881
239 1 1 . 1 1 43 43 GLU C C 43 176.569 176.569 176.291 0.278 25881
240 1 1 . 1 1 43 43 GLU CA C 43 57.097 57.097 58.471 -1.374 25881
241 1 1 . 1 1 43 43 GLU CB C 43 29.948 29.948 28.348 1.600 25881
242 1 1 . 1 1 43 43 GLU H H 43 8.590 8.590 8.604 -0.014 25881
243 1 1 . 1 1 44 44 SER N N 44 115.147 115.147 113.981 1.166 25881
244 1 1 . 1 1 44 44 SER HA H 44 4.268 4.268 4.669 -0.401 25881
245 1 1 . 1 1 44 44 SER C C 44 174.336 174.336 174.395 -0.059 25881
246 1 1 . 1 1 44 44 SER CA C 44 58.348 58.348 57.220 1.128 25881
247 1 1 . 1 1 44 44 SER CB C 44 63.724 63.724 64.639 -0.915 25881
248 1 1 . 1 1 44 44 SER H H 44 8.105 8.105 7.902 0.203 25881
249 1 1 . 1 1 45 45 GLU N N 45 122.849 122.849 119.379 3.470 25881
250 1 1 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.145 0.018 25881
251 1 1 . 1 1 45 45 GLU C C 45 175.304 175.304 176.748 -1.444 25881
252 1 1 . 1 1 45 45 GLU CA C 45 56.412 56.412 58.630 -2.218 25881
253 1 1 . 1 1 45 45 GLU CB C 45 30.130 30.130 30.044 0.086 25881
254 1 1 . 1 1 45 45 GLU H H 45 8.183 8.183 8.691 -0.508 25881
255 1 2 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.563 -0.270 25881
256 1 2 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 62.888 0.114 25881
257 1 2 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 30.683 1.536 25881
258 1 2 . 1 1 1 1 MET HA H 1 3.967 3.967 4.541 -0.574 25881
259 1 2 . 1 1 1 1 MET CA C 1 57.335 57.335 54.068 3.267 25881
260 1 2 . 1 1 1 1 MET CB C 1 34.180 34.180 35.380 -1.200 25881
261 1 2 . 1 1 2 2 VAL C C 2 175.654 175.654 176.170 -0.516 25881
262 1 2 . 1 1 2 2 VAL CA C 2 55.183 55.183 64.818 -9.635 25881
263 1 2 . 1 1 2 2 VAL CB C 2 33.173 33.173 32.096 1.077 25881
264 1 2 . 1 1 3 3 SER N N 3 121.996 121.996 115.377 6.619 25881
265 1 2 . 1 1 3 3 SER HA H 3 4.323 4.323 4.513 -0.190 25881
266 1 2 . 1 1 3 3 SER C C 3 176.021 176.021 174.491 1.530 25881
267 1 2 . 1 1 3 3 SER CA C 3 62.208 62.208 59.258 2.950 25881
268 1 2 . 1 1 3 3 SER H H 3 8.103 8.103 8.132 -0.029 25881
269 1 2 . 1 1 4 4 SER N N 4 119.715 119.715 115.004 4.711 25881
270 1 2 . 1 1 4 4 SER HA H 4 4.317 4.317 4.030 0.287 25881
271 1 2 . 1 1 4 4 SER C C 4 174.010 174.010 172.861 1.149 25881
272 1 2 . 1 1 4 4 SER CA C 4 58.177 58.177 58.853 -0.676 25881
273 1 2 . 1 1 4 4 SER CB C 4 63.763 63.763 61.905 1.858 25881
274 1 2 . 1 1 4 4 SER H H 4 8.298 8.298 8.416 -0.118 25881
275 1 2 . 1 1 5 5 ALA N N 5 126.016 126.016 122.357 3.659 25881
276 1 2 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.514 -0.345 25881
277 1 2 . 1 1 5 5 ALA C C 5 177.297 177.297 175.813 1.484 25881
278 1 2 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.422 0.962 25881
279 1 2 . 1 1 5 5 ALA CB C 5 19.106 19.106 21.070 -1.964 25881
280 1 2 . 1 1 5 5 ALA H H 5 8.119 8.119 7.704 0.415 25881
281 1 2 . 1 1 6 6 VAL N N 6 119.174 119.174 121.052 -1.878 25881
282 1 2 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.413 -0.465 25881
283 1 2 . 1 1 6 6 VAL C C 6 175.743 175.743 174.752 0.991 25881
284 1 2 . 1 1 6 6 VAL CA C 6 61.668 61.668 60.889 0.779 25881
285 1 2 . 1 1 6 6 VAL CB C 6 32.841 32.841 33.971 -1.130 25881
286 1 2 . 1 1 6 6 VAL H H 6 7.861 7.861 8.317 -0.456 25881
287 1 2 . 1 1 7 7 LYS N N 7 123.999 123.999 124.546 -0.547 25881
288 1 2 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.641 -0.474 25881
289 1 2 . 1 1 7 7 LYS C C 7 175.665 175.665 175.380 0.285 25881
290 1 2 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.337 0.953 25881
291 1 2 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.935 -0.395 25881
292 1 2 . 1 1 7 7 LYS H H 7 8.054 8.054 8.153 -0.099 25881
293 1 2 . 1 1 8 8 CYS N N 8 121.428 121.428 121.240 0.188 25881
294 1 2 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.436 -0.793 25881
295 1 2 . 1 1 8 8 CYS C C 8 177.383 177.383 176.568 0.815 25881
296 1 2 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.737 0.029 25881
297 1 2 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.544 4.365 25881
298 1 2 . 1 1 8 8 CYS H H 8 8.539 8.539 8.811 -0.272 25881
299 1 2 . 1 1 9 9 GLY N N 9 118.862 118.862 116.381 2.481 25881
300 1 2 . 1 1 9 9 GLY C C 9 172.770 172.770 175.176 -2.406 25881
301 1 2 . 1 1 9 9 GLY CA C 9 46.144 46.144 46.377 -0.233 25881
302 1 2 . 1 1 9 9 GLY H H 9 9.365 9.365 8.949 0.416 25881
303 1 2 . 1 1 10 10 ILE N N 10 122.885 122.885 119.400 3.485 25881
304 1 2 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.220 -0.238 25881
305 1 2 . 1 1 10 10 ILE C C 10 175.980 175.980 175.407 0.573 25881
306 1 2 . 1 1 10 10 ILE CA C 10 63.056 63.056 63.455 -0.399 25881
307 1 2 . 1 1 10 10 ILE CB C 10 37.944 37.944 38.989 -1.045 25881
308 1 2 . 1 1 10 10 ILE H H 10 8.972 8.972 7.410 1.562 25881
309 1 2 . 1 1 11 11 CYS N N 11 118.245 118.245 113.716 4.529 25881
310 1 2 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.804 -0.155 25881
311 1 2 . 1 1 11 11 CYS C C 11 176.780 176.780 175.000 1.780 25881
312 1 2 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.380 1.714 25881
313 1 2 . 1 1 11 11 CYS CB C 11 31.972 31.972 29.205 2.767 25881
314 1 2 . 1 1 11 11 CYS H H 11 8.466 8.466 7.599 0.867 25881
315 1 2 . 1 1 12 12 ARG N N 12 116.067 116.067 120.167 -4.100 25881
316 1 2 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.110 0.106 25881
317 1 2 . 1 1 12 12 ARG C C 12 175.637 175.637 176.757 -1.120 25881
318 1 2 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.834 1.126 25881
319 1 2 . 1 1 12 12 ARG CB C 12 27.104 27.104 27.066 0.038 25881
320 1 2 . 1 1 12 12 ARG H H 12 7.255 7.255 8.522 -1.267 25881
321 1 2 . 1 1 13 13 GLY N N 13 109.951 109.951 106.799 3.152 25881
322 1 2 . 1 1 13 13 GLY C C 13 173.169 173.169 173.701 -0.532 25881
323 1 2 . 1 1 13 13 GLY CA C 13 44.304 44.304 46.023 -1.719 25881
324 1 2 . 1 1 13 13 GLY H H 13 8.795 8.795 8.090 0.705 25881
325 1 2 . 1 1 14 14 VAL N N 14 113.644 113.644 115.965 -2.321 25881
326 1 2 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.735 -0.691 25881
327 1 2 . 1 1 14 14 VAL C C 14 174.970 174.970 174.296 0.674 25881
328 1 2 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.907 2.324 25881
329 1 2 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.471 0.367 25881
330 1 2 . 1 1 14 14 VAL H H 14 7.266 7.266 7.795 -0.529 25881
331 1 2 . 1 1 15 15 ASP N N 15 119.913 119.913 118.845 1.068 25881
332 1 2 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.699 -0.468 25881
333 1 2 . 1 1 15 15 ASP C C 15 176.279 176.279 176.620 -0.341 25881
334 1 2 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.559 0.464 25881
335 1 2 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.782 -0.836 25881
336 1 2 . 1 1 15 15 ASP H H 15 8.223 8.223 8.376 -0.153 25881
337 1 2 . 1 1 16 16 GLY N N 16 109.534 109.534 107.288 2.246 25881
338 1 2 . 1 1 16 16 GLY C C 16 173.120 173.120 174.838 -1.718 25881
339 1 2 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.102 1.994 25881
340 1 2 . 1 1 16 16 GLY H H 16 8.617 8.617 8.702 -0.085 25881
341 1 2 . 1 1 17 17 LYS N N 17 121.534 121.534 122.885 -1.351 25881
342 1 2 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.039 -0.394 25881
343 1 2 . 1 1 17 17 LYS C C 17 175.029 175.029 177.125 -2.096 25881
344 1 2 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.238 -0.727 25881
345 1 2 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.613 0.531 25881
346 1 2 . 1 1 17 17 LYS H H 17 7.318 7.318 7.746 -0.428 25881
347 1 2 . 1 1 18 18 TYR N N 18 119.391 119.391 120.482 -1.091 25881
348 1 2 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.596 -0.144 25881
349 1 2 . 1 1 18 18 TYR C C 18 174.241 174.241 174.832 -0.591 25881
350 1 2 . 1 1 18 18 TYR CA C 18 55.548 55.548 57.949 -2.401 25881
351 1 2 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.510 -2.014 25881
352 1 2 . 1 1 18 18 TYR H H 18 7.661 7.661 8.157 -0.496 25881
353 1 2 . 1 1 19 19 LYS N N 19 120.140 120.140 122.298 -2.158 25881
354 1 2 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.551 0.390 25881
355 1 2 . 1 1 19 19 LYS C C 19 176.321 176.321 174.385 1.936 25881
356 1 2 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.185 0.379 25881
357 1 2 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.812 0.206 25881
358 1 2 . 1 1 19 19 LYS H H 19 8.395 8.395 8.233 0.162 25881
359 1 2 . 1 1 20 20 CYS N N 20 131.127 131.127 124.890 6.237 25881
360 1 2 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.036 -0.105 25881
361 1 2 . 1 1 20 20 CYS C C 20 176.321 176.321 174.138 2.183 25881
362 1 2 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.678 1.613 25881
363 1 2 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.825 4.041 25881
364 1 2 . 1 1 20 20 CYS H H 20 9.391 9.391 8.643 0.748 25881
365 1 2 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.341 0.059 25881
366 1 2 . 1 1 21 21 PRO C C 21 176.764 176.764 176.918 -0.154 25881
367 1 2 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.700 -0.265 25881
368 1 2 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.659 0.666 25881
369 1 2 . 1 1 22 22 LYS N N 22 120.217 120.217 119.303 0.914 25881
370 1 2 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.200 -0.002 25881
371 1 2 . 1 1 22 22 LYS C C 22 176.798 176.798 178.073 -1.275 25881
372 1 2 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.978 -0.351 25881
373 1 2 . 1 1 22 22 LYS CB C 22 33.262 33.262 31.983 1.279 25881
374 1 2 . 1 1 22 22 LYS H H 22 8.550 8.550 8.436 0.114 25881
375 1 2 . 1 1 23 23 CYS N N 23 115.450 115.450 113.710 1.740 25881
376 1 2 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.941 0.046 25881
377 1 2 . 1 1 23 23 CYS C C 23 176.434 176.434 176.234 0.200 25881
378 1 2 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.486 -0.331 25881
379 1 2 . 1 1 23 23 CYS CB C 23 32.482 32.482 29.616 2.866 25881
380 1 2 . 1 1 23 23 CYS H H 23 7.886 7.886 8.557 -0.671 25881
381 1 2 . 1 1 24 24 GLY N N 24 112.961 112.961 110.965 1.996 25881
382 1 2 . 1 1 24 24 GLY C C 24 173.369 173.369 173.651 -0.282 25881
383 1 2 . 1 1 24 24 GLY CA C 24 46.152 46.152 44.940 1.212 25881
384 1 2 . 1 1 24 24 GLY H H 24 7.958 7.958 8.309 -0.351 25881
385 1 2 . 1 1 25 25 VAL N N 25 123.968 123.968 119.016 4.952 25881
386 1 2 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.132 -0.153 25881
387 1 2 . 1 1 25 25 VAL C C 25 173.934 173.934 174.516 -0.582 25881
388 1 2 . 1 1 25 25 VAL CA C 25 63.136 63.136 60.832 2.304 25881
389 1 2 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.459 -1.500 25881
390 1 2 . 1 1 25 25 VAL H H 25 8.348 8.348 7.300 1.048 25881
391 1 2 . 1 1 26 26 ARG N N 26 125.641 125.641 124.043 1.598 25881
392 1 2 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.746 0.514 25881
393 1 2 . 1 1 26 26 ARG C C 26 177.008 177.008 175.422 1.586 25881
394 1 2 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.736 -0.408 25881
395 1 2 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.562 -2.239 25881
396 1 2 . 1 1 26 26 ARG H H 26 8.379 8.379 8.262 0.117 25881
397 1 2 . 1 1 27 27 TYR N N 27 117.706 117.706 118.246 -0.540 25881
398 1 2 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.078 1.615 25881
399 1 2 . 1 1 27 27 TYR C C 27 175.404 175.404 176.300 -0.896 25881
400 1 2 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.260 1.216 25881
401 1 2 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.711 2.192 25881
402 1 2 . 1 1 27 27 TYR H H 27 8.631 8.631 8.438 0.194 25881
403 1 2 . 1 1 28 28 CYS N N 28 118.515 118.515 116.755 1.760 25881
404 1 2 . 1 1 28 28 CYS HA H 28 4.905 4.905 5.016 -0.111 25881
405 1 2 . 1 1 28 28 CYS C C 28 176.186 176.186 175.132 1.054 25881
406 1 2 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.215 0.399 25881
407 1 2 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.837 6.989 25881
408 1 2 . 1 1 28 28 CYS H H 28 8.817 8.817 8.373 0.444 25881
409 1 2 . 1 1 29 29 SER N N 29 114.067 114.067 113.004 1.063 25881
410 1 2 . 1 1 29 29 SER HA H 29 4.877 4.877 4.038 0.839 25881
411 1 2 . 1 1 29 29 SER C C 29 178.077 178.077 173.501 4.576 25881
412 1 2 . 1 1 29 29 SER CA C 29 57.260 57.260 57.183 0.077 25881
413 1 2 . 1 1 29 29 SER CB C 29 65.051 65.051 63.901 1.149 25881
414 1 2 . 1 1 29 29 SER H H 29 7.400 7.400 7.329 0.071 25881
415 1 2 . 1 1 30 30 LEU HA H 30 4.039 4.039 3.926 0.113 25881
416 1 2 . 1 1 30 30 LEU C C 30 178.077 178.077 178.403 -0.326 25881
417 1 2 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.494 -0.043 25881
418 1 2 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.391 -0.162 25881
419 1 2 . 1 1 30 30 LEU H H 30 6.951 6.951 8.449 -1.498 25881
420 1 2 . 1 1 31 31 LYS N N 31 118.534 118.534 119.577 -1.043 25881
421 1 2 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.048 -0.258 25881
422 1 2 . 1 1 31 31 LYS C C 31 179.162 179.162 177.683 1.479 25881
423 1 2 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.840 1.027 25881
424 1 2 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.460 0.447 25881
425 1 2 . 1 1 31 31 LYS H H 31 8.030 8.030 7.622 0.408 25881
426 1 2 . 1 1 32 32 CYS N N 32 118.700 118.700 116.753 1.947 25881
427 1 2 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.559 -0.574 25881
428 1 2 . 1 1 32 32 CYS C C 32 176.766 176.766 177.094 -0.328 25881
429 1 2 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.706 5.973 25881
430 1 2 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.259 2.290 25881
431 1 2 . 1 1 32 32 CYS H H 32 7.424 7.424 7.757 -0.333 25881
432 1 2 . 1 1 33 33 TYR N N 33 118.151 118.151 123.469 -5.318 25881
433 1 2 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.207 -0.097 25881
434 1 2 . 1 1 33 33 TYR C C 33 178.549 178.549 175.901 2.648 25881
435 1 2 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.680 2.507 25881
436 1 2 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.749 1.097 25881
437 1 2 . 1 1 33 33 TYR H H 33 7.918 7.918 7.961 -0.043 25881
438 1 2 . 1 1 34 34 LYS N N 34 114.631 114.631 117.704 -3.073 25881
439 1 2 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.271 -0.349 25881
440 1 2 . 1 1 34 34 LYS C C 34 174.991 174.991 175.362 -0.371 25881
441 1 2 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.324 0.627 25881
442 1 2 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.088 1.057 25881
443 1 2 . 1 1 34 34 LYS H H 34 7.939 7.939 7.543 0.396 25881
444 1 2 . 1 1 35 35 ASP N N 35 121.194 121.194 119.707 1.487 25881
445 1 2 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.718 -0.424 25881
446 1 2 . 1 1 35 35 ASP C C 35 175.480 175.480 174.906 0.574 25881
447 1 2 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.094 1.245 25881
448 1 2 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.302 -2.941 25881
449 1 2 . 1 1 35 35 ASP H H 35 7.115 7.115 7.714 -0.599 25881
450 1 2 . 1 1 36 36 ALA N N 36 130.311 130.311 126.350 3.961 25881
451 1 2 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.978 -1.091 25881
452 1 2 . 1 1 36 36 ALA C C 36 177.717 177.717 176.582 1.135 25881
453 1 2 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.500 2.026 25881
454 1 2 . 1 1 36 36 ALA CB C 36 18.711 18.711 18.873 -0.162 25881
455 1 2 . 1 1 36 36 ALA H H 36 8.073 8.073 8.580 -0.507 25881
456 1 2 . 1 1 37 37 ALA N N 37 117.133 117.133 122.542 -5.409 25881
457 1 2 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.402 -0.316 25881
458 1 2 . 1 1 37 37 ALA C C 37 178.989 178.989 178.604 0.385 25881
459 1 2 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.472 -0.261 25881
460 1 2 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.299 -1.151 25881
461 1 2 . 1 1 37 37 ALA H H 37 7.839 7.839 8.736 -0.897 25881
462 1 2 . 1 1 38 38 LYS N N 38 114.127 114.127 116.340 -2.213 25881
463 1 2 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.479 -0.184 25881
464 1 2 . 1 1 38 38 LYS C C 38 175.690 175.690 176.820 -1.130 25881
465 1 2 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.989 -0.786 25881
466 1 2 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.344 1.804 25881
467 1 2 . 1 1 38 38 LYS H H 38 7.292 7.292 9.197 -1.905 25881
468 1 2 . 1 1 39 39 HIS N N 39 122.110 122.110 121.506 0.604 25881
469 1 2 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.628 0.135 25881
470 1 2 . 1 1 39 39 HIS C C 39 171.783 171.783 173.021 -1.238 25881
471 1 2 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.592 -2.957 25881
472 1 2 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.955 -2.326 25881
473 1 2 . 1 1 39 39 HIS H H 39 8.393 8.393 7.912 0.481 25881
474 1 2 . 1 1 40 40 VAL N N 40 123.393 123.393 126.360 -2.967 25881
475 1 2 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.245 -0.498 25881
476 1 2 . 1 1 40 40 VAL C C 40 175.292 175.292 175.313 -0.021 25881
477 1 2 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.501 -0.337 25881
478 1 2 . 1 1 40 40 VAL CB C 40 34.132 34.132 34.967 -0.835 25881
479 1 2 . 1 1 40 40 VAL H H 40 7.811 7.811 8.209 -0.398 25881
480 1 2 . 1 1 41 41 HIS N N 41 125.669 125.669 125.040 0.629 25881
481 1 2 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.719 0.159 25881
482 1 2 . 1 1 41 41 HIS C C 41 174.640 174.640 174.603 0.037 25881
483 1 2 . 1 1 41 41 HIS CA C 41 52.900 52.900 55.456 -2.556 25881
484 1 2 . 1 1 41 41 HIS CB C 41 30.067 30.067 31.828 -1.761 25881
485 1 2 . 1 1 41 41 HIS H H 41 8.512 8.512 8.243 0.269 25881
486 1 2 . 1 1 42 42 LYS N N 42 123.564 123.564 121.282 2.282 25881
487 1 2 . 1 1 42 42 LYS C C 42 176.739 176.739 175.144 1.595 25881
488 1 2 . 1 1 42 42 LYS CA C 42 56.320 56.320 56.060 0.260 25881
489 1 2 . 1 1 42 42 LYS CB C 42 33.229 33.229 33.407 -0.178 25881
490 1 2 . 1 1 42 42 LYS H H 42 8.668 8.668 8.485 0.183 25881
491 1 2 . 1 1 43 43 GLU N N 43 122.633 122.633 121.682 0.951 25881
492 1 2 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.232 -0.122 25881
493 1 2 . 1 1 43 43 GLU C C 43 176.569 176.569 176.231 0.338 25881
494 1 2 . 1 1 43 43 GLU CA C 43 57.097 57.097 56.513 0.584 25881
495 1 2 . 1 1 43 43 GLU CB C 43 29.948 29.948 29.645 0.303 25881
496 1 2 . 1 1 43 43 GLU H H 43 8.590 8.590 8.239 0.351 25881
497 1 2 . 1 1 44 44 SER N N 44 115.147 115.147 123.970 -8.823 25881
498 1 2 . 1 1 44 44 SER HA H 44 4.268 4.268 4.452 -0.184 25881
499 1 2 . 1 1 44 44 SER C C 44 174.336 174.336 174.605 -0.269 25881
500 1 2 . 1 1 44 44 SER CA C 44 58.348 58.348 58.793 -0.445 25881
501 1 2 . 1 1 44 44 SER CB C 44 63.724 63.724 62.782 0.942 25881
502 1 2 . 1 1 44 44 SER H H 44 8.105 8.105 8.843 -0.738 25881
503 1 2 . 1 1 45 45 GLU N N 45 122.849 122.849 125.243 -2.394 25881
504 1 2 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.095 0.068 25881
505 1 2 . 1 1 45 45 GLU C C 45 175.304 175.304 176.396 -1.092 25881
506 1 2 . 1 1 45 45 GLU CA C 45 56.412 56.412 57.992 -1.580 25881
507 1 2 . 1 1 45 45 GLU CB C 45 30.130 30.130 30.126 0.004 25881
508 1 2 . 1 1 45 45 GLU H H 45 8.183 8.183 8.437 -0.254 25881
509 1 3 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.622 -0.329 25881
510 1 3 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 63.127 -0.125 25881
511 1 3 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 31.714 0.504 25881
512 1 3 . 1 1 1 1 MET HA H 1 3.967 3.967 4.767 -0.800 25881
513 1 3 . 1 1 1 1 MET CA C 1 57.335 57.335 54.837 2.498 25881
514 1 3 . 1 1 1 1 MET CB C 1 34.180 34.180 35.239 -1.059 25881
515 1 3 . 1 1 2 2 VAL C C 2 175.654 175.654 175.379 0.275 25881
516 1 3 . 1 1 2 2 VAL CA C 2 55.183 55.183 63.218 -8.035 25881
517 1 3 . 1 1 2 2 VAL CB C 2 33.173 33.173 30.441 2.732 25881
518 1 3 . 1 1 3 3 SER N N 3 121.996 121.996 120.760 1.236 25881
519 1 3 . 1 1 3 3 SER HA H 3 4.323 4.323 4.593 -0.270 25881
520 1 3 . 1 1 3 3 SER C C 3 176.021 176.021 173.898 2.123 25881
521 1 3 . 1 1 3 3 SER CA C 3 62.208 62.208 57.836 4.372 25881
522 1 3 . 1 1 3 3 SER H H 3 8.103 8.103 8.186 -0.083 25881
523 1 3 . 1 1 4 4 SER N N 4 119.715 119.715 118.147 1.568 25881
524 1 3 . 1 1 4 4 SER HA H 4 4.317 4.317 4.311 0.006 25881
525 1 3 . 1 1 4 4 SER C C 4 174.010 174.010 173.443 0.567 25881
526 1 3 . 1 1 4 4 SER CA C 4 58.177 58.177 58.448 -0.271 25881
527 1 3 . 1 1 4 4 SER CB C 4 63.763 63.763 62.921 0.842 25881
528 1 3 . 1 1 4 4 SER H H 4 8.298 8.298 8.397 -0.099 25881
529 1 3 . 1 1 5 5 ALA N N 5 126.016 126.016 122.839 3.177 25881
530 1 3 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.351 -0.182 25881
531 1 3 . 1 1 5 5 ALA C C 5 177.297 177.297 176.459 0.838 25881
532 1 3 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.684 0.700 25881
533 1 3 . 1 1 5 5 ALA CB C 5 19.106 19.106 19.972 -0.866 25881
534 1 3 . 1 1 5 5 ALA H H 5 8.119 8.119 7.791 0.328 25881
535 1 3 . 1 1 6 6 VAL N N 6 119.174 119.174 119.903 -0.729 25881
536 1 3 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.323 -0.375 25881
537 1 3 . 1 1 6 6 VAL C C 6 175.743 175.743 174.639 1.104 25881
538 1 3 . 1 1 6 6 VAL CA C 6 61.668 61.668 61.126 0.542 25881
539 1 3 . 1 1 6 6 VAL CB C 6 32.841 32.841 34.966 -2.125 25881
540 1 3 . 1 1 6 6 VAL H H 6 7.861 7.861 8.122 -0.261 25881
541 1 3 . 1 1 7 7 LYS N N 7 123.999 123.999 125.194 -1.195 25881
542 1 3 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.634 -0.467 25881
543 1 3 . 1 1 7 7 LYS C C 7 175.665 175.665 176.142 -0.477 25881
544 1 3 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.018 1.272 25881
545 1 3 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.410 0.131 25881
546 1 3 . 1 1 7 7 LYS H H 7 8.054 8.054 8.282 -0.228 25881
547 1 3 . 1 1 8 8 CYS N N 8 121.428 121.428 122.606 -1.178 25881
548 1 3 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.394 -0.751 25881
549 1 3 . 1 1 8 8 CYS C C 8 177.383 177.383 176.327 1.056 25881
550 1 3 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.828 -0.062 25881
551 1 3 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.655 4.254 25881
552 1 3 . 1 1 8 8 CYS H H 8 8.539 8.539 8.805 -0.266 25881
553 1 3 . 1 1 9 9 GLY N N 9 118.862 118.862 116.455 2.407 25881
554 1 3 . 1 1 9 9 GLY C C 9 172.770 172.770 174.900 -2.130 25881
555 1 3 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.891 0.254 25881
556 1 3 . 1 1 9 9 GLY H H 9 9.365 9.365 8.827 0.538 25881
557 1 3 . 1 1 10 10 ILE N N 10 122.885 122.885 118.367 4.518 25881
558 1 3 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.190 -0.208 25881
559 1 3 . 1 1 10 10 ILE C C 10 175.980 175.980 175.243 0.737 25881
560 1 3 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.240 0.816 25881
561 1 3 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.070 -1.126 25881
562 1 3 . 1 1 10 10 ILE H H 10 8.972 8.972 7.275 1.697 25881
563 1 3 . 1 1 11 11 CYS N N 11 118.245 118.245 113.231 5.014 25881
564 1 3 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.884 -0.235 25881
565 1 3 . 1 1 11 11 CYS C C 11 176.780 176.780 175.265 1.515 25881
566 1 3 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.835 1.259 25881
567 1 3 . 1 1 11 11 CYS CB C 11 31.972 31.972 30.312 1.660 25881
568 1 3 . 1 1 11 11 CYS H H 11 8.466 8.466 7.639 0.827 25881
569 1 3 . 1 1 12 12 ARG N N 12 116.067 116.067 119.780 -3.713 25881
570 1 3 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.116 0.100 25881
571 1 3 . 1 1 12 12 ARG C C 12 175.637 175.637 176.350 -0.713 25881
572 1 3 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.892 1.068 25881
573 1 3 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.882 0.222 25881
574 1 3 . 1 1 12 12 ARG H H 12 7.255 7.255 8.549 -1.294 25881
575 1 3 . 1 1 13 13 GLY N N 13 109.951 109.951 105.976 3.975 25881
576 1 3 . 1 1 13 13 GLY C C 13 173.169 173.169 173.860 -0.691 25881
577 1 3 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.903 -1.599 25881
578 1 3 . 1 1 13 13 GLY H H 13 8.795 8.795 7.967 0.828 25881
579 1 3 . 1 1 14 14 VAL N N 14 113.644 113.644 115.949 -2.305 25881
580 1 3 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.727 -0.683 25881
581 1 3 . 1 1 14 14 VAL C C 14 174.970 174.970 174.257 0.713 25881
582 1 3 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.745 2.486 25881
583 1 3 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.719 0.119 25881
584 1 3 . 1 1 14 14 VAL H H 14 7.266 7.266 7.736 -0.470 25881
585 1 3 . 1 1 15 15 ASP N N 15 119.913 119.913 118.326 1.587 25881
586 1 3 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.628 -0.397 25881
587 1 3 . 1 1 15 15 ASP C C 15 176.279 176.279 176.880 -0.601 25881
588 1 3 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.777 0.246 25881
589 1 3 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.481 -0.534 25881
590 1 3 . 1 1 15 15 ASP H H 15 8.223 8.223 8.419 -0.196 25881
591 1 3 . 1 1 16 16 GLY N N 16 109.534 109.534 107.262 2.272 25881
592 1 3 . 1 1 16 16 GLY C C 16 173.120 173.120 174.829 -1.709 25881
593 1 3 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.002 2.094 25881
594 1 3 . 1 1 16 16 GLY H H 16 8.617 8.617 8.731 -0.114 25881
595 1 3 . 1 1 17 17 LYS N N 17 121.534 121.534 123.328 -1.794 25881
596 1 3 . 1 1 17 17 LYS HA H 17 3.645 3.645 3.956 -0.311 25881
597 1 3 . 1 1 17 17 LYS C C 17 175.029 175.029 176.786 -1.757 25881
598 1 3 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.604 -1.093 25881
599 1 3 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.570 0.574 25881
600 1 3 . 1 1 17 17 LYS H H 17 7.318 7.318 7.807 -0.489 25881
601 1 3 . 1 1 18 18 TYR N N 18 119.391 119.391 118.844 0.547 25881
602 1 3 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.806 -0.354 25881
603 1 3 . 1 1 18 18 TYR C C 18 174.241 174.241 174.208 0.033 25881
604 1 3 . 1 1 18 18 TYR CA C 18 55.548 55.548 56.899 -1.351 25881
605 1 3 . 1 1 18 18 TYR CB C 18 38.496 38.496 41.666 -3.170 25881
606 1 3 . 1 1 18 18 TYR H H 18 7.661 7.661 8.050 -0.389 25881
607 1 3 . 1 1 19 19 LYS N N 19 120.140 120.140 121.681 -1.541 25881
608 1 3 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.700 0.241 25881
609 1 3 . 1 1 19 19 LYS C C 19 176.321 176.321 174.652 1.669 25881
610 1 3 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.001 0.563 25881
611 1 3 . 1 1 19 19 LYS CB C 19 36.018 36.018 36.115 -0.097 25881
612 1 3 . 1 1 19 19 LYS H H 19 8.395 8.395 8.422 -0.027 25881
613 1 3 . 1 1 20 20 CYS N N 20 131.127 131.127 124.801 6.326 25881
614 1 3 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.037 -0.106 25881
615 1 3 . 1 1 20 20 CYS C C 20 176.321 176.321 174.170 2.151 25881
616 1 3 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.648 1.644 25881
617 1 3 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.806 4.060 25881
618 1 3 . 1 1 20 20 CYS H H 20 9.391 9.391 8.598 0.793 25881
619 1 3 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.348 0.052 25881
620 1 3 . 1 1 21 21 PRO C C 21 176.764 176.764 176.938 -0.174 25881
621 1 3 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.736 -0.301 25881
622 1 3 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.670 0.655 25881
623 1 3 . 1 1 22 22 LYS N N 22 120.217 120.217 118.901 1.316 25881
624 1 3 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.277 -0.079 25881
625 1 3 . 1 1 22 22 LYS C C 22 176.798 176.798 177.709 -0.911 25881
626 1 3 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.662 -0.035 25881
627 1 3 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.174 1.088 25881
628 1 3 . 1 1 22 22 LYS H H 22 8.550 8.550 8.418 0.132 25881
629 1 3 . 1 1 23 23 CYS N N 23 115.450 115.450 113.648 1.802 25881
630 1 3 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.780 0.207 25881
631 1 3 . 1 1 23 23 CYS C C 23 176.434 176.434 176.241 0.193 25881
632 1 3 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.214 -0.059 25881
633 1 3 . 1 1 23 23 CYS CB C 23 32.482 32.482 30.018 2.464 25881
634 1 3 . 1 1 23 23 CYS H H 23 7.886 7.886 8.249 -0.363 25881
635 1 3 . 1 1 24 24 GLY N N 24 112.961 112.961 110.435 2.526 25881
636 1 3 . 1 1 24 24 GLY C C 24 173.369 173.369 174.274 -0.905 25881
637 1 3 . 1 1 24 24 GLY CA C 24 46.152 46.152 44.847 1.305 25881
638 1 3 . 1 1 24 24 GLY H H 24 7.958 7.958 8.384 -0.426 25881
639 1 3 . 1 1 25 25 VAL N N 25 123.968 123.968 120.926 3.042 25881
640 1 3 . 1 1 25 25 VAL HA H 25 3.979 3.979 3.919 0.060 25881
641 1 3 . 1 1 25 25 VAL C C 25 173.934 173.934 174.262 -0.328 25881
642 1 3 . 1 1 25 25 VAL CA C 25 63.136 63.136 61.687 1.449 25881
643 1 3 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.151 -1.192 25881
644 1 3 . 1 1 25 25 VAL H H 25 8.348 8.348 7.206 1.142 25881
645 1 3 . 1 1 26 26 ARG N N 26 125.641 125.641 125.348 0.293 25881
646 1 3 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.695 0.565 25881
647 1 3 . 1 1 26 26 ARG C C 26 177.008 177.008 175.494 1.514 25881
648 1 3 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.735 -0.407 25881
649 1 3 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.316 -1.993 25881
650 1 3 . 1 1 26 26 ARG H H 26 8.379 8.379 8.328 0.051 25881
651 1 3 . 1 1 27 27 TYR N N 27 117.706 117.706 118.306 -0.600 25881
652 1 3 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.084 1.609 25881
653 1 3 . 1 1 27 27 TYR C C 27 175.404 175.404 176.159 -0.755 25881
654 1 3 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.179 1.297 25881
655 1 3 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.824 2.079 25881
656 1 3 . 1 1 27 27 TYR H H 27 8.631 8.631 8.212 0.419 25881
657 1 3 . 1 1 28 28 CYS N N 28 118.515 118.515 115.828 2.687 25881
658 1 3 . 1 1 28 28 CYS HA H 28 4.905 4.905 5.093 -0.188 25881
659 1 3 . 1 1 28 28 CYS C C 28 176.186 176.186 175.078 1.108 25881
660 1 3 . 1 1 28 28 CYS CA C 28 58.614 58.614 57.865 0.748 25881
661 1 3 . 1 1 28 28 CYS CB C 28 34.827 34.827 28.005 6.822 25881
662 1 3 . 1 1 28 28 CYS H H 28 8.817 8.817 8.468 0.349 25881
663 1 3 . 1 1 29 29 SER N N 29 114.067 114.067 112.578 1.489 25881
664 1 3 . 1 1 29 29 SER HA H 29 4.877 4.877 4.318 0.559 25881
665 1 3 . 1 1 29 29 SER C C 29 178.077 178.077 173.350 4.727 25881
666 1 3 . 1 1 29 29 SER CA C 29 57.260 57.260 57.441 -0.182 25881
667 1 3 . 1 1 29 29 SER CB C 29 65.051 65.051 64.294 0.757 25881
668 1 3 . 1 1 29 29 SER H H 29 7.400 7.400 7.370 0.030 25881
669 1 3 . 1 1 30 30 LEU HA H 30 4.039 4.039 4.163 -0.124 25881
670 1 3 . 1 1 30 30 LEU C C 30 178.077 178.077 177.391 0.686 25881
671 1 3 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.227 0.224 25881
672 1 3 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.555 -0.326 25881
673 1 3 . 1 1 30 30 LEU H H 30 6.951 6.951 8.504 -1.553 25881
674 1 3 . 1 1 31 31 LYS N N 31 118.534 118.534 118.472 0.062 25881
675 1 3 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.001 -0.211 25881
676 1 3 . 1 1 31 31 LYS C C 31 179.162 179.162 177.244 1.918 25881
677 1 3 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.819 1.048 25881
678 1 3 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.474 0.433 25881
679 1 3 . 1 1 31 31 LYS H H 31 8.030 8.030 8.326 -0.296 25881
680 1 3 . 1 1 32 32 CYS N N 32 118.700 118.700 115.652 3.048 25881
681 1 3 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.606 -0.621 25881
682 1 3 . 1 1 32 32 CYS C C 32 176.766 176.766 177.003 -0.237 25881
683 1 3 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.661 6.018 25881
684 1 3 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.199 2.350 25881
685 1 3 . 1 1 32 32 CYS H H 32 7.424 7.424 7.628 -0.204 25881
686 1 3 . 1 1 33 33 TYR N N 33 118.151 118.151 123.657 -5.506 25881
687 1 3 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.517 -0.407 25881
688 1 3 . 1 1 33 33 TYR C C 33 178.549 178.549 176.080 2.469 25881
689 1 3 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.724 2.463 25881
690 1 3 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.812 1.034 25881
691 1 3 . 1 1 33 33 TYR H H 33 7.918 7.918 7.848 0.070 25881
692 1 3 . 1 1 34 34 LYS N N 34 114.631 114.631 118.270 -3.639 25881
693 1 3 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.304 -0.382 25881
694 1 3 . 1 1 34 34 LYS C C 34 174.991 174.991 175.388 -0.397 25881
695 1 3 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.691 0.260 25881
696 1 3 . 1 1 34 34 LYS CB C 34 32.145 32.145 30.953 1.192 25881
697 1 3 . 1 1 34 34 LYS H H 34 7.939 7.939 7.605 0.334 25881
698 1 3 . 1 1 35 35 ASP N N 35 121.194 121.194 120.625 0.569 25881
699 1 3 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.685 -0.391 25881
700 1 3 . 1 1 35 35 ASP C C 35 175.480 175.480 175.016 0.464 25881
701 1 3 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.378 0.961 25881
702 1 3 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.334 -2.974 25881
703 1 3 . 1 1 35 35 ASP H H 35 7.115 7.115 7.974 -0.859 25881
704 1 3 . 1 1 36 36 ALA N N 36 130.311 130.311 125.955 4.356 25881
705 1 3 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.905 -1.018 25881
706 1 3 . 1 1 36 36 ALA C C 36 177.717 177.717 176.323 1.394 25881
707 1 3 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.653 1.873 25881
708 1 3 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.096 -0.385 25881
709 1 3 . 1 1 36 36 ALA H H 36 8.073 8.073 8.539 -0.466 25881
710 1 3 . 1 1 37 37 ALA N N 37 117.133 117.133 122.414 -5.281 25881
711 1 3 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.442 -0.356 25881
712 1 3 . 1 1 37 37 ALA C C 37 178.989 178.989 178.399 0.590 25881
713 1 3 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.368 -0.157 25881
714 1 3 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.433 -1.286 25881
715 1 3 . 1 1 37 37 ALA H H 37 7.839 7.839 8.899 -1.060 25881
716 1 3 . 1 1 38 38 LYS N N 38 114.127 114.127 116.588 -2.461 25881
717 1 3 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.517 -0.222 25881
718 1 3 . 1 1 38 38 LYS C C 38 175.690 175.690 176.690 -1.000 25881
719 1 3 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.692 -0.489 25881
720 1 3 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.751 1.397 25881
721 1 3 . 1 1 38 38 LYS H H 38 7.292 7.292 9.154 -1.862 25881
722 1 3 . 1 1 39 39 HIS N N 39 122.110 122.110 122.086 0.024 25881
723 1 3 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.454 0.309 25881
724 1 3 . 1 1 39 39 HIS C C 39 171.783 171.783 173.614 -1.831 25881
725 1 3 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.896 -3.261 25881
726 1 3 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.944 -2.315 25881
727 1 3 . 1 1 39 39 HIS H H 39 8.393 8.393 8.453 -0.060 25881
728 1 3 . 1 1 40 40 VAL N N 40 123.393 123.393 126.649 -3.256 25881
729 1 3 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.212 -0.465 25881
730 1 3 . 1 1 40 40 VAL C C 40 175.292 175.292 175.248 0.044 25881
731 1 3 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.182 -0.018 25881
732 1 3 . 1 1 40 40 VAL CB C 40 34.132 34.132 33.528 0.604 25881
733 1 3 . 1 1 40 40 VAL H H 40 7.811 7.811 8.236 -0.425 25881
734 1 3 . 1 1 41 41 HIS N N 41 125.669 125.669 124.735 0.934 25881
735 1 3 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.716 0.162 25881
736 1 3 . 1 1 41 41 HIS C C 41 174.640 174.640 174.145 0.495 25881
737 1 3 . 1 1 41 41 HIS CA C 41 52.900 52.900 55.382 -2.482 25881
738 1 3 . 1 1 41 41 HIS CB C 41 30.067 30.067 31.370 -1.303 25881
739 1 3 . 1 1 41 41 HIS H H 41 8.512 8.512 8.479 0.033 25881
740 1 3 . 1 1 42 42 LYS N N 42 123.564 123.564 125.957 -2.393 25881
741 1 3 . 1 1 42 42 LYS C C 42 176.739 176.739 175.778 0.961 25881
742 1 3 . 1 1 42 42 LYS CA C 42 56.320 56.320 55.153 1.167 25881
743 1 3 . 1 1 42 42 LYS CB C 42 33.229 33.229 35.145 -1.916 25881
744 1 3 . 1 1 42 42 LYS H H 42 8.668 8.668 8.523 0.145 25881
745 1 3 . 1 1 43 43 GLU N N 43 122.633 122.633 121.296 1.337 25881
746 1 3 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.156 -0.046 25881
747 1 3 . 1 1 43 43 GLU C C 43 176.569 176.569 177.045 -0.476 25881
748 1 3 . 1 1 43 43 GLU CA C 43 57.097 57.097 57.256 -0.159 25881
749 1 3 . 1 1 43 43 GLU CB C 43 29.948 29.948 29.298 0.650 25881
750 1 3 . 1 1 43 43 GLU H H 43 8.590 8.590 8.665 -0.075 25881
751 1 3 . 1 1 44 44 SER N N 44 115.147 115.147 113.537 1.610 25881
752 1 3 . 1 1 44 44 SER HA H 44 4.268 4.268 4.101 0.167 25881
753 1 3 . 1 1 44 44 SER C C 44 174.336 174.336 175.184 -0.848 25881
754 1 3 . 1 1 44 44 SER CA C 44 58.348 58.348 60.844 -2.496 25881
755 1 3 . 1 1 44 44 SER CB C 44 63.724 63.724 61.849 1.875 25881
756 1 3 . 1 1 44 44 SER H H 44 8.105 8.105 8.588 -0.483 25881
757 1 3 . 1 1 45 45 GLU N N 45 122.849 122.849 122.061 0.788 25881
758 1 3 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.461 -0.298 25881
759 1 3 . 1 1 45 45 GLU C C 45 175.304 175.304 176.411 -1.107 25881
760 1 3 . 1 1 45 45 GLU CA C 45 56.412 56.412 56.980 -0.568 25881
761 1 3 . 1 1 45 45 GLU CB C 45 30.130 30.130 30.457 -0.327 25881
762 1 3 . 1 1 45 45 GLU H H 45 8.183 8.183 8.120 0.063 25881
763 1 4 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.258 0.035 25881
764 1 4 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 64.007 -1.005 25881
765 1 4 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 31.967 0.251 25881
766 1 4 . 1 1 1 1 MET HA H 1 3.967 3.967 4.219 -0.252 25881
767 1 4 . 1 1 1 1 MET CA C 1 57.335 57.335 56.300 1.035 25881
768 1 4 . 1 1 1 1 MET CB C 1 34.180 34.180 32.971 1.209 25881
769 1 4 . 1 1 2 2 VAL C C 2 175.654 175.654 177.135 -1.481 25881
770 1 4 . 1 1 2 2 VAL CA C 2 55.183 55.183 62.336 -7.153 25881
771 1 4 . 1 1 2 2 VAL CB C 2 33.173 33.173 31.923 1.250 25881
772 1 4 . 1 1 3 3 SER N N 3 121.996 121.996 115.792 6.204 25881
773 1 4 . 1 1 3 3 SER HA H 3 4.323 4.323 4.125 0.198 25881
774 1 4 . 1 1 3 3 SER C C 3 176.021 176.021 175.027 0.994 25881
775 1 4 . 1 1 3 3 SER CA C 3 62.208 62.208 60.750 1.458 25881
776 1 4 . 1 1 3 3 SER H H 3 8.103 8.103 8.720 -0.617 25881
777 1 4 . 1 1 4 4 SER N N 4 119.715 119.715 117.662 2.053 25881
778 1 4 . 1 1 4 4 SER HA H 4 4.317 4.317 4.394 -0.077 25881
779 1 4 . 1 1 4 4 SER C C 4 174.010 174.010 175.072 -1.062 25881
780 1 4 . 1 1 4 4 SER CA C 4 58.177 58.177 59.712 -1.535 25881
781 1 4 . 1 1 4 4 SER CB C 4 63.763 63.763 63.777 -0.014 25881
782 1 4 . 1 1 4 4 SER H H 4 8.298 8.298 7.891 0.407 25881
783 1 4 . 1 1 5 5 ALA N N 5 126.016 126.016 122.967 3.049 25881
784 1 4 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.522 -0.353 25881
785 1 4 . 1 1 5 5 ALA C C 5 177.297 177.297 176.567 0.730 25881
786 1 4 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.647 0.737 25881
787 1 4 . 1 1 5 5 ALA CB C 5 19.106 19.106 20.171 -1.065 25881
788 1 4 . 1 1 5 5 ALA H H 5 8.119 8.119 7.515 0.604 25881
789 1 4 . 1 1 6 6 VAL N N 6 119.174 119.174 119.788 -0.614 25881
790 1 4 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.275 -0.327 25881
791 1 4 . 1 1 6 6 VAL C C 6 175.743 175.743 174.829 0.914 25881
792 1 4 . 1 1 6 6 VAL CA C 6 61.668 61.668 61.052 0.616 25881
793 1 4 . 1 1 6 6 VAL CB C 6 32.841 32.841 35.797 -2.956 25881
794 1 4 . 1 1 6 6 VAL H H 6 7.861 7.861 8.291 -0.430 25881
795 1 4 . 1 1 7 7 LYS N N 7 123.999 123.999 125.247 -1.248 25881
796 1 4 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.671 -0.504 25881
797 1 4 . 1 1 7 7 LYS C C 7 175.665 175.665 176.051 -0.386 25881
798 1 4 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.121 1.169 25881
799 1 4 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.748 -0.207 25881
800 1 4 . 1 1 7 7 LYS H H 7 8.054 8.054 8.266 -0.212 25881
801 1 4 . 1 1 8 8 CYS N N 8 121.428 121.428 122.498 -1.070 25881
802 1 4 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.449 -0.806 25881
803 1 4 . 1 1 8 8 CYS C C 8 177.383 177.383 176.300 1.083 25881
804 1 4 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.540 0.226 25881
805 1 4 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.500 4.409 25881
806 1 4 . 1 1 8 8 CYS H H 8 8.539 8.539 8.863 -0.324 25881
807 1 4 . 1 1 9 9 GLY N N 9 118.862 118.862 116.917 1.945 25881
808 1 4 . 1 1 9 9 GLY C C 9 172.770 172.770 174.017 -1.247 25881
809 1 4 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.669 0.475 25881
810 1 4 . 1 1 9 9 GLY H H 9 9.365 9.365 9.072 0.293 25881
811 1 4 . 1 1 10 10 ILE N N 10 122.885 122.885 117.727 5.158 25881
812 1 4 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.165 -0.183 25881
813 1 4 . 1 1 10 10 ILE C C 10 175.980 175.980 175.574 0.406 25881
814 1 4 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.440 0.616 25881
815 1 4 . 1 1 10 10 ILE CB C 10 37.944 37.944 40.097 -2.153 25881
816 1 4 . 1 1 10 10 ILE H H 10 8.972 8.972 7.305 1.667 25881
817 1 4 . 1 1 11 11 CYS N N 11 118.245 118.245 113.576 4.669 25881
818 1 4 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.739 -0.090 25881
819 1 4 . 1 1 11 11 CYS C C 11 176.780 176.780 175.172 1.608 25881
820 1 4 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.563 1.531 25881
821 1 4 . 1 1 11 11 CYS CB C 11 31.972 31.972 29.226 2.747 25881
822 1 4 . 1 1 11 11 CYS H H 11 8.466 8.466 7.655 0.811 25881
823 1 4 . 1 1 12 12 ARG N N 12 116.067 116.067 119.486 -3.419 25881
824 1 4 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.130 0.086 25881
825 1 4 . 1 1 12 12 ARG C C 12 175.637 175.637 176.335 -0.698 25881
826 1 4 . 1 1 12 12 ARG CA C 12 57.960 57.960 57.143 0.817 25881
827 1 4 . 1 1 12 12 ARG CB C 12 27.104 27.104 27.193 -0.089 25881
828 1 4 . 1 1 12 12 ARG H H 12 7.255 7.255 8.262 -1.007 25881
829 1 4 . 1 1 13 13 GLY N N 13 109.951 109.951 105.910 4.041 25881
830 1 4 . 1 1 13 13 GLY C C 13 173.169 173.169 173.568 -0.399 25881
831 1 4 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.829 -1.525 25881
832 1 4 . 1 1 13 13 GLY H H 13 8.795 8.795 7.920 0.875 25881
833 1 4 . 1 1 14 14 VAL N N 14 113.644 113.644 116.725 -3.081 25881
834 1 4 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.689 -0.645 25881
835 1 4 . 1 1 14 14 VAL C C 14 174.970 174.970 174.520 0.450 25881
836 1 4 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.794 2.437 25881
837 1 4 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.643 0.195 25881
838 1 4 . 1 1 14 14 VAL H H 14 7.266 7.266 7.722 -0.456 25881
839 1 4 . 1 1 15 15 ASP N N 15 119.913 119.913 118.795 1.118 25881
840 1 4 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.692 -0.461 25881
841 1 4 . 1 1 15 15 ASP C C 15 176.279 176.279 176.889 -0.610 25881
842 1 4 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.724 0.298 25881
843 1 4 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.926 -0.979 25881
844 1 4 . 1 1 15 15 ASP H H 15 8.223 8.223 8.379 -0.156 25881
845 1 4 . 1 1 16 16 GLY N N 16 109.534 109.534 107.254 2.280 25881
846 1 4 . 1 1 16 16 GLY C C 16 173.120 173.120 175.100 -1.980 25881
847 1 4 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.058 2.038 25881
848 1 4 . 1 1 16 16 GLY H H 16 8.617 8.617 8.628 -0.011 25881
849 1 4 . 1 1 17 17 LYS N N 17 121.534 121.534 123.015 -1.481 25881
850 1 4 . 1 1 17 17 LYS HA H 17 3.645 3.645 3.964 -0.319 25881
851 1 4 . 1 1 17 17 LYS C C 17 175.029 175.029 177.212 -2.183 25881
852 1 4 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.630 -1.119 25881
853 1 4 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.576 0.568 25881
854 1 4 . 1 1 17 17 LYS H H 17 7.318 7.318 7.837 -0.519 25881
855 1 4 . 1 1 18 18 TYR N N 18 119.391 119.391 120.203 -0.812 25881
856 1 4 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.582 -0.130 25881
857 1 4 . 1 1 18 18 TYR C C 18 174.241 174.241 174.870 -0.629 25881
858 1 4 . 1 1 18 18 TYR CA C 18 55.548 55.548 58.031 -2.483 25881
859 1 4 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.315 -1.819 25881
860 1 4 . 1 1 18 18 TYR H H 18 7.661 7.661 8.116 -0.455 25881
861 1 4 . 1 1 19 19 LYS N N 19 120.140 120.140 122.477 -2.337 25881
862 1 4 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.565 0.376 25881
863 1 4 . 1 1 19 19 LYS C C 19 176.321 176.321 174.452 1.869 25881
864 1 4 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.129 0.435 25881
865 1 4 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.815 0.203 25881
866 1 4 . 1 1 19 19 LYS H H 19 8.395 8.395 8.228 0.167 25881
867 1 4 . 1 1 20 20 CYS N N 20 131.127 131.127 125.215 5.912 25881
868 1 4 . 1 1 20 20 CYS HA H 20 4.931 4.931 4.946 -0.015 25881
869 1 4 . 1 1 20 20 CYS C C 20 176.321 176.321 174.126 2.195 25881
870 1 4 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.661 1.631 25881
871 1 4 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.573 4.293 25881
872 1 4 . 1 1 20 20 CYS H H 20 9.391 9.391 8.594 0.797 25881
873 1 4 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.325 0.075 25881
874 1 4 . 1 1 21 21 PRO C C 21 176.764 176.764 177.055 -0.291 25881
875 1 4 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.760 -0.325 25881
876 1 4 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.626 0.699 25881
877 1 4 . 1 1 22 22 LYS N N 22 120.217 120.217 118.847 1.370 25881
878 1 4 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.224 -0.026 25881
879 1 4 . 1 1 22 22 LYS C C 22 176.798 176.798 177.859 -1.061 25881
880 1 4 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.873 -0.246 25881
881 1 4 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.160 1.102 25881
882 1 4 . 1 1 22 22 LYS H H 22 8.550 8.550 8.725 -0.175 25881
883 1 4 . 1 1 23 23 CYS N N 23 115.450 115.450 113.603 1.847 25881
884 1 4 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.950 0.037 25881
885 1 4 . 1 1 23 23 CYS C C 23 176.434 176.434 176.338 0.096 25881
886 1 4 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.586 -0.431 25881
887 1 4 . 1 1 23 23 CYS CB C 23 32.482 32.482 30.607 1.875 25881
888 1 4 . 1 1 23 23 CYS H H 23 7.886 7.886 8.338 -0.452 25881
889 1 4 . 1 1 24 24 GLY N N 24 112.961 112.961 110.917 2.044 25881
890 1 4 . 1 1 24 24 GLY C C 24 173.369 173.369 173.593 -0.224 25881
891 1 4 . 1 1 24 24 GLY CA C 24 46.152 46.152 44.876 1.276 25881
892 1 4 . 1 1 24 24 GLY H H 24 7.958 7.958 8.438 -0.480 25881
893 1 4 . 1 1 25 25 VAL N N 25 123.968 123.968 119.275 4.693 25881
894 1 4 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.093 -0.114 25881
895 1 4 . 1 1 25 25 VAL C C 25 173.934 173.934 174.290 -0.356 25881
896 1 4 . 1 1 25 25 VAL CA C 25 63.136 63.136 61.163 1.973 25881
897 1 4 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.111 -1.152 25881
898 1 4 . 1 1 25 25 VAL H H 25 8.348 8.348 7.278 1.070 25881
899 1 4 . 1 1 26 26 ARG N N 26 125.641 125.641 124.945 0.696 25881
900 1 4 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.820 0.440 25881
901 1 4 . 1 1 26 26 ARG C C 26 177.008 177.008 175.434 1.574 25881
902 1 4 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.659 -0.331 25881
903 1 4 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.216 -1.893 25881
904 1 4 . 1 1 26 26 ARG H H 26 8.379 8.379 8.466 -0.087 25881
905 1 4 . 1 1 27 27 TYR N N 27 117.706 117.706 118.979 -1.273 25881
906 1 4 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.068 1.625 25881
907 1 4 . 1 1 27 27 TYR C C 27 175.404 175.404 176.339 -0.935 25881
908 1 4 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.100 1.376 25881
909 1 4 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.560 2.343 25881
910 1 4 . 1 1 27 27 TYR H H 27 8.631 8.631 8.465 0.166 25881
911 1 4 . 1 1 28 28 CYS N N 28 118.515 118.515 116.213 2.302 25881
912 1 4 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.931 -0.026 25881
913 1 4 . 1 1 28 28 CYS C C 28 176.186 176.186 175.039 1.147 25881
914 1 4 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.898 -0.284 25881
915 1 4 . 1 1 28 28 CYS CB C 28 34.827 34.827 28.008 6.819 25881
916 1 4 . 1 1 28 28 CYS H H 28 8.817 8.817 8.394 0.423 25881
917 1 4 . 1 1 29 29 SER N N 29 114.067 114.067 111.982 2.085 25881
918 1 4 . 1 1 29 29 SER HA H 29 4.877 4.877 4.227 0.650 25881
919 1 4 . 1 1 29 29 SER C C 29 178.077 178.077 173.546 4.531 25881
920 1 4 . 1 1 29 29 SER CA C 29 57.260 57.260 57.220 0.040 25881
921 1 4 . 1 1 29 29 SER CB C 29 65.051 65.051 64.778 0.273 25881
922 1 4 . 1 1 29 29 SER H H 29 7.400 7.400 7.419 -0.019 25881
923 1 4 . 1 1 30 30 LEU HA H 30 4.039 4.039 4.081 -0.042 25881
924 1 4 . 1 1 30 30 LEU C C 30 178.077 178.077 177.165 0.912 25881
925 1 4 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.505 -0.055 25881
926 1 4 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.538 -0.309 25881
927 1 4 . 1 1 30 30 LEU H H 30 6.951 6.951 8.254 -1.303 25881
928 1 4 . 1 1 31 31 LYS N N 31 118.534 118.534 117.859 0.675 25881
929 1 4 . 1 1 31 31 LYS HA H 31 3.790 3.790 3.972 -0.182 25881
930 1 4 . 1 1 31 31 LYS C C 31 179.162 179.162 177.262 1.900 25881
931 1 4 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.670 1.197 25881
932 1 4 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.327 0.580 25881
933 1 4 . 1 1 31 31 LYS H H 31 8.030 8.030 8.329 -0.299 25881
934 1 4 . 1 1 32 32 CYS N N 32 118.700 118.700 115.991 2.709 25881
935 1 4 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.478 -0.493 25881
936 1 4 . 1 1 32 32 CYS C C 32 176.766 176.766 176.995 -0.229 25881
937 1 4 . 1 1 32 32 CYS CA C 32 65.679 65.679 60.163 5.516 25881
938 1 4 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.011 2.538 25881
939 1 4 . 1 1 32 32 CYS H H 32 7.424 7.424 7.581 -0.157 25881
940 1 4 . 1 1 33 33 TYR N N 33 118.151 118.151 123.162 -5.011 25881
941 1 4 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.166 -0.056 25881
942 1 4 . 1 1 33 33 TYR C C 33 178.549 178.549 175.812 2.737 25881
943 1 4 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.524 2.663 25881
944 1 4 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.609 1.237 25881
945 1 4 . 1 1 33 33 TYR H H 33 7.918 7.918 7.621 0.297 25881
946 1 4 . 1 1 34 34 LYS N N 34 114.631 114.631 117.726 -3.095 25881
947 1 4 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.181 -0.259 25881
948 1 4 . 1 1 34 34 LYS C C 34 174.991 174.991 175.452 -0.461 25881
949 1 4 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.481 0.470 25881
950 1 4 . 1 1 34 34 LYS CB C 34 32.145 32.145 30.991 1.154 25881
951 1 4 . 1 1 34 34 LYS H H 34 7.939 7.939 7.732 0.207 25881
952 1 4 . 1 1 35 35 ASP N N 35 121.194 121.194 119.955 1.239 25881
953 1 4 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.678 -0.384 25881
954 1 4 . 1 1 35 35 ASP C C 35 175.480 175.480 175.036 0.444 25881
955 1 4 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.359 0.980 25881
956 1 4 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.484 -3.123 25881
957 1 4 . 1 1 35 35 ASP H H 35 7.115 7.115 7.831 -0.716 25881
958 1 4 . 1 1 36 36 ALA N N 36 130.311 130.311 126.380 3.931 25881
959 1 4 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.752 -0.865 25881
960 1 4 . 1 1 36 36 ALA C C 36 177.717 177.717 176.345 1.372 25881
961 1 4 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.499 2.027 25881
962 1 4 . 1 1 36 36 ALA CB C 36 18.711 18.711 18.686 0.025 25881
963 1 4 . 1 1 36 36 ALA H H 36 8.073 8.073 8.616 -0.543 25881
964 1 4 . 1 1 37 37 ALA N N 37 117.133 117.133 122.340 -5.207 25881
965 1 4 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.449 -0.363 25881
966 1 4 . 1 1 37 37 ALA C C 37 178.989 178.989 178.357 0.632 25881
967 1 4 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.331 -0.121 25881
968 1 4 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.442 -1.295 25881
969 1 4 . 1 1 37 37 ALA H H 37 7.839 7.839 8.939 -1.100 25881
970 1 4 . 1 1 38 38 LYS N N 38 114.127 114.127 116.720 -2.593 25881
971 1 4 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.512 -0.217 25881
972 1 4 . 1 1 38 38 LYS C C 38 175.690 175.690 176.864 -1.174 25881
973 1 4 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.770 -0.567 25881
974 1 4 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.654 1.494 25881
975 1 4 . 1 1 38 38 LYS H H 38 7.292 7.292 9.208 -1.916 25881
976 1 4 . 1 1 39 39 HIS N N 39 122.110 122.110 122.683 -0.573 25881
977 1 4 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.449 0.314 25881
978 1 4 . 1 1 39 39 HIS C C 39 171.783 171.783 173.606 -1.823 25881
979 1 4 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.971 -3.336 25881
980 1 4 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.572 -1.943 25881
981 1 4 . 1 1 39 39 HIS H H 39 8.393 8.393 8.529 -0.136 25881
982 1 4 . 1 1 40 40 VAL N N 40 123.393 123.393 127.205 -3.812 25881
983 1 4 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.160 -0.413 25881
984 1 4 . 1 1 40 40 VAL C C 40 175.292 175.292 175.524 -0.232 25881
985 1 4 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.969 -0.805 25881
986 1 4 . 1 1 40 40 VAL CB C 40 34.132 34.132 33.314 0.818 25881
987 1 4 . 1 1 40 40 VAL H H 40 7.811 7.811 8.027 -0.216 25881
988 1 4 . 1 1 41 41 HIS N N 41 125.669 125.669 126.700 -1.031 25881
989 1 4 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.637 0.241 25881
990 1 4 . 1 1 41 41 HIS C C 41 174.640 174.640 175.370 -0.730 25881
991 1 4 . 1 1 41 41 HIS CA C 41 52.900 52.900 54.997 -2.097 25881
992 1 4 . 1 1 41 41 HIS CB C 41 30.067 30.067 30.605 -0.538 25881
993 1 4 . 1 1 41 41 HIS H H 41 8.512 8.512 8.580 -0.068 25881
994 1 4 . 1 1 42 42 LYS N N 42 123.564 123.564 119.709 3.855 25881
995 1 4 . 1 1 42 42 LYS C C 42 176.739 176.739 175.471 1.268 25881
996 1 4 . 1 1 42 42 LYS CA C 42 56.320 56.320 58.213 -1.893 25881
997 1 4 . 1 1 42 42 LYS CB C 42 33.229 33.229 31.820 1.409 25881
998 1 4 . 1 1 42 42 LYS H H 42 8.668 8.668 8.235 0.433 25881
999 1 4 . 1 1 43 43 GLU N N 43 122.633 122.633 120.081 2.552 25881
1000 1 4 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.660 -0.550 25881
1001 1 4 . 1 1 43 43 GLU C C 43 176.569 176.569 174.634 1.935 25881
1002 1 4 . 1 1 43 43 GLU CA C 43 57.097 57.097 55.816 1.281 25881
1003 1 4 . 1 1 43 43 GLU CB C 43 29.948 29.948 31.475 -1.527 25881
1004 1 4 . 1 1 43 43 GLU H H 43 8.590 8.590 8.078 0.512 25881
1005 1 4 . 1 1 44 44 SER N N 44 115.147 115.147 119.795 -4.648 25881
1006 1 4 . 1 1 44 44 SER HA H 44 4.268 4.268 4.808 -0.540 25881
1007 1 4 . 1 1 44 44 SER C C 44 174.336 174.336 173.723 0.613 25881
1008 1 4 . 1 1 44 44 SER CA C 44 58.348 58.348 58.108 0.240 25881
1009 1 4 . 1 1 44 44 SER CB C 44 63.724 63.724 63.900 -0.176 25881
1010 1 4 . 1 1 44 44 SER H H 44 8.105 8.105 8.392 -0.287 25881
1011 1 4 . 1 1 45 45 GLU N N 45 122.849 122.849 122.612 0.237 25881
1012 1 4 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.348 -0.185 25881
1013 1 4 . 1 1 45 45 GLU C C 45 175.304 175.304 176.277 -0.973 25881
1014 1 4 . 1 1 45 45 GLU CA C 45 56.412 56.412 57.434 -1.022 25881
1015 1 4 . 1 1 45 45 GLU CB C 45 30.130 30.130 30.121 0.009 25881
1016 1 4 . 1 1 45 45 GLU H H 45 8.183 8.183 8.609 -0.426 25881
1017 1 5 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.542 -0.249 25881
1018 1 5 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 63.063 -0.061 25881
1019 1 5 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 30.541 1.677 25881
1020 1 5 . 1 1 1 1 MET HA H 1 3.967 3.967 4.630 -0.663 25881
1021 1 5 . 1 1 1 1 MET CA C 1 57.335 57.335 54.767 2.568 25881
1022 1 5 . 1 1 1 1 MET CB C 1 34.180 34.180 33.481 0.699 25881
1023 1 5 . 1 1 2 2 VAL C C 2 175.654 175.654 174.906 0.748 25881
1024 1 5 . 1 1 2 2 VAL CA C 2 55.183 55.183 60.875 -5.692 25881
1025 1 5 . 1 1 2 2 VAL CB C 2 33.173 33.173 32.055 1.118 25881
1026 1 5 . 1 1 3 3 SER N N 3 121.996 121.996 115.044 6.952 25881
1027 1 5 . 1 1 3 3 SER HA H 3 4.323 4.323 4.151 0.172 25881
1028 1 5 . 1 1 3 3 SER C C 3 176.021 176.021 174.676 1.345 25881
1029 1 5 . 1 1 3 3 SER CA C 3 62.208 62.208 59.568 2.640 25881
1030 1 5 . 1 1 3 3 SER H H 3 8.103 8.103 7.817 0.286 25881
1031 1 5 . 1 1 4 4 SER N N 4 119.715 119.715 115.010 4.705 25881
1032 1 5 . 1 1 4 4 SER HA H 4 4.317 4.317 4.383 -0.066 25881
1033 1 5 . 1 1 4 4 SER C C 4 174.010 174.010 174.597 -0.587 25881
1034 1 5 . 1 1 4 4 SER CA C 4 58.177 58.177 59.261 -1.084 25881
1035 1 5 . 1 1 4 4 SER CB C 4 63.763 63.763 63.453 0.310 25881
1036 1 5 . 1 1 4 4 SER H H 4 8.298 8.298 8.365 -0.067 25881
1037 1 5 . 1 1 5 5 ALA N N 5 126.016 126.016 124.500 1.516 25881
1038 1 5 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.609 -0.440 25881
1039 1 5 . 1 1 5 5 ALA C C 5 177.297 177.297 175.613 1.684 25881
1040 1 5 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.565 0.820 25881
1041 1 5 . 1 1 5 5 ALA CB C 5 19.106 19.106 20.533 -1.427 25881
1042 1 5 . 1 1 5 5 ALA H H 5 8.119 8.119 7.691 0.427 25881
1043 1 5 . 1 1 6 6 VAL N N 6 119.174 119.174 119.502 -0.328 25881
1044 1 5 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.389 -0.441 25881
1045 1 5 . 1 1 6 6 VAL C C 6 175.743 175.743 174.776 0.967 25881
1046 1 5 . 1 1 6 6 VAL CA C 6 61.668 61.668 59.915 1.753 25881
1047 1 5 . 1 1 6 6 VAL CB C 6 32.841 32.841 35.272 -2.431 25881
1048 1 5 . 1 1 6 6 VAL H H 6 7.861 7.861 8.227 -0.366 25881
1049 1 5 . 1 1 7 7 LYS N N 7 123.999 123.999 124.371 -0.372 25881
1050 1 5 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.726 -0.559 25881
1051 1 5 . 1 1 7 7 LYS C C 7 175.665 175.665 176.192 -0.527 25881
1052 1 5 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.047 1.243 25881
1053 1 5 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.241 0.300 25881
1054 1 5 . 1 1 7 7 LYS H H 7 8.054 8.054 8.296 -0.242 25881
1055 1 5 . 1 1 8 8 CYS N N 8 121.428 121.428 121.621 -0.193 25881
1056 1 5 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.391 -0.748 25881
1057 1 5 . 1 1 8 8 CYS C C 8 177.383 177.383 175.809 1.574 25881
1058 1 5 . 1 1 8 8 CYS CA C 8 59.766 59.766 60.031 -0.265 25881
1059 1 5 . 1 1 8 8 CYS CB C 8 30.909 30.909 27.246 3.663 25881
1060 1 5 . 1 1 8 8 CYS H H 8 8.539 8.539 8.886 -0.347 25881
1061 1 5 . 1 1 9 9 GLY N N 9 118.862 118.862 115.814 3.048 25881
1062 1 5 . 1 1 9 9 GLY C C 9 172.770 172.770 174.549 -1.779 25881
1063 1 5 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.650 0.494 25881
1064 1 5 . 1 1 9 9 GLY H H 9 9.365 9.365 8.955 0.410 25881
1065 1 5 . 1 1 10 10 ILE N N 10 122.885 122.885 117.973 4.912 25881
1066 1 5 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.176 -0.194 25881
1067 1 5 . 1 1 10 10 ILE C C 10 175.980 175.980 175.234 0.746 25881
1068 1 5 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.600 0.456 25881
1069 1 5 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.298 -1.354 25881
1070 1 5 . 1 1 10 10 ILE H H 10 8.972 8.972 7.328 1.644 25881
1071 1 5 . 1 1 11 11 CYS N N 11 118.245 118.245 113.138 5.107 25881
1072 1 5 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.809 -0.160 25881
1073 1 5 . 1 1 11 11 CYS C C 11 176.780 176.780 175.012 1.768 25881
1074 1 5 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.747 1.347 25881
1075 1 5 . 1 1 11 11 CYS CB C 11 31.972 31.972 29.695 2.277 25881
1076 1 5 . 1 1 11 11 CYS H H 11 8.466 8.466 7.629 0.837 25881
1077 1 5 . 1 1 12 12 ARG N N 12 116.067 116.067 119.324 -3.257 25881
1078 1 5 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.145 0.071 25881
1079 1 5 . 1 1 12 12 ARG C C 12 175.637 175.637 176.500 -0.863 25881
1080 1 5 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.880 1.080 25881
1081 1 5 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.826 0.278 25881
1082 1 5 . 1 1 12 12 ARG H H 12 7.255 7.255 8.329 -1.074 25881
1083 1 5 . 1 1 13 13 GLY N N 13 109.951 109.951 106.083 3.868 25881
1084 1 5 . 1 1 13 13 GLY C C 13 173.169 173.169 173.728 -0.559 25881
1085 1 5 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.896 -1.592 25881
1086 1 5 . 1 1 13 13 GLY H H 13 8.795 8.795 7.895 0.900 25881
1087 1 5 . 1 1 14 14 VAL N N 14 113.644 113.644 116.091 -2.447 25881
1088 1 5 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.692 -0.648 25881
1089 1 5 . 1 1 14 14 VAL C C 14 174.970 174.970 174.385 0.585 25881
1090 1 5 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.935 2.296 25881
1091 1 5 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.661 0.177 25881
1092 1 5 . 1 1 14 14 VAL H H 14 7.266 7.266 7.601 -0.335 25881
1093 1 5 . 1 1 15 15 ASP N N 15 119.913 119.913 118.881 1.032 25881
1094 1 5 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.651 -0.420 25881
1095 1 5 . 1 1 15 15 ASP C C 15 176.279 176.279 176.654 -0.375 25881
1096 1 5 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.644 0.379 25881
1097 1 5 . 1 1 15 15 ASP CB C 15 39.947 39.947 41.015 -1.068 25881
1098 1 5 . 1 1 15 15 ASP H H 15 8.223 8.223 8.368 -0.145 25881
1099 1 5 . 1 1 16 16 GLY N N 16 109.534 109.534 107.197 2.337 25881
1100 1 5 . 1 1 16 16 GLY C C 16 173.120 173.120 174.893 -1.773 25881
1101 1 5 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.009 2.087 25881
1102 1 5 . 1 1 16 16 GLY H H 16 8.617 8.617 8.877 -0.260 25881
1103 1 5 . 1 1 17 17 LYS N N 17 121.534 121.534 122.876 -1.342 25881
1104 1 5 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.008 -0.363 25881
1105 1 5 . 1 1 17 17 LYS C C 17 175.029 175.029 177.245 -2.216 25881
1106 1 5 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.526 -1.015 25881
1107 1 5 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.627 0.517 25881
1108 1 5 . 1 1 17 17 LYS H H 17 7.318 7.318 7.773 -0.455 25881
1109 1 5 . 1 1 18 18 TYR N N 18 119.391 119.391 120.172 -0.781 25881
1110 1 5 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.595 -0.143 25881
1111 1 5 . 1 1 18 18 TYR C C 18 174.241 174.241 174.869 -0.628 25881
1112 1 5 . 1 1 18 18 TYR CA C 18 55.548 55.548 57.825 -2.277 25881
1113 1 5 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.366 -1.870 25881
1114 1 5 . 1 1 18 18 TYR H H 18 7.661 7.661 8.053 -0.392 25881
1115 1 5 . 1 1 19 19 LYS N N 19 120.140 120.140 122.124 -1.984 25881
1116 1 5 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.470 0.471 25881
1117 1 5 . 1 1 19 19 LYS C C 19 176.321 176.321 174.426 1.895 25881
1118 1 5 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.215 0.349 25881
1119 1 5 . 1 1 19 19 LYS CB C 19 36.018 36.018 36.002 0.016 25881
1120 1 5 . 1 1 19 19 LYS H H 19 8.395 8.395 8.213 0.182 25881
1121 1 5 . 1 1 20 20 CYS N N 20 131.127 131.127 124.572 6.555 25881
1122 1 5 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.000 -0.069 25881
1123 1 5 . 1 1 20 20 CYS C C 20 176.321 176.321 174.091 2.230 25881
1124 1 5 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.668 1.624 25881
1125 1 5 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.711 4.155 25881
1126 1 5 . 1 1 20 20 CYS H H 20 9.391 9.391 8.536 0.855 25881
1127 1 5 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.391 0.009 25881
1128 1 5 . 1 1 21 21 PRO C C 21 176.764 176.764 176.690 0.074 25881
1129 1 5 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.472 -0.037 25881
1130 1 5 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.559 0.766 25881
1131 1 5 . 1 1 22 22 LYS N N 22 120.217 120.217 119.218 0.999 25881
1132 1 5 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.356 -0.158 25881
1133 1 5 . 1 1 22 22 LYS C C 22 176.798 176.798 177.836 -1.038 25881
1134 1 5 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.462 0.165 25881
1135 1 5 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.486 0.776 25881
1136 1 5 . 1 1 22 22 LYS H H 22 8.550 8.550 8.313 0.237 25881
1137 1 5 . 1 1 23 23 CYS N N 23 115.450 115.450 114.146 1.304 25881
1138 1 5 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.994 -0.007 25881
1139 1 5 . 1 1 23 23 CYS C C 23 176.434 176.434 176.318 0.116 25881
1140 1 5 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.502 -0.347 25881
1141 1 5 . 1 1 23 23 CYS CB C 23 32.482 32.482 30.281 2.201 25881
1142 1 5 . 1 1 23 23 CYS H H 23 7.886 7.886 8.254 -0.368 25881
1143 1 5 . 1 1 24 24 GLY N N 24 112.961 112.961 110.559 2.402 25881
1144 1 5 . 1 1 24 24 GLY C C 24 173.369 173.369 173.564 -0.195 25881
1145 1 5 . 1 1 24 24 GLY CA C 24 46.152 46.152 45.107 1.045 25881
1146 1 5 . 1 1 24 24 GLY H H 24 7.958 7.958 8.328 -0.370 25881
1147 1 5 . 1 1 25 25 VAL N N 25 123.968 123.968 119.663 4.305 25881
1148 1 5 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.074 -0.095 25881
1149 1 5 . 1 1 25 25 VAL C C 25 173.934 173.934 174.757 -0.823 25881
1150 1 5 . 1 1 25 25 VAL CA C 25 63.136 63.136 60.852 2.284 25881
1151 1 5 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.692 -1.733 25881
1152 1 5 . 1 1 25 25 VAL H H 25 8.348 8.348 7.264 1.084 25881
1153 1 5 . 1 1 26 26 ARG N N 26 125.641 125.641 124.860 0.781 25881
1154 1 5 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.579 0.681 25881
1155 1 5 . 1 1 26 26 ARG C C 26 177.008 177.008 175.371 1.637 25881
1156 1 5 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.880 -0.552 25881
1157 1 5 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.381 -2.058 25881
1158 1 5 . 1 1 26 26 ARG H H 26 8.379 8.379 8.237 0.142 25881
1159 1 5 . 1 1 27 27 TYR N N 27 117.706 117.706 118.420 -0.714 25881
1160 1 5 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.107 1.586 25881
1161 1 5 . 1 1 27 27 TYR C C 27 175.404 175.404 176.203 -0.799 25881
1162 1 5 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.317 1.159 25881
1163 1 5 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.738 2.165 25881
1164 1 5 . 1 1 27 27 TYR H H 27 8.631 8.631 8.359 0.272 25881
1165 1 5 . 1 1 28 28 CYS N N 28 118.515 118.515 116.276 2.239 25881
1166 1 5 . 1 1 28 28 CYS HA H 28 4.905 4.905 5.061 -0.156 25881
1167 1 5 . 1 1 28 28 CYS C C 28 176.186 176.186 174.738 1.448 25881
1168 1 5 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.331 0.283 25881
1169 1 5 . 1 1 28 28 CYS CB C 28 34.827 34.827 28.430 6.397 25881
1170 1 5 . 1 1 28 28 CYS H H 28 8.817 8.817 8.363 0.454 25881
1171 1 5 . 1 1 29 29 SER N N 29 114.067 114.067 112.728 1.339 25881
1172 1 5 . 1 1 29 29 SER HA H 29 4.877 4.877 4.110 0.767 25881
1173 1 5 . 1 1 29 29 SER C C 29 178.077 178.077 173.686 4.391 25881
1174 1 5 . 1 1 29 29 SER CA C 29 57.260 57.260 57.505 -0.245 25881
1175 1 5 . 1 1 29 29 SER CB C 29 65.051 65.051 64.061 0.990 25881
1176 1 5 . 1 1 29 29 SER H H 29 7.400 7.400 7.366 0.034 25881
1177 1 5 . 1 1 30 30 LEU HA H 30 4.039 4.039 3.935 0.104 25881
1178 1 5 . 1 1 30 30 LEU C C 30 178.077 178.077 178.405 -0.328 25881
1179 1 5 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.636 -0.185 25881
1180 1 5 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.382 -0.153 25881
1181 1 5 . 1 1 30 30 LEU H H 30 6.951 6.951 8.506 -1.555 25881
1182 1 5 . 1 1 31 31 LYS N N 31 118.534 118.534 117.989 0.545 25881
1183 1 5 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.050 -0.260 25881
1184 1 5 . 1 1 31 31 LYS C C 31 179.162 179.162 176.910 2.252 25881
1185 1 5 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.449 1.418 25881
1186 1 5 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.893 0.014 25881
1187 1 5 . 1 1 31 31 LYS H H 31 8.030 8.030 7.625 0.405 25881
1188 1 5 . 1 1 32 32 CYS N N 32 118.700 118.700 115.426 3.274 25881
1189 1 5 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.653 -0.668 25881
1190 1 5 . 1 1 32 32 CYS C C 32 176.766 176.766 176.750 0.016 25881
1191 1 5 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.337 6.342 25881
1192 1 5 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.963 1.586 25881
1193 1 5 . 1 1 32 32 CYS H H 32 7.424 7.424 7.512 -0.088 25881
1194 1 5 . 1 1 33 33 TYR N N 33 118.151 118.151 123.683 -5.532 25881
1195 1 5 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.290 -0.180 25881
1196 1 5 . 1 1 33 33 TYR C C 33 178.549 178.549 175.868 2.681 25881
1197 1 5 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.650 2.537 25881
1198 1 5 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.913 0.933 25881
1199 1 5 . 1 1 33 33 TYR H H 33 7.918 7.918 8.073 -0.155 25881
1200 1 5 . 1 1 34 34 LYS N N 34 114.631 114.631 117.970 -3.339 25881
1201 1 5 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.316 -0.394 25881
1202 1 5 . 1 1 34 34 LYS C C 34 174.991 174.991 175.422 -0.431 25881
1203 1 5 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.594 0.357 25881
1204 1 5 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.035 1.110 25881
1205 1 5 . 1 1 34 34 LYS H H 34 7.939 7.939 7.678 0.261 25881
1206 1 5 . 1 1 35 35 ASP N N 35 121.194 121.194 120.485 0.709 25881
1207 1 5 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.686 -0.392 25881
1208 1 5 . 1 1 35 35 ASP C C 35 175.480 175.480 175.011 0.469 25881
1209 1 5 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.306 1.034 25881
1210 1 5 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.612 -3.251 25881
1211 1 5 . 1 1 35 35 ASP H H 35 7.115 7.115 7.928 -0.812 25881
1212 1 5 . 1 1 36 36 ALA N N 36 130.311 130.311 125.762 4.549 25881
1213 1 5 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.871 -0.984 25881
1214 1 5 . 1 1 36 36 ALA C C 36 177.717 177.717 176.322 1.395 25881
1215 1 5 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.659 1.867 25881
1216 1 5 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.041 -0.330 25881
1217 1 5 . 1 1 36 36 ALA H H 36 8.073 8.073 8.580 -0.507 25881
1218 1 5 . 1 1 37 37 ALA N N 37 117.133 117.133 122.901 -5.768 25881
1219 1 5 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.270 -0.184 25881
1220 1 5 . 1 1 37 37 ALA C C 37 178.989 178.989 178.321 0.668 25881
1221 1 5 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.436 -0.225 25881
1222 1 5 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.297 -1.150 25881
1223 1 5 . 1 1 37 37 ALA H H 37 7.839 7.839 8.957 -1.118 25881
1224 1 5 . 1 1 38 38 LYS N N 38 114.127 114.127 116.468 -2.341 25881
1225 1 5 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.517 -0.222 25881
1226 1 5 . 1 1 38 38 LYS C C 38 175.690 175.690 176.732 -1.042 25881
1227 1 5 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.647 -0.444 25881
1228 1 5 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.733 1.415 25881
1229 1 5 . 1 1 38 38 LYS H H 38 7.292 7.292 9.209 -1.917 25881
1230 1 5 . 1 1 39 39 HIS N N 39 122.110 122.110 122.775 -0.665 25881
1231 1 5 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.503 0.260 25881
1232 1 5 . 1 1 39 39 HIS C C 39 171.783 171.783 173.565 -1.782 25881
1233 1 5 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.404 -2.769 25881
1234 1 5 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.972 -2.343 25881
1235 1 5 . 1 1 39 39 HIS H H 39 8.393 8.393 8.681 -0.288 25881
1236 1 5 . 1 1 40 40 VAL N N 40 123.393 123.393 127.245 -3.852 25881
1237 1 5 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.139 -0.392 25881
1238 1 5 . 1 1 40 40 VAL C C 40 175.292 175.292 175.441 -0.149 25881
1239 1 5 . 1 1 40 40 VAL CA C 40 61.164 61.164 62.943 -1.779 25881
1240 1 5 . 1 1 40 40 VAL CB C 40 34.132 34.132 32.064 2.068 25881
1241 1 5 . 1 1 40 40 VAL H H 40 7.811 7.811 8.672 -0.861 25881
1242 1 5 . 1 1 41 41 HIS N N 41 125.669 125.669 126.174 -0.505 25881
1243 1 5 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.500 0.378 25881
1244 1 5 . 1 1 41 41 HIS C C 41 174.640 174.640 175.900 -1.260 25881
1245 1 5 . 1 1 41 41 HIS CA C 41 52.900 52.900 56.173 -3.273 25881
1246 1 5 . 1 1 41 41 HIS CB C 41 30.067 30.067 31.670 -1.603 25881
1247 1 5 . 1 1 41 41 HIS H H 41 8.512 8.512 8.610 -0.098 25881
1248 1 5 . 1 1 42 42 LYS N N 42 123.564 123.564 121.192 2.372 25881
1249 1 5 . 1 1 42 42 LYS C C 42 176.739 176.739 176.508 0.231 25881
1250 1 5 . 1 1 42 42 LYS CA C 42 56.320 56.320 55.722 0.598 25881
1251 1 5 . 1 1 42 42 LYS CB C 42 33.229 33.229 31.118 2.111 25881
1252 1 5 . 1 1 42 42 LYS H H 42 8.668 8.668 8.322 0.346 25881
1253 1 5 . 1 1 43 43 GLU N N 43 122.633 122.633 122.507 0.126 25881
1254 1 5 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.518 -0.408 25881
1255 1 5 . 1 1 43 43 GLU C C 43 176.569 176.569 175.443 1.126 25881
1256 1 5 . 1 1 43 43 GLU CA C 43 57.097 57.097 56.306 0.791 25881
1257 1 5 . 1 1 43 43 GLU CB C 43 29.948 29.948 31.434 -1.486 25881
1258 1 5 . 1 1 43 43 GLU H H 43 8.590 8.590 8.085 0.505 25881
1259 1 5 . 1 1 44 44 SER N N 44 115.147 115.147 120.211 -5.064 25881
1260 1 5 . 1 1 44 44 SER HA H 44 4.268 4.268 4.658 -0.390 25881
1261 1 5 . 1 1 44 44 SER C C 44 174.336 174.336 173.925 0.411 25881
1262 1 5 . 1 1 44 44 SER CA C 44 58.348 58.348 58.397 -0.049 25881
1263 1 5 . 1 1 44 44 SER CB C 44 63.724 63.724 63.266 0.458 25881
1264 1 5 . 1 1 44 44 SER H H 44 8.105 8.105 8.539 -0.434 25881
1265 1 5 . 1 1 45 45 GLU N N 45 122.849 122.849 123.870 -1.021 25881
1266 1 5 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.216 -0.053 25881
1267 1 5 . 1 1 45 45 GLU C C 45 175.304 175.304 176.044 -0.740 25881
1268 1 5 . 1 1 45 45 GLU CA C 45 56.412 56.412 57.156 -0.744 25881
1269 1 5 . 1 1 45 45 GLU CB C 45 30.130 30.130 29.244 0.886 25881
1270 1 5 . 1 1 45 45 GLU H H 45 8.183 8.183 8.551 -0.368 25881
1271 1 6 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.258 0.035 25881
1272 1 6 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 63.055 -0.053 25881
1273 1 6 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 31.931 0.287 25881
1274 1 6 . 1 1 1 1 MET HA H 1 3.967 3.967 4.497 -0.530 25881
1275 1 6 . 1 1 1 1 MET CA C 1 57.335 57.335 55.995 1.341 25881
1276 1 6 . 1 1 1 1 MET CB C 1 34.180 34.180 33.943 0.237 25881
1277 1 6 . 1 1 2 2 VAL C C 2 175.654 175.654 175.276 0.378 25881
1278 1 6 . 1 1 2 2 VAL CA C 2 55.183 55.183 62.934 -7.751 25881
1279 1 6 . 1 1 2 2 VAL CB C 2 33.173 33.173 30.679 2.494 25881
1280 1 6 . 1 1 3 3 SER N N 3 121.996 121.996 114.895 7.101 25881
1281 1 6 . 1 1 3 3 SER HA H 3 4.323 4.323 4.491 -0.168 25881
1282 1 6 . 1 1 3 3 SER C C 3 176.021 176.021 174.132 1.889 25881
1283 1 6 . 1 1 3 3 SER CA C 3 62.208 62.208 58.914 3.294 25881
1284 1 6 . 1 1 3 3 SER H H 3 8.103 8.103 8.103 -0.000 25881
1285 1 6 . 1 1 4 4 SER N N 4 119.715 119.715 117.133 2.582 25881
1286 1 6 . 1 1 4 4 SER HA H 4 4.317 4.317 4.652 -0.335 25881
1287 1 6 . 1 1 4 4 SER C C 4 174.010 174.010 173.226 0.784 25881
1288 1 6 . 1 1 4 4 SER CA C 4 58.177 58.177 57.990 0.187 25881
1289 1 6 . 1 1 4 4 SER CB C 4 63.763 63.763 63.864 -0.101 25881
1290 1 6 . 1 1 4 4 SER H H 4 8.298 8.298 7.847 0.451 25881
1291 1 6 . 1 1 5 5 ALA N N 5 126.016 126.016 128.359 -2.343 25881
1292 1 6 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.552 -0.383 25881
1293 1 6 . 1 1 5 5 ALA C C 5 177.297 177.297 176.458 0.839 25881
1294 1 6 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.801 0.583 25881
1295 1 6 . 1 1 5 5 ALA CB C 5 19.106 19.106 19.954 -0.848 25881
1296 1 6 . 1 1 5 5 ALA H H 5 8.119 8.119 7.977 0.142 25881
1297 1 6 . 1 1 6 6 VAL N N 6 119.174 119.174 120.978 -1.804 25881
1298 1 6 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.290 -0.342 25881
1299 1 6 . 1 1 6 6 VAL C C 6 175.743 175.743 174.769 0.974 25881
1300 1 6 . 1 1 6 6 VAL CA C 6 61.668 61.668 60.891 0.777 25881
1301 1 6 . 1 1 6 6 VAL CB C 6 32.841 32.841 35.516 -2.675 25881
1302 1 6 . 1 1 6 6 VAL H H 6 7.861 7.861 8.283 -0.422 25881
1303 1 6 . 1 1 7 7 LYS N N 7 123.999 123.999 125.955 -1.956 25881
1304 1 6 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.668 -0.501 25881
1305 1 6 . 1 1 7 7 LYS C C 7 175.665 175.665 175.743 -0.078 25881
1306 1 6 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.115 1.175 25881
1307 1 6 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.329 0.212 25881
1308 1 6 . 1 1 7 7 LYS H H 7 8.054 8.054 8.263 -0.209 25881
1309 1 6 . 1 1 8 8 CYS N N 8 121.428 121.428 122.900 -1.472 25881
1310 1 6 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.371 -0.728 25881
1311 1 6 . 1 1 8 8 CYS C C 8 177.383 177.383 176.792 0.591 25881
1312 1 6 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.943 -0.177 25881
1313 1 6 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.803 4.106 25881
1314 1 6 . 1 1 8 8 CYS H H 8 8.539 8.539 8.759 -0.220 25881
1315 1 6 . 1 1 9 9 GLY N N 9 118.862 118.862 116.417 2.445 25881
1316 1 6 . 1 1 9 9 GLY C C 9 172.770 172.770 174.679 -1.909 25881
1317 1 6 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.789 0.355 25881
1318 1 6 . 1 1 9 9 GLY H H 9 9.365 9.365 8.931 0.434 25881
1319 1 6 . 1 1 10 10 ILE N N 10 122.885 122.885 118.205 4.680 25881
1320 1 6 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.167 -0.185 25881
1321 1 6 . 1 1 10 10 ILE C C 10 175.980 175.980 175.390 0.590 25881
1322 1 6 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.072 0.984 25881
1323 1 6 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.851 -1.907 25881
1324 1 6 . 1 1 10 10 ILE H H 10 8.972 8.972 7.329 1.643 25881
1325 1 6 . 1 1 11 11 CYS N N 11 118.245 118.245 113.004 5.241 25881
1326 1 6 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.795 -0.146 25881
1327 1 6 . 1 1 11 11 CYS C C 11 176.780 176.780 174.992 1.788 25881
1328 1 6 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.744 1.350 25881
1329 1 6 . 1 1 11 11 CYS CB C 11 31.972 31.972 29.908 2.064 25881
1330 1 6 . 1 1 11 11 CYS H H 11 8.466 8.466 7.612 0.854 25881
1331 1 6 . 1 1 12 12 ARG N N 12 116.067 116.067 120.551 -4.484 25881
1332 1 6 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.147 0.069 25881
1333 1 6 . 1 1 12 12 ARG C C 12 175.637 175.637 176.440 -0.803 25881
1334 1 6 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.533 1.427 25881
1335 1 6 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.663 0.441 25881
1336 1 6 . 1 1 12 12 ARG H H 12 7.255 7.255 8.475 -1.220 25881
1337 1 6 . 1 1 13 13 GLY N N 13 109.951 109.951 108.233 1.718 25881
1338 1 6 . 1 1 13 13 GLY C C 13 173.169 173.169 174.205 -1.036 25881
1339 1 6 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.844 -1.540 25881
1340 1 6 . 1 1 13 13 GLY H H 13 8.795 8.795 7.966 0.829 25881
1341 1 6 . 1 1 14 14 VAL N N 14 113.644 113.644 117.071 -3.427 25881
1342 1 6 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.661 -0.617 25881
1343 1 6 . 1 1 14 14 VAL C C 14 174.970 174.970 174.528 0.442 25881
1344 1 6 . 1 1 14 14 VAL CA C 14 61.231 61.231 59.382 1.849 25881
1345 1 6 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.444 0.394 25881
1346 1 6 . 1 1 14 14 VAL H H 14 7.266 7.266 7.967 -0.701 25881
1347 1 6 . 1 1 15 15 ASP N N 15 119.913 119.913 120.651 -0.738 25881
1348 1 6 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.762 -0.531 25881
1349 1 6 . 1 1 15 15 ASP C C 15 176.279 176.279 177.134 -0.855 25881
1350 1 6 . 1 1 15 15 ASP CA C 15 55.023 55.023 56.137 -1.114 25881
1351 1 6 . 1 1 15 15 ASP CB C 15 39.947 39.947 41.106 -1.159 25881
1352 1 6 . 1 1 15 15 ASP H H 15 8.223 8.223 8.458 -0.235 25881
1353 1 6 . 1 1 16 16 GLY N N 16 109.534 109.534 109.166 0.368 25881
1354 1 6 . 1 1 16 16 GLY C C 16 173.120 173.120 174.883 -1.763 25881
1355 1 6 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.719 1.377 25881
1356 1 6 . 1 1 16 16 GLY H H 16 8.617 8.617 8.952 -0.335 25881
1357 1 6 . 1 1 17 17 LYS N N 17 121.534 121.534 124.368 -2.834 25881
1358 1 6 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.096 -0.451 25881
1359 1 6 . 1 1 17 17 LYS C C 17 175.029 175.029 177.176 -2.147 25881
1360 1 6 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.273 -0.762 25881
1361 1 6 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.747 0.397 25881
1362 1 6 . 1 1 17 17 LYS H H 17 7.318 7.318 7.880 -0.562 25881
1363 1 6 . 1 1 18 18 TYR N N 18 119.391 119.391 120.232 -0.841 25881
1364 1 6 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.635 -0.183 25881
1365 1 6 . 1 1 18 18 TYR C C 18 174.241 174.241 174.876 -0.635 25881
1366 1 6 . 1 1 18 18 TYR CA C 18 55.548 55.548 57.355 -1.808 25881
1367 1 6 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.548 -2.052 25881
1368 1 6 . 1 1 18 18 TYR H H 18 7.661 7.661 8.025 -0.364 25881
1369 1 6 . 1 1 19 19 LYS N N 19 120.140 120.140 121.750 -1.610 25881
1370 1 6 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.542 0.399 25881
1371 1 6 . 1 1 19 19 LYS C C 19 176.321 176.321 174.391 1.930 25881
1372 1 6 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.221 0.342 25881
1373 1 6 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.836 0.182 25881
1374 1 6 . 1 1 19 19 LYS H H 19 8.395 8.395 8.230 0.165 25881
1375 1 6 . 1 1 20 20 CYS N N 20 131.127 131.127 124.776 6.351 25881
1376 1 6 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.076 -0.145 25881
1377 1 6 . 1 1 20 20 CYS C C 20 176.321 176.321 173.979 2.342 25881
1378 1 6 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.592 1.700 25881
1379 1 6 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.719 4.147 25881
1380 1 6 . 1 1 20 20 CYS H H 20 9.391 9.391 8.627 0.764 25881
1381 1 6 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.355 0.045 25881
1382 1 6 . 1 1 21 21 PRO C C 21 176.764 176.764 176.986 -0.222 25881
1383 1 6 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.642 -0.207 25881
1384 1 6 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.619 0.706 25881
1385 1 6 . 1 1 22 22 LYS N N 22 120.217 120.217 119.236 0.981 25881
1386 1 6 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.230 -0.032 25881
1387 1 6 . 1 1 22 22 LYS C C 22 176.798 176.798 177.547 -0.749 25881
1388 1 6 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.915 -0.288 25881
1389 1 6 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.061 1.201 25881
1390 1 6 . 1 1 22 22 LYS H H 22 8.550 8.550 8.624 -0.074 25881
1391 1 6 . 1 1 23 23 CYS N N 23 115.450 115.450 113.635 1.815 25881
1392 1 6 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.971 0.016 25881
1393 1 6 . 1 1 23 23 CYS C C 23 176.434 176.434 176.229 0.205 25881
1394 1 6 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.472 -0.318 25881
1395 1 6 . 1 1 23 23 CYS CB C 23 32.482 32.482 30.652 1.830 25881
1396 1 6 . 1 1 23 23 CYS H H 23 7.886 7.886 8.322 -0.436 25881
1397 1 6 . 1 1 24 24 GLY N N 24 112.961 112.961 110.265 2.696 25881
1398 1 6 . 1 1 24 24 GLY C C 24 173.369 173.369 173.584 -0.215 25881
1399 1 6 . 1 1 24 24 GLY CA C 24 46.152 46.152 45.043 1.109 25881
1400 1 6 . 1 1 24 24 GLY H H 24 7.958 7.958 8.458 -0.500 25881
1401 1 6 . 1 1 25 25 VAL N N 25 123.968 123.968 119.586 4.382 25881
1402 1 6 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.105 -0.126 25881
1403 1 6 . 1 1 25 25 VAL C C 25 173.934 173.934 174.585 -0.651 25881
1404 1 6 . 1 1 25 25 VAL CA C 25 63.136 63.136 60.309 2.827 25881
1405 1 6 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.930 -1.971 25881
1406 1 6 . 1 1 25 25 VAL H H 25 8.348 8.348 7.369 0.979 25881
1407 1 6 . 1 1 26 26 ARG N N 26 125.641 125.641 124.499 1.142 25881
1408 1 6 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.606 0.654 25881
1409 1 6 . 1 1 26 26 ARG C C 26 177.008 177.008 175.240 1.768 25881
1410 1 6 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.882 -0.554 25881
1411 1 6 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.537 -2.214 25881
1412 1 6 . 1 1 26 26 ARG H H 26 8.379 8.379 8.267 0.112 25881
1413 1 6 . 1 1 27 27 TYR N N 27 117.706 117.706 118.635 -0.929 25881
1414 1 6 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.072 1.621 25881
1415 1 6 . 1 1 27 27 TYR C C 27 175.404 175.404 176.297 -0.893 25881
1416 1 6 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.048 1.428 25881
1417 1 6 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.681 2.222 25881
1418 1 6 . 1 1 27 27 TYR H H 27 8.631 8.631 8.170 0.461 25881
1419 1 6 . 1 1 28 28 CYS N N 28 118.515 118.515 116.429 2.086 25881
1420 1 6 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.965 -0.060 25881
1421 1 6 . 1 1 28 28 CYS C C 28 176.186 176.186 175.003 1.183 25881
1422 1 6 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.378 0.236 25881
1423 1 6 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.931 6.896 25881
1424 1 6 . 1 1 28 28 CYS H H 28 8.817 8.817 8.370 0.447 25881
1425 1 6 . 1 1 29 29 SER N N 29 114.067 114.067 113.008 1.059 25881
1426 1 6 . 1 1 29 29 SER HA H 29 4.877 4.877 4.024 0.853 25881
1427 1 6 . 1 1 29 29 SER C C 29 178.077 178.077 173.471 4.606 25881
1428 1 6 . 1 1 29 29 SER CA C 29 57.260 57.260 57.499 -0.239 25881
1429 1 6 . 1 1 29 29 SER CB C 29 65.051 65.051 63.737 1.314 25881
1430 1 6 . 1 1 29 29 SER H H 29 7.400 7.400 7.374 0.026 25881
1431 1 6 . 1 1 30 30 LEU HA H 30 4.039 4.039 3.926 0.113 25881
1432 1 6 . 1 1 30 30 LEU C C 30 178.077 178.077 178.474 -0.397 25881
1433 1 6 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.504 -0.053 25881
1434 1 6 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.414 -0.185 25881
1435 1 6 . 1 1 30 30 LEU H H 30 6.951 6.951 8.439 -1.488 25881
1436 1 6 . 1 1 31 31 LYS N N 31 118.534 118.534 118.720 -0.186 25881
1437 1 6 . 1 1 31 31 LYS HA H 31 3.790 3.790 3.985 -0.195 25881
1438 1 6 . 1 1 31 31 LYS C C 31 179.162 179.162 176.991 2.171 25881
1439 1 6 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.743 1.124 25881
1440 1 6 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.950 -0.043 25881
1441 1 6 . 1 1 31 31 LYS H H 31 8.030 8.030 7.572 0.458 25881
1442 1 6 . 1 1 32 32 CYS N N 32 118.700 118.700 115.234 3.466 25881
1443 1 6 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.625 -0.640 25881
1444 1 6 . 1 1 32 32 CYS C C 32 176.766 176.766 176.825 -0.059 25881
1445 1 6 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.132 6.547 25881
1446 1 6 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.456 2.093 25881
1447 1 6 . 1 1 32 32 CYS H H 32 7.424 7.424 7.549 -0.125 25881
1448 1 6 . 1 1 33 33 TYR N N 33 118.151 118.151 123.858 -5.707 25881
1449 1 6 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.249 -0.139 25881
1450 1 6 . 1 1 33 33 TYR C C 33 178.549 178.549 175.726 2.823 25881
1451 1 6 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.547 2.640 25881
1452 1 6 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.860 0.986 25881
1453 1 6 . 1 1 33 33 TYR H H 33 7.918 7.918 7.666 0.252 25881
1454 1 6 . 1 1 34 34 LYS N N 34 114.631 114.631 117.656 -3.025 25881
1455 1 6 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.260 -0.338 25881
1456 1 6 . 1 1 34 34 LYS C C 34 174.991 174.991 175.547 -0.556 25881
1457 1 6 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.649 0.302 25881
1458 1 6 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.093 1.052 25881
1459 1 6 . 1 1 34 34 LYS H H 34 7.939 7.939 7.491 0.448 25881
1460 1 6 . 1 1 35 35 ASP N N 35 121.194 121.194 120.563 0.631 25881
1461 1 6 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.665 -0.371 25881
1462 1 6 . 1 1 35 35 ASP C C 35 175.480 175.480 175.251 0.229 25881
1463 1 6 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.436 0.903 25881
1464 1 6 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.483 -3.123 25881
1465 1 6 . 1 1 35 35 ASP H H 35 7.115 7.115 7.912 -0.797 25881
1466 1 6 . 1 1 36 36 ALA N N 36 130.311 130.311 125.691 4.620 25881
1467 1 6 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.927 -1.040 25881
1468 1 6 . 1 1 36 36 ALA C C 36 177.717 177.717 176.794 0.923 25881
1469 1 6 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.406 2.120 25881
1470 1 6 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.459 -0.748 25881
1471 1 6 . 1 1 36 36 ALA H H 36 8.073 8.073 8.541 -0.468 25881
1472 1 6 . 1 1 37 37 ALA N N 37 117.133 117.133 121.868 -4.735 25881
1473 1 6 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.423 -0.337 25881
1474 1 6 . 1 1 37 37 ALA C C 37 178.989 178.989 178.647 0.342 25881
1475 1 6 . 1 1 37 37 ALA CA C 37 53.211 53.211 54.253 -1.042 25881
1476 1 6 . 1 1 37 37 ALA CB C 37 19.147 19.147 19.964 -0.817 25881
1477 1 6 . 1 1 37 37 ALA H H 37 7.839 7.839 8.577 -0.738 25881
1478 1 6 . 1 1 38 38 LYS N N 38 114.127 114.127 115.807 -1.680 25881
1479 1 6 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.495 -0.200 25881
1480 1 6 . 1 1 38 38 LYS C C 38 175.690 175.690 176.894 -1.204 25881
1481 1 6 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.727 -0.524 25881
1482 1 6 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.593 1.555 25881
1483 1 6 . 1 1 38 38 LYS H H 38 7.292 7.292 9.121 -1.829 25881
1484 1 6 . 1 1 39 39 HIS N N 39 122.110 122.110 122.217 -0.107 25881
1485 1 6 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.464 0.299 25881
1486 1 6 . 1 1 39 39 HIS C C 39 171.783 171.783 173.672 -1.889 25881
1487 1 6 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.700 -3.065 25881
1488 1 6 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.626 -1.997 25881
1489 1 6 . 1 1 39 39 HIS H H 39 8.393 8.393 8.385 0.008 25881
1490 1 6 . 1 1 40 40 VAL N N 40 123.393 123.393 127.451 -4.058 25881
1491 1 6 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.115 -0.368 25881
1492 1 6 . 1 1 40 40 VAL C C 40 175.292 175.292 175.471 -0.179 25881
1493 1 6 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.958 -0.793 25881
1494 1 6 . 1 1 40 40 VAL CB C 40 34.132 34.132 31.960 2.172 25881
1495 1 6 . 1 1 40 40 VAL H H 40 7.811 7.811 7.946 -0.135 25881
1496 1 6 . 1 1 41 41 HIS N N 41 125.669 125.669 125.676 -0.007 25881
1497 1 6 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.705 0.173 25881
1498 1 6 . 1 1 41 41 HIS C C 41 174.640 174.640 174.557 0.083 25881
1499 1 6 . 1 1 41 41 HIS CA C 41 52.900 52.900 55.475 -2.575 25881
1500 1 6 . 1 1 41 41 HIS CB C 41 30.067 30.067 32.588 -2.521 25881
1501 1 6 . 1 1 41 41 HIS H H 41 8.512 8.512 8.620 -0.108 25881
1502 1 6 . 1 1 42 42 LYS N N 42 123.564 123.564 121.977 1.587 25881
1503 1 6 . 1 1 42 42 LYS C C 42 176.739 176.739 176.158 0.581 25881
1504 1 6 . 1 1 42 42 LYS CA C 42 56.320 56.320 55.953 0.367 25881
1505 1 6 . 1 1 42 42 LYS CB C 42 33.229 33.229 33.275 -0.046 25881
1506 1 6 . 1 1 42 42 LYS H H 42 8.668 8.668 8.574 0.094 25881
1507 1 6 . 1 1 43 43 GLU N N 43 122.633 122.633 118.926 3.707 25881
1508 1 6 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.076 0.034 25881
1509 1 6 . 1 1 43 43 GLU C C 43 176.569 176.569 176.625 -0.056 25881
1510 1 6 . 1 1 43 43 GLU CA C 43 57.097 57.097 56.397 0.700 25881
1511 1 6 . 1 1 43 43 GLU CB C 43 29.948 29.948 30.090 -0.142 25881
1512 1 6 . 1 1 43 43 GLU H H 43 8.590 8.590 8.338 0.252 25881
1513 1 6 . 1 1 44 44 SER N N 44 115.147 115.147 115.945 -0.798 25881
1514 1 6 . 1 1 44 44 SER HA H 44 4.268 4.268 3.972 0.296 25881
1515 1 6 . 1 1 44 44 SER C C 44 174.336 174.336 173.773 0.563 25881
1516 1 6 . 1 1 44 44 SER CA C 44 58.348 58.348 59.823 -1.475 25881
1517 1 6 . 1 1 44 44 SER CB C 44 63.724 63.724 62.960 0.764 25881
1518 1 6 . 1 1 44 44 SER H H 44 8.105 8.105 8.771 -0.666 25881
1519 1 6 . 1 1 45 45 GLU N N 45 122.849 122.849 121.489 1.360 25881
1520 1 6 . 1 1 45 45 GLU HA H 45 4.163 4.163 3.993 0.170 25881
1521 1 6 . 1 1 45 45 GLU C C 45 175.304 175.304 175.123 0.181 25881
1522 1 6 . 1 1 45 45 GLU CA C 45 56.412 56.412 57.627 -1.215 25881
1523 1 6 . 1 1 45 45 GLU CB C 45 30.130 30.130 28.493 1.637 25881
1524 1 6 . 1 1 45 45 GLU H H 45 8.183 8.183 8.309 -0.126 25881
1525 1 7 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.503 -0.210 25881
1526 1 7 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 62.773 0.229 25881
1527 1 7 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 31.321 0.897 25881
1528 1 7 . 1 1 1 1 MET HA H 1 3.967 3.967 4.686 -0.719 25881
1529 1 7 . 1 1 1 1 MET CA C 1 57.335 57.335 56.584 0.751 25881
1530 1 7 . 1 1 1 1 MET CB C 1 34.180 34.180 34.513 -0.333 25881
1531 1 7 . 1 1 2 2 VAL C C 2 175.654 175.654 174.009 1.645 25881
1532 1 7 . 1 1 2 2 VAL CA C 2 55.183 55.183 63.238 -8.055 25881
1533 1 7 . 1 1 2 2 VAL CB C 2 33.173 33.173 30.208 2.965 25881
1534 1 7 . 1 1 3 3 SER N N 3 121.996 121.996 116.474 5.522 25881
1535 1 7 . 1 1 3 3 SER HA H 3 4.323 4.323 4.697 -0.374 25881
1536 1 7 . 1 1 3 3 SER C C 3 176.021 176.021 174.067 1.954 25881
1537 1 7 . 1 1 3 3 SER CA C 3 62.208 62.208 57.414 4.794 25881
1538 1 7 . 1 1 3 3 SER H H 3 8.103 8.103 7.568 0.535 25881
1539 1 7 . 1 1 4 4 SER N N 4 119.715 119.715 116.149 3.566 25881
1540 1 7 . 1 1 4 4 SER HA H 4 4.317 4.317 4.241 0.076 25881
1541 1 7 . 1 1 4 4 SER C C 4 174.010 174.010 173.302 0.708 25881
1542 1 7 . 1 1 4 4 SER CA C 4 58.177 58.177 58.978 -0.801 25881
1543 1 7 . 1 1 4 4 SER CB C 4 63.763 63.763 62.959 0.804 25881
1544 1 7 . 1 1 4 4 SER H H 4 8.298 8.298 8.539 -0.241 25881
1545 1 7 . 1 1 5 5 ALA N N 5 126.016 126.016 122.333 3.683 25881
1546 1 7 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.563 -0.394 25881
1547 1 7 . 1 1 5 5 ALA C C 5 177.297 177.297 175.073 2.224 25881
1548 1 7 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.898 0.486 25881
1549 1 7 . 1 1 5 5 ALA CB C 5 19.106 19.106 20.862 -1.756 25881
1550 1 7 . 1 1 5 5 ALA H H 5 8.119 8.119 7.644 0.475 25881
1551 1 7 . 1 1 6 6 VAL N N 6 119.174 119.174 118.713 0.461 25881
1552 1 7 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.437 -0.489 25881
1553 1 7 . 1 1 6 6 VAL C C 6 175.743 175.743 174.540 1.203 25881
1554 1 7 . 1 1 6 6 VAL CA C 6 61.668 61.668 60.574 1.094 25881
1555 1 7 . 1 1 6 6 VAL CB C 6 32.841 32.841 35.415 -2.574 25881
1556 1 7 . 1 1 6 6 VAL H H 6 7.861 7.861 8.272 -0.411 25881
1557 1 7 . 1 1 7 7 LYS N N 7 123.999 123.999 124.811 -0.812 25881
1558 1 7 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.718 -0.551 25881
1559 1 7 . 1 1 7 7 LYS C C 7 175.665 175.665 176.153 -0.488 25881
1560 1 7 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.183 1.107 25881
1561 1 7 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.068 0.473 25881
1562 1 7 . 1 1 7 7 LYS H H 7 8.054 8.054 8.365 -0.311 25881
1563 1 7 . 1 1 8 8 CYS N N 8 121.428 121.428 122.486 -1.058 25881
1564 1 7 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.382 -0.739 25881
1565 1 7 . 1 1 8 8 CYS C C 8 177.383 177.383 176.083 1.300 25881
1566 1 7 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.816 -0.049 25881
1567 1 7 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.760 4.149 25881
1568 1 7 . 1 1 8 8 CYS H H 8 8.539 8.539 8.855 -0.316 25881
1569 1 7 . 1 1 9 9 GLY N N 9 118.862 118.862 116.228 2.634 25881
1570 1 7 . 1 1 9 9 GLY C C 9 172.770 172.770 174.653 -1.883 25881
1571 1 7 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.644 0.500 25881
1572 1 7 . 1 1 9 9 GLY H H 9 9.365 9.365 8.880 0.485 25881
1573 1 7 . 1 1 10 10 ILE N N 10 122.885 122.885 118.466 4.419 25881
1574 1 7 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.136 -0.154 25881
1575 1 7 . 1 1 10 10 ILE C C 10 175.980 175.980 176.170 -0.190 25881
1576 1 7 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.211 0.845 25881
1577 1 7 . 1 1 10 10 ILE CB C 10 37.944 37.944 38.865 -0.921 25881
1578 1 7 . 1 1 10 10 ILE H H 10 8.972 8.972 7.288 1.684 25881
1579 1 7 . 1 1 11 11 CYS N N 11 118.245 118.245 114.687 3.558 25881
1580 1 7 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.773 -0.124 25881
1581 1 7 . 1 1 11 11 CYS C C 11 176.780 176.780 175.311 1.469 25881
1582 1 7 . 1 1 11 11 CYS CA C 11 59.094 59.094 58.006 1.088 25881
1583 1 7 . 1 1 11 11 CYS CB C 11 31.972 31.972 30.129 1.843 25881
1584 1 7 . 1 1 11 11 CYS H H 11 8.466 8.466 7.683 0.783 25881
1585 1 7 . 1 1 12 12 ARG N N 12 116.067 116.067 119.213 -3.146 25881
1586 1 7 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.129 0.087 25881
1587 1 7 . 1 1 12 12 ARG C C 12 175.637 175.637 176.435 -0.798 25881
1588 1 7 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.875 1.085 25881
1589 1 7 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.821 0.283 25881
1590 1 7 . 1 1 12 12 ARG H H 12 7.255 7.255 8.419 -1.164 25881
1591 1 7 . 1 1 13 13 GLY N N 13 109.951 109.951 106.129 3.822 25881
1592 1 7 . 1 1 13 13 GLY C C 13 173.169 173.169 173.918 -0.749 25881
1593 1 7 . 1 1 13 13 GLY CA C 13 44.304 44.304 46.012 -1.708 25881
1594 1 7 . 1 1 13 13 GLY H H 13 8.795 8.795 7.898 0.897 25881
1595 1 7 . 1 1 14 14 VAL N N 14 113.644 113.644 116.043 -2.399 25881
1596 1 7 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.703 -0.659 25881
1597 1 7 . 1 1 14 14 VAL C C 14 174.970 174.970 174.439 0.531 25881
1598 1 7 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.876 2.355 25881
1599 1 7 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.345 0.493 25881
1600 1 7 . 1 1 14 14 VAL H H 14 7.266 7.266 7.834 -0.568 25881
1601 1 7 . 1 1 15 15 ASP N N 15 119.913 119.913 118.712 1.201 25881
1602 1 7 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.651 -0.420 25881
1603 1 7 . 1 1 15 15 ASP C C 15 176.279 176.279 176.623 -0.344 25881
1604 1 7 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.836 0.187 25881
1605 1 7 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.560 -0.613 25881
1606 1 7 . 1 1 15 15 ASP H H 15 8.223 8.223 8.376 -0.153 25881
1607 1 7 . 1 1 16 16 GLY N N 16 109.534 109.534 107.340 2.194 25881
1608 1 7 . 1 1 16 16 GLY C C 16 173.120 173.120 174.831 -1.711 25881
1609 1 7 . 1 1 16 16 GLY CA C 16 46.096 46.096 43.981 2.115 25881
1610 1 7 . 1 1 16 16 GLY H H 16 8.617 8.617 8.936 -0.319 25881
1611 1 7 . 1 1 17 17 LYS N N 17 121.534 121.534 123.445 -1.911 25881
1612 1 7 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.018 -0.373 25881
1613 1 7 . 1 1 17 17 LYS C C 17 175.029 175.029 177.218 -2.189 25881
1614 1 7 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.451 -0.940 25881
1615 1 7 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.602 0.541 25881
1616 1 7 . 1 1 17 17 LYS H H 17 7.318 7.318 7.733 -0.415 25881
1617 1 7 . 1 1 18 18 TYR N N 18 119.391 119.391 120.414 -1.023 25881
1618 1 7 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.557 -0.105 25881
1619 1 7 . 1 1 18 18 TYR C C 18 174.241 174.241 174.945 -0.704 25881
1620 1 7 . 1 1 18 18 TYR CA C 18 55.548 55.548 58.284 -2.736 25881
1621 1 7 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.139 -1.643 25881
1622 1 7 . 1 1 18 18 TYR H H 18 7.661 7.661 7.980 -0.319 25881
1623 1 7 . 1 1 19 19 LYS N N 19 120.140 120.140 122.268 -2.128 25881
1624 1 7 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.519 0.422 25881
1625 1 7 . 1 1 19 19 LYS C C 19 176.321 176.321 174.425 1.896 25881
1626 1 7 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.096 0.468 25881
1627 1 7 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.903 0.115 25881
1628 1 7 . 1 1 19 19 LYS H H 19 8.395 8.395 8.191 0.204 25881
1629 1 7 . 1 1 20 20 CYS N N 20 131.127 131.127 124.236 6.891 25881
1630 1 7 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.018 -0.087 25881
1631 1 7 . 1 1 20 20 CYS C C 20 176.321 176.321 173.982 2.339 25881
1632 1 7 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.552 1.740 25881
1633 1 7 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.857 4.009 25881
1634 1 7 . 1 1 20 20 CYS H H 20 9.391 9.391 8.574 0.817 25881
1635 1 7 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.406 -0.006 25881
1636 1 7 . 1 1 21 21 PRO C C 21 176.764 176.764 176.513 0.251 25881
1637 1 7 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.334 0.101 25881
1638 1 7 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.490 0.835 25881
1639 1 7 . 1 1 22 22 LYS N N 22 120.217 120.217 117.716 2.501 25881
1640 1 7 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.493 -0.295 25881
1641 1 7 . 1 1 22 22 LYS C C 22 176.798 176.798 177.598 -0.800 25881
1642 1 7 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.637 -0.010 25881
1643 1 7 . 1 1 22 22 LYS CB C 22 33.262 33.262 33.072 0.190 25881
1644 1 7 . 1 1 22 22 LYS H H 22 8.550 8.550 8.060 0.490 25881
1645 1 7 . 1 1 23 23 CYS N N 23 115.450 115.450 114.023 1.427 25881
1646 1 7 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.942 0.045 25881
1647 1 7 . 1 1 23 23 CYS C C 23 176.434 176.434 176.397 0.037 25881
1648 1 7 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.629 -0.474 25881
1649 1 7 . 1 1 23 23 CYS CB C 23 32.482 32.482 29.806 2.676 25881
1650 1 7 . 1 1 23 23 CYS H H 23 7.886 7.886 8.016 -0.130 25881
1651 1 7 . 1 1 24 24 GLY N N 24 112.961 112.961 110.496 2.465 25881
1652 1 7 . 1 1 24 24 GLY C C 24 173.369 173.369 173.732 -0.363 25881
1653 1 7 . 1 1 24 24 GLY CA C 24 46.152 46.152 45.016 1.136 25881
1654 1 7 . 1 1 24 24 GLY H H 24 7.958 7.958 8.279 -0.321 25881
1655 1 7 . 1 1 25 25 VAL N N 25 123.968 123.968 119.960 4.008 25881
1656 1 7 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.107 -0.128 25881
1657 1 7 . 1 1 25 25 VAL C C 25 173.934 173.934 174.518 -0.584 25881
1658 1 7 . 1 1 25 25 VAL CA C 25 63.136 63.136 60.963 2.173 25881
1659 1 7 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.517 -1.558 25881
1660 1 7 . 1 1 25 25 VAL H H 25 8.348 8.348 7.322 1.026 25881
1661 1 7 . 1 1 26 26 ARG N N 26 125.641 125.641 124.101 1.540 25881
1662 1 7 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.626 0.634 25881
1663 1 7 . 1 1 26 26 ARG C C 26 177.008 177.008 175.448 1.560 25881
1664 1 7 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.714 -0.386 25881
1665 1 7 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.515 -2.192 25881
1666 1 7 . 1 1 26 26 ARG H H 26 8.379 8.379 8.211 0.168 25881
1667 1 7 . 1 1 27 27 TYR N N 27 117.706 117.706 118.550 -0.844 25881
1668 1 7 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.080 1.613 25881
1669 1 7 . 1 1 27 27 TYR C C 27 175.404 175.404 176.257 -0.853 25881
1670 1 7 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.187 1.289 25881
1671 1 7 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.659 2.244 25881
1672 1 7 . 1 1 27 27 TYR H H 27 8.631 8.631 8.386 0.245 25881
1673 1 7 . 1 1 28 28 CYS N N 28 118.515 118.515 117.068 1.447 25881
1674 1 7 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.982 -0.077 25881
1675 1 7 . 1 1 28 28 CYS C C 28 176.186 176.186 175.114 1.072 25881
1676 1 7 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.427 0.187 25881
1677 1 7 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.879 6.948 25881
1678 1 7 . 1 1 28 28 CYS H H 28 8.817 8.817 8.377 0.440 25881
1679 1 7 . 1 1 29 29 SER N N 29 114.067 114.067 113.176 0.891 25881
1680 1 7 . 1 1 29 29 SER HA H 29 4.877 4.877 4.169 0.708 25881
1681 1 7 . 1 1 29 29 SER C C 29 178.077 178.077 173.305 4.772 25881
1682 1 7 . 1 1 29 29 SER CA C 29 57.260 57.260 57.449 -0.189 25881
1683 1 7 . 1 1 29 29 SER CB C 29 65.051 65.051 64.177 0.874 25881
1684 1 7 . 1 1 29 29 SER H H 29 7.400 7.400 7.348 0.052 25881
1685 1 7 . 1 1 30 30 LEU HA H 30 4.039 4.039 4.149 -0.110 25881
1686 1 7 . 1 1 30 30 LEU C C 30 178.077 178.077 177.491 0.586 25881
1687 1 7 . 1 1 30 30 LEU CA C 30 57.451 57.451 56.911 0.540 25881
1688 1 7 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.687 -0.458 25881
1689 1 7 . 1 1 30 30 LEU H H 30 6.951 6.951 8.442 -1.491 25881
1690 1 7 . 1 1 31 31 LYS N N 31 118.534 118.534 118.733 -0.199 25881
1691 1 7 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.035 -0.245 25881
1692 1 7 . 1 1 31 31 LYS C C 31 179.162 179.162 176.851 2.311 25881
1693 1 7 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.649 1.218 25881
1694 1 7 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.714 0.193 25881
1695 1 7 . 1 1 31 31 LYS H H 31 8.030 8.030 7.593 0.437 25881
1696 1 7 . 1 1 32 32 CYS N N 32 118.700 118.700 115.885 2.815 25881
1697 1 7 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.582 -0.597 25881
1698 1 7 . 1 1 32 32 CYS C C 32 176.766 176.766 177.044 -0.278 25881
1699 1 7 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.860 5.819 25881
1700 1 7 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.311 2.238 25881
1701 1 7 . 1 1 32 32 CYS H H 32 7.424 7.424 7.631 -0.207 25881
1702 1 7 . 1 1 33 33 TYR N N 33 118.151 118.151 123.449 -5.298 25881
1703 1 7 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.390 -0.280 25881
1704 1 7 . 1 1 33 33 TYR C C 33 178.549 178.549 176.284 2.265 25881
1705 1 7 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.785 2.402 25881
1706 1 7 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.748 1.098 25881
1707 1 7 . 1 1 33 33 TYR H H 33 7.918 7.918 7.828 0.090 25881
1708 1 7 . 1 1 34 34 LYS N N 34 114.631 114.631 118.127 -3.496 25881
1709 1 7 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.282 -0.360 25881
1710 1 7 . 1 1 34 34 LYS C C 34 174.991 174.991 175.308 -0.317 25881
1711 1 7 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.450 0.501 25881
1712 1 7 . 1 1 34 34 LYS CB C 34 32.145 32.145 30.992 1.153 25881
1713 1 7 . 1 1 34 34 LYS H H 34 7.939 7.939 7.623 0.316 25881
1714 1 7 . 1 1 35 35 ASP N N 35 121.194 121.194 119.980 1.214 25881
1715 1 7 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.669 -0.375 25881
1716 1 7 . 1 1 35 35 ASP C C 35 175.480 175.480 175.006 0.474 25881
1717 1 7 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.415 0.924 25881
1718 1 7 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.309 -2.948 25881
1719 1 7 . 1 1 35 35 ASP H H 35 7.115 7.115 7.798 -0.683 25881
1720 1 7 . 1 1 36 36 ALA N N 36 130.311 130.311 126.424 3.887 25881
1721 1 7 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.873 -0.986 25881
1722 1 7 . 1 1 36 36 ALA C C 36 177.717 177.717 176.494 1.223 25881
1723 1 7 . 1 1 36 36 ALA CA C 36 53.526 53.526 50.822 2.704 25881
1724 1 7 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.423 -0.712 25881
1725 1 7 . 1 1 36 36 ALA H H 36 8.073 8.073 8.517 -0.444 25881
1726 1 7 . 1 1 37 37 ALA N N 37 117.133 117.133 120.941 -3.808 25881
1727 1 7 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.530 -0.444 25881
1728 1 7 . 1 1 37 37 ALA C C 37 178.989 178.989 178.475 0.514 25881
1729 1 7 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.847 -0.636 25881
1730 1 7 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.120 -0.974 25881
1731 1 7 . 1 1 37 37 ALA H H 37 7.839 7.839 8.633 -0.794 25881
1732 1 7 . 1 1 38 38 LYS N N 38 114.127 114.127 116.665 -2.538 25881
1733 1 7 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.496 -0.201 25881
1734 1 7 . 1 1 38 38 LYS C C 38 175.690 175.690 177.116 -1.426 25881
1735 1 7 . 1 1 38 38 LYS CA C 38 56.203 56.203 57.032 -0.829 25881
1736 1 7 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.547 1.601 25881
1737 1 7 . 1 1 38 38 LYS H H 38 7.292 7.292 9.165 -1.873 25881
1738 1 7 . 1 1 39 39 HIS N N 39 122.110 122.110 121.483 0.627 25881
1739 1 7 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.578 0.185 25881
1740 1 7 . 1 1 39 39 HIS C C 39 171.783 171.783 173.417 -1.634 25881
1741 1 7 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.130 -2.495 25881
1742 1 7 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.573 -1.944 25881
1743 1 7 . 1 1 39 39 HIS H H 39 8.393 8.393 8.752 -0.359 25881
1744 1 7 . 1 1 40 40 VAL N N 40 123.393 123.393 127.261 -3.868 25881
1745 1 7 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.214 -0.467 25881
1746 1 7 . 1 1 40 40 VAL C C 40 175.292 175.292 176.043 -0.751 25881
1747 1 7 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.554 -0.390 25881
1748 1 7 . 1 1 40 40 VAL CB C 40 34.132 34.132 32.410 1.722 25881
1749 1 7 . 1 1 40 40 VAL H H 40 7.811 7.811 8.026 -0.215 25881
1750 1 7 . 1 1 41 41 HIS N N 41 125.669 125.669 127.629 -1.960 25881
1751 1 7 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.733 0.145 25881
1752 1 7 . 1 1 41 41 HIS C C 41 174.640 174.640 175.499 -0.859 25881
1753 1 7 . 1 1 41 41 HIS CA C 41 52.900 52.900 54.756 -1.856 25881
1754 1 7 . 1 1 41 41 HIS CB C 41 30.067 30.067 32.394 -2.327 25881
1755 1 7 . 1 1 41 41 HIS H H 41 8.512 8.512 8.449 0.063 25881
1756 1 7 . 1 1 42 42 LYS N N 42 123.564 123.564 120.323 3.241 25881
1757 1 7 . 1 1 42 42 LYS C C 42 176.739 176.739 176.673 0.066 25881
1758 1 7 . 1 1 42 42 LYS CA C 42 56.320 56.320 56.512 -0.192 25881
1759 1 7 . 1 1 42 42 LYS CB C 42 33.229 33.229 32.529 0.700 25881
1760 1 7 . 1 1 42 42 LYS H H 42 8.668 8.668 8.615 0.053 25881
1761 1 7 . 1 1 43 43 GLU N N 43 122.633 122.633 117.961 4.672 25881
1762 1 7 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.433 -0.323 25881
1763 1 7 . 1 1 43 43 GLU C C 43 176.569 176.569 176.286 0.283 25881
1764 1 7 . 1 1 43 43 GLU CA C 43 57.097 57.097 56.042 1.055 25881
1765 1 7 . 1 1 43 43 GLU CB C 43 29.948 29.948 29.543 0.405 25881
1766 1 7 . 1 1 43 43 GLU H H 43 8.590 8.590 8.453 0.137 25881
1767 1 7 . 1 1 44 44 SER N N 44 115.147 115.147 118.120 -2.973 25881
1768 1 7 . 1 1 44 44 SER HA H 44 4.268 4.268 4.398 -0.130 25881
1769 1 7 . 1 1 44 44 SER C C 44 174.336 174.336 174.304 0.032 25881
1770 1 7 . 1 1 44 44 SER CA C 44 58.348 58.348 58.325 0.023 25881
1771 1 7 . 1 1 44 44 SER CB C 44 63.724 63.724 62.809 0.915 25881
1772 1 7 . 1 1 44 44 SER H H 44 8.105 8.105 8.031 0.074 25881
1773 1 7 . 1 1 45 45 GLU N N 45 122.849 122.849 126.706 -3.857 25881
1774 1 7 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.284 -0.121 25881
1775 1 7 . 1 1 45 45 GLU C C 45 175.304 175.304 175.687 -0.383 25881
1776 1 7 . 1 1 45 45 GLU CA C 45 56.412 56.412 56.767 -0.355 25881
1777 1 7 . 1 1 45 45 GLU CB C 45 30.130 30.130 28.401 1.729 25881
1778 1 7 . 1 1 45 45 GLU H H 45 8.183 8.183 8.554 -0.371 25881
1779 1 8 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.445 -0.152 25881
1780 1 8 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 62.625 0.377 25881
1781 1 8 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 32.879 -0.661 25881
1782 1 8 . 1 1 1 1 MET HA H 1 3.967 3.967 4.670 -0.703 25881
1783 1 8 . 1 1 1 1 MET CA C 1 57.335 57.335 54.755 2.580 25881
1784 1 8 . 1 1 1 1 MET CB C 1 34.180 34.180 34.511 -0.332 25881
1785 1 8 . 1 1 2 2 VAL C C 2 175.654 175.654 175.984 -0.330 25881
1786 1 8 . 1 1 2 2 VAL CA C 2 55.183 55.183 62.674 -7.491 25881
1787 1 8 . 1 1 2 2 VAL CB C 2 33.173 33.173 32.571 0.602 25881
1788 1 8 . 1 1 3 3 SER N N 3 121.996 121.996 114.797 7.199 25881
1789 1 8 . 1 1 3 3 SER HA H 3 4.323 4.323 4.534 -0.211 25881
1790 1 8 . 1 1 3 3 SER C C 3 176.021 176.021 174.332 1.689 25881
1791 1 8 . 1 1 3 3 SER CA C 3 62.208 62.208 58.094 4.114 25881
1792 1 8 . 1 1 3 3 SER H H 3 8.103 8.103 7.695 0.408 25881
1793 1 8 . 1 1 4 4 SER N N 4 119.715 119.715 115.785 3.930 25881
1794 1 8 . 1 1 4 4 SER HA H 4 4.317 4.317 4.261 0.056 25881
1795 1 8 . 1 1 4 4 SER C C 4 174.010 174.010 173.224 0.786 25881
1796 1 8 . 1 1 4 4 SER CA C 4 58.177 58.177 58.677 -0.500 25881
1797 1 8 . 1 1 4 4 SER CB C 4 63.763 63.763 62.517 1.246 25881
1798 1 8 . 1 1 4 4 SER H H 4 8.298 8.298 8.439 -0.141 25881
1799 1 8 . 1 1 5 5 ALA N N 5 126.016 126.016 122.844 3.172 25881
1800 1 8 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.317 -0.148 25881
1801 1 8 . 1 1 5 5 ALA C C 5 177.297 177.297 176.064 1.233 25881
1802 1 8 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.651 0.733 25881
1803 1 8 . 1 1 5 5 ALA CB C 5 19.106 19.106 19.951 -0.845 25881
1804 1 8 . 1 1 5 5 ALA H H 5 8.119 8.119 8.037 0.082 25881
1805 1 8 . 1 1 6 6 VAL N N 6 119.174 119.174 119.553 -0.379 25881
1806 1 8 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.326 -0.378 25881
1807 1 8 . 1 1 6 6 VAL C C 6 175.743 175.743 174.473 1.270 25881
1808 1 8 . 1 1 6 6 VAL CA C 6 61.668 61.668 61.289 0.378 25881
1809 1 8 . 1 1 6 6 VAL CB C 6 32.841 32.841 35.307 -2.466 25881
1810 1 8 . 1 1 6 6 VAL H H 6 7.861 7.861 8.116 -0.255 25881
1811 1 8 . 1 1 7 7 LYS N N 7 123.999 123.999 124.196 -0.197 25881
1812 1 8 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.659 -0.492 25881
1813 1 8 . 1 1 7 7 LYS C C 7 175.665 175.665 176.222 -0.557 25881
1814 1 8 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.192 1.098 25881
1815 1 8 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.266 0.275 25881
1816 1 8 . 1 1 7 7 LYS H H 7 8.054 8.054 8.257 -0.203 25881
1817 1 8 . 1 1 8 8 CYS N N 8 121.428 121.428 122.867 -1.439 25881
1818 1 8 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.398 -0.755 25881
1819 1 8 . 1 1 8 8 CYS C C 8 177.383 177.383 176.373 1.010 25881
1820 1 8 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.694 0.072 25881
1821 1 8 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.494 4.415 25881
1822 1 8 . 1 1 8 8 CYS H H 8 8.539 8.539 8.871 -0.332 25881
1823 1 8 . 1 1 9 9 GLY N N 9 118.862 118.862 116.411 2.451 25881
1824 1 8 . 1 1 9 9 GLY C C 9 172.770 172.770 174.956 -2.186 25881
1825 1 8 . 1 1 9 9 GLY CA C 9 46.144 46.144 46.133 0.012 25881
1826 1 8 . 1 1 9 9 GLY H H 9 9.365 9.365 8.926 0.439 25881
1827 1 8 . 1 1 10 10 ILE N N 10 122.885 122.885 118.860 4.025 25881
1828 1 8 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.247 -0.265 25881
1829 1 8 . 1 1 10 10 ILE C C 10 175.980 175.980 175.432 0.548 25881
1830 1 8 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.816 0.240 25881
1831 1 8 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.118 -1.174 25881
1832 1 8 . 1 1 10 10 ILE H H 10 8.972 8.972 7.384 1.588 25881
1833 1 8 . 1 1 11 11 CYS N N 11 118.245 118.245 113.686 4.559 25881
1834 1 8 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.715 -0.066 25881
1835 1 8 . 1 1 11 11 CYS C C 11 176.780 176.780 175.198 1.582 25881
1836 1 8 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.725 1.369 25881
1837 1 8 . 1 1 11 11 CYS CB C 11 31.972 31.972 29.417 2.555 25881
1838 1 8 . 1 1 11 11 CYS H H 11 8.466 8.466 7.498 0.968 25881
1839 1 8 . 1 1 12 12 ARG N N 12 116.067 116.067 119.767 -3.700 25881
1840 1 8 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.103 0.113 25881
1841 1 8 . 1 1 12 12 ARG C C 12 175.637 175.637 176.556 -0.919 25881
1842 1 8 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.956 1.004 25881
1843 1 8 . 1 1 12 12 ARG CB C 12 27.104 27.104 27.133 -0.029 25881
1844 1 8 . 1 1 12 12 ARG H H 12 7.255 7.255 8.494 -1.239 25881
1845 1 8 . 1 1 13 13 GLY N N 13 109.951 109.951 105.209 4.742 25881
1846 1 8 . 1 1 13 13 GLY C C 13 173.169 173.169 173.740 -0.571 25881
1847 1 8 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.417 -1.113 25881
1848 1 8 . 1 1 13 13 GLY H H 13 8.795 8.795 7.840 0.955 25881
1849 1 8 . 1 1 14 14 VAL N N 14 113.644 113.644 115.369 -1.725 25881
1850 1 8 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.732 -0.688 25881
1851 1 8 . 1 1 14 14 VAL C C 14 174.970 174.970 174.353 0.617 25881
1852 1 8 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.831 2.400 25881
1853 1 8 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.925 -0.087 25881
1854 1 8 . 1 1 14 14 VAL H H 14 7.266 7.266 7.837 -0.571 25881
1855 1 8 . 1 1 15 15 ASP N N 15 119.913 119.913 119.333 0.580 25881
1856 1 8 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.729 -0.498 25881
1857 1 8 . 1 1 15 15 ASP C C 15 176.279 176.279 176.928 -0.649 25881
1858 1 8 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.388 0.635 25881
1859 1 8 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.718 -0.771 25881
1860 1 8 . 1 1 15 15 ASP H H 15 8.223 8.223 8.361 -0.138 25881
1861 1 8 . 1 1 16 16 GLY N N 16 109.534 109.534 107.814 1.720 25881
1862 1 8 . 1 1 16 16 GLY C C 16 173.120 173.120 174.745 -1.625 25881
1863 1 8 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.163 1.933 25881
1864 1 8 . 1 1 16 16 GLY H H 16 8.617 8.617 8.791 -0.174 25881
1865 1 8 . 1 1 17 17 LYS N N 17 121.534 121.534 123.125 -1.591 25881
1866 1 8 . 1 1 17 17 LYS HA H 17 3.645 3.645 3.997 -0.352 25881
1867 1 8 . 1 1 17 17 LYS C C 17 175.029 175.029 177.037 -2.008 25881
1868 1 8 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.574 -1.063 25881
1869 1 8 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.526 0.619 25881
1870 1 8 . 1 1 17 17 LYS H H 17 7.318 7.318 7.689 -0.371 25881
1871 1 8 . 1 1 18 18 TYR N N 18 119.391 119.391 119.595 -0.204 25881
1872 1 8 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.663 -0.211 25881
1873 1 8 . 1 1 18 18 TYR C C 18 174.241 174.241 174.580 -0.339 25881
1874 1 8 . 1 1 18 18 TYR CA C 18 55.548 55.548 57.526 -1.978 25881
1875 1 8 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.572 -2.076 25881
1876 1 8 . 1 1 18 18 TYR H H 18 7.661 7.661 8.121 -0.460 25881
1877 1 8 . 1 1 19 19 LYS N N 19 120.140 120.140 121.632 -1.492 25881
1878 1 8 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.541 0.400 25881
1879 1 8 . 1 1 19 19 LYS C C 19 176.321 176.321 174.580 1.741 25881
1880 1 8 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.197 0.367 25881
1881 1 8 . 1 1 19 19 LYS CB C 19 36.018 36.018 36.171 -0.153 25881
1882 1 8 . 1 1 19 19 LYS H H 19 8.395 8.395 8.380 0.015 25881
1883 1 8 . 1 1 20 20 CYS N N 20 131.127 131.127 124.564 6.563 25881
1884 1 8 . 1 1 20 20 CYS HA H 20 4.931 4.931 4.985 -0.054 25881
1885 1 8 . 1 1 20 20 CYS C C 20 176.321 176.321 174.241 2.080 25881
1886 1 8 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.750 1.542 25881
1887 1 8 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.976 3.890 25881
1888 1 8 . 1 1 20 20 CYS H H 20 9.391 9.391 8.509 0.882 25881
1889 1 8 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.376 0.024 25881
1890 1 8 . 1 1 21 21 PRO C C 21 176.764 176.764 176.634 0.130 25881
1891 1 8 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.615 -0.181 25881
1892 1 8 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.600 0.725 25881
1893 1 8 . 1 1 22 22 LYS N N 22 120.217 120.217 118.868 1.349 25881
1894 1 8 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.372 -0.174 25881
1895 1 8 . 1 1 22 22 LYS C C 22 176.798 176.798 177.763 -0.965 25881
1896 1 8 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.256 0.371 25881
1897 1 8 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.663 0.599 25881
1898 1 8 . 1 1 22 22 LYS H H 22 8.550 8.550 8.165 0.385 25881
1899 1 8 . 1 1 23 23 CYS N N 23 115.450 115.450 114.170 1.280 25881
1900 1 8 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.961 0.026 25881
1901 1 8 . 1 1 23 23 CYS C C 23 176.434 176.434 176.238 0.196 25881
1902 1 8 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.393 -0.238 25881
1903 1 8 . 1 1 23 23 CYS CB C 23 32.482 32.482 29.956 2.526 25881
1904 1 8 . 1 1 23 23 CYS H H 23 7.886 7.886 8.184 -0.298 25881
1905 1 8 . 1 1 24 24 GLY N N 24 112.961 112.961 110.366 2.595 25881
1906 1 8 . 1 1 24 24 GLY C C 24 173.369 173.369 173.759 -0.390 25881
1907 1 8 . 1 1 24 24 GLY CA C 24 46.152 46.152 45.195 0.957 25881
1908 1 8 . 1 1 24 24 GLY H H 24 7.958 7.958 8.215 -0.257 25881
1909 1 8 . 1 1 25 25 VAL N N 25 123.968 123.968 119.759 4.209 25881
1910 1 8 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.040 -0.061 25881
1911 1 8 . 1 1 25 25 VAL C C 25 173.934 173.934 174.439 -0.505 25881
1912 1 8 . 1 1 25 25 VAL CA C 25 63.136 63.136 60.808 2.328 25881
1913 1 8 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.404 -1.445 25881
1914 1 8 . 1 1 25 25 VAL H H 25 8.348 8.348 7.372 0.976 25881
1915 1 8 . 1 1 26 26 ARG N N 26 125.641 125.641 124.500 1.141 25881
1916 1 8 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.599 0.661 25881
1917 1 8 . 1 1 26 26 ARG C C 26 177.008 177.008 175.468 1.540 25881
1918 1 8 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.667 -0.339 25881
1919 1 8 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.472 -2.149 25881
1920 1 8 . 1 1 26 26 ARG H H 26 8.379 8.379 8.254 0.125 25881
1921 1 8 . 1 1 27 27 TYR N N 27 117.706 117.706 118.314 -0.608 25881
1922 1 8 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.100 1.593 25881
1923 1 8 . 1 1 27 27 TYR C C 27 175.404 175.404 176.231 -0.827 25881
1924 1 8 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.449 1.027 25881
1925 1 8 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.924 1.979 25881
1926 1 8 . 1 1 27 27 TYR H H 27 8.631 8.631 8.302 0.329 25881
1927 1 8 . 1 1 28 28 CYS N N 28 118.515 118.515 116.108 2.407 25881
1928 1 8 . 1 1 28 28 CYS HA H 28 4.905 4.905 5.043 -0.138 25881
1929 1 8 . 1 1 28 28 CYS C C 28 176.186 176.186 174.714 1.472 25881
1930 1 8 . 1 1 28 28 CYS CA C 28 58.614 58.614 57.881 0.733 25881
1931 1 8 . 1 1 28 28 CYS CB C 28 34.827 34.827 28.092 6.735 25881
1932 1 8 . 1 1 28 28 CYS H H 28 8.817 8.817 8.368 0.449 25881
1933 1 8 . 1 1 29 29 SER N N 29 114.067 114.067 112.514 1.553 25881
1934 1 8 . 1 1 29 29 SER HA H 29 4.877 4.877 4.253 0.624 25881
1935 1 8 . 1 1 29 29 SER C C 29 178.077 178.077 173.750 4.327 25881
1936 1 8 . 1 1 29 29 SER CA C 29 57.260 57.260 57.364 -0.104 25881
1937 1 8 . 1 1 29 29 SER CB C 29 65.051 65.051 64.000 1.051 25881
1938 1 8 . 1 1 29 29 SER H H 29 7.400 7.400 7.386 0.014 25881
1939 1 8 . 1 1 30 30 LEU HA H 30 4.039 4.039 3.969 0.070 25881
1940 1 8 . 1 1 30 30 LEU C C 30 178.077 178.077 178.542 -0.465 25881
1941 1 8 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.593 -0.142 25881
1942 1 8 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.484 -0.255 25881
1943 1 8 . 1 1 30 30 LEU H H 30 6.951 6.951 8.534 -1.583 25881
1944 1 8 . 1 1 31 31 LYS N N 31 118.534 118.534 119.271 -0.737 25881
1945 1 8 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.083 -0.293 25881
1946 1 8 . 1 1 31 31 LYS C C 31 179.162 179.162 177.629 1.533 25881
1947 1 8 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.808 1.059 25881
1948 1 8 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.613 0.294 25881
1949 1 8 . 1 1 31 31 LYS H H 31 8.030 8.030 7.709 0.321 25881
1950 1 8 . 1 1 32 32 CYS N N 32 118.700 118.700 116.734 1.966 25881
1951 1 8 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.636 -0.651 25881
1952 1 8 . 1 1 32 32 CYS C C 32 176.766 176.766 177.112 -0.346 25881
1953 1 8 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.557 6.122 25881
1954 1 8 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.762 1.787 25881
1955 1 8 . 1 1 32 32 CYS H H 32 7.424 7.424 7.657 -0.233 25881
1956 1 8 . 1 1 33 33 TYR N N 33 118.151 118.151 123.695 -5.544 25881
1957 1 8 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.450 -0.340 25881
1958 1 8 . 1 1 33 33 TYR C C 33 178.549 178.549 176.533 2.016 25881
1959 1 8 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.945 2.242 25881
1960 1 8 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.769 1.077 25881
1961 1 8 . 1 1 33 33 TYR H H 33 7.918 7.918 8.140 -0.222 25881
1962 1 8 . 1 1 34 34 LYS N N 34 114.631 114.631 117.969 -3.338 25881
1963 1 8 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.270 -0.348 25881
1964 1 8 . 1 1 34 34 LYS C C 34 174.991 174.991 175.299 -0.308 25881
1965 1 8 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.518 0.433 25881
1966 1 8 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.174 0.972 25881
1967 1 8 . 1 1 34 34 LYS H H 34 7.939 7.939 7.816 0.123 25881
1968 1 8 . 1 1 35 35 ASP N N 35 121.194 121.194 120.187 1.007 25881
1969 1 8 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.702 -0.408 25881
1970 1 8 . 1 1 35 35 ASP C C 35 175.480 175.480 174.972 0.508 25881
1971 1 8 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.444 0.895 25881
1972 1 8 . 1 1 35 35 ASP CB C 35 40.361 40.361 42.811 -2.450 25881
1973 1 8 . 1 1 35 35 ASP H H 35 7.115 7.115 7.779 -0.664 25881
1974 1 8 . 1 1 36 36 ALA N N 36 130.311 130.311 126.275 4.036 25881
1975 1 8 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.948 -1.061 25881
1976 1 8 . 1 1 36 36 ALA C C 36 177.717 177.717 176.352 1.365 25881
1977 1 8 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.684 1.842 25881
1978 1 8 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.014 -0.303 25881
1979 1 8 . 1 1 36 36 ALA H H 36 8.073 8.073 8.465 -0.392 25881
1980 1 8 . 1 1 37 37 ALA N N 37 117.133 117.133 122.574 -5.441 25881
1981 1 8 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.435 -0.349 25881
1982 1 8 . 1 1 37 37 ALA C C 37 178.989 178.989 178.473 0.516 25881
1983 1 8 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.424 -0.213 25881
1984 1 8 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.325 -1.178 25881
1985 1 8 . 1 1 37 37 ALA H H 37 7.839 7.839 8.904 -1.065 25881
1986 1 8 . 1 1 38 38 LYS N N 38 114.127 114.127 116.895 -2.768 25881
1987 1 8 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.469 -0.174 25881
1988 1 8 . 1 1 38 38 LYS C C 38 175.690 175.690 177.151 -1.461 25881
1989 1 8 . 1 1 38 38 LYS CA C 38 56.203 56.203 57.140 -0.937 25881
1990 1 8 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.239 1.909 25881
1991 1 8 . 1 1 38 38 LYS H H 38 7.292 7.292 9.064 -1.772 25881
1992 1 8 . 1 1 39 39 HIS N N 39 122.110 122.110 122.283 -0.173 25881
1993 1 8 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.617 0.146 25881
1994 1 8 . 1 1 39 39 HIS C C 39 171.783 171.783 173.359 -1.576 25881
1995 1 8 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.240 -2.605 25881
1996 1 8 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.538 -1.909 25881
1997 1 8 . 1 1 39 39 HIS H H 39 8.393 8.393 8.460 -0.067 25881
1998 1 8 . 1 1 40 40 VAL N N 40 123.393 123.393 127.833 -4.440 25881
1999 1 8 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.295 -0.548 25881
2000 1 8 . 1 1 40 40 VAL C C 40 175.292 175.292 175.380 -0.088 25881
2001 1 8 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.355 -0.191 25881
2002 1 8 . 1 1 40 40 VAL CB C 40 34.132 34.132 33.905 0.227 25881
2003 1 8 . 1 1 40 40 VAL H H 40 7.811 7.811 8.036 -0.225 25881
2004 1 8 . 1 1 41 41 HIS N N 41 125.669 125.669 128.855 -3.186 25881
2005 1 8 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.581 0.297 25881
2006 1 8 . 1 1 41 41 HIS C C 41 174.640 174.640 174.534 0.106 25881
2007 1 8 . 1 1 41 41 HIS CA C 41 52.900 52.900 56.098 -3.198 25881
2008 1 8 . 1 1 41 41 HIS CB C 41 30.067 30.067 28.657 1.410 25881
2009 1 8 . 1 1 41 41 HIS H H 41 8.512 8.512 8.801 -0.289 25881
2010 1 8 . 1 1 42 42 LYS N N 42 123.564 123.564 124.783 -1.219 25881
2011 1 8 . 1 1 42 42 LYS C C 42 176.739 176.739 176.191 0.548 25881
2012 1 8 . 1 1 42 42 LYS CA C 42 56.320 56.320 55.980 0.340 25881
2013 1 8 . 1 1 42 42 LYS CB C 42 33.229 33.229 33.680 -0.451 25881
2014 1 8 . 1 1 42 42 LYS H H 42 8.668 8.668 8.016 0.652 25881
2015 1 8 . 1 1 43 43 GLU N N 43 122.633 122.633 123.177 -0.544 25881
2016 1 8 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.417 -0.307 25881
2017 1 8 . 1 1 43 43 GLU C C 43 176.569 176.569 175.796 0.773 25881
2018 1 8 . 1 1 43 43 GLU CA C 43 57.097 57.097 56.385 0.713 25881
2019 1 8 . 1 1 43 43 GLU CB C 43 29.948 29.948 29.686 0.262 25881
2020 1 8 . 1 1 43 43 GLU H H 43 8.590 8.590 8.598 -0.008 25881
2021 1 8 . 1 1 44 44 SER N N 44 115.147 115.147 114.505 0.642 25881
2022 1 8 . 1 1 44 44 SER HA H 44 4.268 4.268 4.644 -0.376 25881
2023 1 8 . 1 1 44 44 SER C C 44 174.336 174.336 173.827 0.509 25881
2024 1 8 . 1 1 44 44 SER CA C 44 58.348 58.348 57.337 1.011 25881
2025 1 8 . 1 1 44 44 SER CB C 44 63.724 63.724 64.651 -0.927 25881
2026 1 8 . 1 1 44 44 SER H H 44 8.105 8.105 7.814 0.291 25881
2027 1 8 . 1 1 45 45 GLU N N 45 122.849 122.849 121.885 0.964 25881
2028 1 8 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.418 -0.255 25881
2029 1 8 . 1 1 45 45 GLU C C 45 175.304 175.304 175.559 -0.255 25881
2030 1 8 . 1 1 45 45 GLU CA C 45 56.412 56.412 56.756 -0.344 25881
2031 1 8 . 1 1 45 45 GLU CB C 45 30.130 30.130 29.761 0.369 25881
2032 1 8 . 1 1 45 45 GLU H H 45 8.183 8.183 8.631 -0.448 25881
2033 1 9 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.523 -0.230 25881
2034 1 9 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 63.053 -0.051 25881
2035 1 9 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 30.016 2.202 25881
2036 1 9 . 1 1 1 1 MET HA H 1 3.967 3.967 4.652 -0.685 25881
2037 1 9 . 1 1 1 1 MET CA C 1 57.335 57.335 55.443 1.892 25881
2038 1 9 . 1 1 1 1 MET CB C 1 34.180 34.180 34.408 -0.228 25881
2039 1 9 . 1 1 2 2 VAL C C 2 175.654 175.654 176.091 -0.437 25881
2040 1 9 . 1 1 2 2 VAL CA C 2 55.183 55.183 63.400 -8.217 25881
2041 1 9 . 1 1 2 2 VAL CB C 2 33.173 33.173 32.537 0.636 25881
2042 1 9 . 1 1 3 3 SER N N 3 121.996 121.996 115.406 6.590 25881
2043 1 9 . 1 1 3 3 SER HA H 3 4.323 4.323 4.538 -0.215 25881
2044 1 9 . 1 1 3 3 SER C C 3 176.021 176.021 174.884 1.137 25881
2045 1 9 . 1 1 3 3 SER CA C 3 62.208 62.208 58.393 3.815 25881
2046 1 9 . 1 1 3 3 SER H H 3 8.103 8.103 8.138 -0.035 25881
2047 1 9 . 1 1 4 4 SER N N 4 119.715 119.715 118.016 1.699 25881
2048 1 9 . 1 1 4 4 SER HA H 4 4.317 4.317 4.393 -0.076 25881
2049 1 9 . 1 1 4 4 SER C C 4 174.010 174.010 174.898 -0.888 25881
2050 1 9 . 1 1 4 4 SER CA C 4 58.177 58.177 59.409 -1.232 25881
2051 1 9 . 1 1 4 4 SER CB C 4 63.763 63.763 63.798 -0.035 25881
2052 1 9 . 1 1 4 4 SER H H 4 8.298 8.298 8.025 0.273 25881
2053 1 9 . 1 1 5 5 ALA N N 5 126.016 126.016 124.126 1.890 25881
2054 1 9 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.328 -0.159 25881
2055 1 9 . 1 1 5 5 ALA C C 5 177.297 177.297 176.811 0.486 25881
2056 1 9 . 1 1 5 5 ALA CA C 5 52.384 52.384 52.162 0.222 25881
2057 1 9 . 1 1 5 5 ALA CB C 5 19.106 19.106 19.551 -0.445 25881
2058 1 9 . 1 1 5 5 ALA H H 5 8.119 8.119 7.927 0.192 25881
2059 1 9 . 1 1 6 6 VAL N N 6 119.174 119.174 118.675 0.499 25881
2060 1 9 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.351 -0.403 25881
2061 1 9 . 1 1 6 6 VAL C C 6 175.743 175.743 175.134 0.609 25881
2062 1 9 . 1 1 6 6 VAL CA C 6 61.668 61.668 59.869 1.799 25881
2063 1 9 . 1 1 6 6 VAL CB C 6 32.841 32.841 34.231 -1.390 25881
2064 1 9 . 1 1 6 6 VAL H H 6 7.861 7.861 7.626 0.235 25881
2065 1 9 . 1 1 7 7 LYS N N 7 123.999 123.999 119.992 4.007 25881
2066 1 9 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.787 -0.620 25881
2067 1 9 . 1 1 7 7 LYS C C 7 175.665 175.665 175.457 0.208 25881
2068 1 9 . 1 1 7 7 LYS CA C 7 55.290 55.290 53.703 1.587 25881
2069 1 9 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.804 -0.264 25881
2070 1 9 . 1 1 7 7 LYS H H 7 8.054 8.054 8.137 -0.083 25881
2071 1 9 . 1 1 8 8 CYS N N 8 121.428 121.428 124.756 -3.328 25881
2072 1 9 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.420 -0.777 25881
2073 1 9 . 1 1 8 8 CYS C C 8 177.383 177.383 176.855 0.528 25881
2074 1 9 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.847 -0.081 25881
2075 1 9 . 1 1 8 8 CYS CB C 8 30.909 30.909 27.073 3.836 25881
2076 1 9 . 1 1 8 8 CYS H H 8 8.539 8.539 8.773 -0.234 25881
2077 1 9 . 1 1 9 9 GLY N N 9 118.862 118.862 117.499 1.363 25881
2078 1 9 . 1 1 9 9 GLY C C 9 172.770 172.770 174.560 -1.790 25881
2079 1 9 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.864 0.280 25881
2080 1 9 . 1 1 9 9 GLY H H 9 9.365 9.365 9.162 0.203 25881
2081 1 9 . 1 1 10 10 ILE N N 10 122.885 122.885 120.061 2.824 25881
2082 1 9 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.304 -0.322 25881
2083 1 9 . 1 1 10 10 ILE C C 10 175.980 175.980 176.435 -0.455 25881
2084 1 9 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.674 0.382 25881
2085 1 9 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.207 -1.263 25881
2086 1 9 . 1 1 10 10 ILE H H 10 8.972 8.972 7.556 1.416 25881
2087 1 9 . 1 1 11 11 CYS N N 11 118.245 118.245 114.314 3.931 25881
2088 1 9 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.863 -0.214 25881
2089 1 9 . 1 1 11 11 CYS C C 11 176.780 176.780 175.092 1.688 25881
2090 1 9 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.958 1.136 25881
2091 1 9 . 1 1 11 11 CYS CB C 11 31.972 31.972 30.730 1.242 25881
2092 1 9 . 1 1 11 11 CYS H H 11 8.466 8.466 7.782 0.684 25881
2093 1 9 . 1 1 12 12 ARG N N 12 116.067 116.067 120.535 -4.468 25881
2094 1 9 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.116 0.100 25881
2095 1 9 . 1 1 12 12 ARG C C 12 175.637 175.637 176.376 -0.739 25881
2096 1 9 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.493 1.467 25881
2097 1 9 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.625 0.479 25881
2098 1 9 . 1 1 12 12 ARG H H 12 7.255 7.255 8.615 -1.360 25881
2099 1 9 . 1 1 13 13 GLY N N 13 109.951 109.951 107.366 2.585 25881
2100 1 9 . 1 1 13 13 GLY C C 13 173.169 173.169 173.852 -0.683 25881
2101 1 9 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.919 -1.615 25881
2102 1 9 . 1 1 13 13 GLY H H 13 8.795 8.795 8.105 0.690 25881
2103 1 9 . 1 1 14 14 VAL N N 14 113.644 113.644 115.290 -1.646 25881
2104 1 9 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.743 -0.699 25881
2105 1 9 . 1 1 14 14 VAL C C 14 174.970 174.970 174.308 0.662 25881
2106 1 9 . 1 1 14 14 VAL CA C 14 61.231 61.231 59.065 2.167 25881
2107 1 9 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.962 -0.124 25881
2108 1 9 . 1 1 14 14 VAL H H 14 7.266 7.266 7.762 -0.496 25881
2109 1 9 . 1 1 15 15 ASP N N 15 119.913 119.913 120.669 -0.756 25881
2110 1 9 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.846 -0.615 25881
2111 1 9 . 1 1 15 15 ASP C C 15 176.279 176.279 177.158 -0.879 25881
2112 1 9 . 1 1 15 15 ASP CA C 15 55.023 55.023 55.805 -0.782 25881
2113 1 9 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.982 -1.035 25881
2114 1 9 . 1 1 15 15 ASP H H 15 8.223 8.223 8.456 -0.233 25881
2115 1 9 . 1 1 16 16 GLY N N 16 109.534 109.534 107.805 1.729 25881
2116 1 9 . 1 1 16 16 GLY C C 16 173.120 173.120 174.741 -1.621 25881
2117 1 9 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.530 1.566 25881
2118 1 9 . 1 1 16 16 GLY H H 16 8.617 8.617 8.257 0.360 25881
2119 1 9 . 1 1 17 17 LYS N N 17 121.534 121.534 123.325 -1.791 25881
2120 1 9 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.075 -0.430 25881
2121 1 9 . 1 1 17 17 LYS C C 17 175.029 175.029 176.911 -1.882 25881
2122 1 9 . 1 1 17 17 LYS CA C 17 57.511 57.511 57.846 -0.335 25881
2123 1 9 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.676 0.468 25881
2124 1 9 . 1 1 17 17 LYS H H 17 7.318 7.318 7.847 -0.529 25881
2125 1 9 . 1 1 18 18 TYR N N 18 119.391 119.391 120.425 -1.034 25881
2126 1 9 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.689 -0.237 25881
2127 1 9 . 1 1 18 18 TYR C C 18 174.241 174.241 174.432 -0.191 25881
2128 1 9 . 1 1 18 18 TYR CA C 18 55.548 55.548 57.461 -1.913 25881
2129 1 9 . 1 1 18 18 TYR CB C 18 38.496 38.496 41.238 -2.742 25881
2130 1 9 . 1 1 18 18 TYR H H 18 7.661 7.661 8.303 -0.642 25881
2131 1 9 . 1 1 19 19 LYS N N 19 120.140 120.140 121.694 -1.554 25881
2132 1 9 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.573 0.368 25881
2133 1 9 . 1 1 19 19 LYS C C 19 176.321 176.321 174.463 1.858 25881
2134 1 9 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.237 0.327 25881
2135 1 9 . 1 1 19 19 LYS CB C 19 36.018 36.018 36.248 -0.230 25881
2136 1 9 . 1 1 19 19 LYS H H 19 8.395 8.395 8.425 -0.030 25881
2137 1 9 . 1 1 20 20 CYS N N 20 131.127 131.127 124.110 7.017 25881
2138 1 9 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.047 -0.116 25881
2139 1 9 . 1 1 20 20 CYS C C 20 176.321 176.321 173.952 2.369 25881
2140 1 9 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.568 1.724 25881
2141 1 9 . 1 1 20 20 CYS CB C 20 30.866 30.866 27.208 3.658 25881
2142 1 9 . 1 1 20 20 CYS H H 20 9.391 9.391 8.649 0.742 25881
2143 1 9 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.413 -0.013 25881
2144 1 9 . 1 1 21 21 PRO C C 21 176.764 176.764 176.505 0.259 25881
2145 1 9 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.407 0.028 25881
2146 1 9 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.551 0.774 25881
2147 1 9 . 1 1 22 22 LYS N N 22 120.217 120.217 117.083 3.134 25881
2148 1 9 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.500 -0.302 25881
2149 1 9 . 1 1 22 22 LYS C C 22 176.798 176.798 178.361 -1.563 25881
2150 1 9 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.603 0.024 25881
2151 1 9 . 1 1 22 22 LYS CB C 22 33.262 33.262 33.033 0.229 25881
2152 1 9 . 1 1 22 22 LYS H H 22 8.550 8.550 8.015 0.535 25881
2153 1 9 . 1 1 23 23 CYS N N 23 115.450 115.450 113.841 1.609 25881
2154 1 9 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.793 0.194 25881
2155 1 9 . 1 1 23 23 CYS C C 23 176.434 176.434 175.929 0.505 25881
2156 1 9 . 1 1 23 23 CYS CA C 23 58.155 58.155 57.823 0.332 25881
2157 1 9 . 1 1 23 23 CYS CB C 23 32.482 32.482 29.267 3.215 25881
2158 1 9 . 1 1 23 23 CYS H H 23 7.886 7.886 8.012 -0.126 25881
2159 1 9 . 1 1 24 24 GLY N N 24 112.961 112.961 109.802 3.159 25881
2160 1 9 . 1 1 24 24 GLY C C 24 173.369 173.369 174.586 -1.217 25881
2161 1 9 . 1 1 24 24 GLY CA C 24 46.152 46.152 45.105 1.047 25881
2162 1 9 . 1 1 24 24 GLY H H 24 7.958 7.958 8.381 -0.423 25881
2163 1 9 . 1 1 25 25 VAL N N 25 123.968 123.968 120.821 3.147 25881
2164 1 9 . 1 1 25 25 VAL HA H 25 3.979 3.979 3.994 -0.015 25881
2165 1 9 . 1 1 25 25 VAL C C 25 173.934 173.934 174.011 -0.077 25881
2166 1 9 . 1 1 25 25 VAL CA C 25 63.136 63.136 61.566 1.570 25881
2167 1 9 . 1 1 25 25 VAL CB C 25 31.959 31.959 32.759 -0.800 25881
2168 1 9 . 1 1 25 25 VAL H H 25 8.348 8.348 7.083 1.265 25881
2169 1 9 . 1 1 26 26 ARG N N 26 125.641 125.641 125.746 -0.105 25881
2170 1 9 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.647 0.613 25881
2171 1 9 . 1 1 26 26 ARG C C 26 177.008 177.008 175.440 1.568 25881
2172 1 9 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.600 -0.272 25881
2173 1 9 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.125 -1.802 25881
2174 1 9 . 1 1 26 26 ARG H H 26 8.379 8.379 8.387 -0.008 25881
2175 1 9 . 1 1 27 27 TYR N N 27 117.706 117.706 119.388 -1.682 25881
2176 1 9 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.055 1.638 25881
2177 1 9 . 1 1 27 27 TYR C C 27 175.404 175.404 176.639 -1.235 25881
2178 1 9 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.218 1.258 25881
2179 1 9 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.576 2.327 25881
2180 1 9 . 1 1 27 27 TYR H H 27 8.631 8.631 7.989 0.642 25881
2181 1 9 . 1 1 28 28 CYS N N 28 118.515 118.515 115.604 2.911 25881
2182 1 9 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.964 -0.059 25881
2183 1 9 . 1 1 28 28 CYS C C 28 176.186 176.186 175.027 1.159 25881
2184 1 9 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.651 -0.037 25881
2185 1 9 . 1 1 28 28 CYS CB C 28 34.827 34.827 28.030 6.797 25881
2186 1 9 . 1 1 28 28 CYS H H 28 8.817 8.817 8.392 0.425 25881
2187 1 9 . 1 1 29 29 SER N N 29 114.067 114.067 111.881 2.186 25881
2188 1 9 . 1 1 29 29 SER HA H 29 4.877 4.877 4.250 0.627 25881
2189 1 9 . 1 1 29 29 SER C C 29 178.077 178.077 173.433 4.644 25881
2190 1 9 . 1 1 29 29 SER CA C 29 57.260 57.260 57.365 -0.105 25881
2191 1 9 . 1 1 29 29 SER CB C 29 65.051 65.051 64.475 0.576 25881
2192 1 9 . 1 1 29 29 SER H H 29 7.400 7.400 7.436 -0.036 25881
2193 1 9 . 1 1 30 30 LEU HA H 30 4.039 4.039 4.151 -0.112 25881
2194 1 9 . 1 1 30 30 LEU C C 30 178.077 178.077 177.294 0.783 25881
2195 1 9 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.281 0.170 25881
2196 1 9 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.584 -0.355 25881
2197 1 9 . 1 1 30 30 LEU H H 30 6.951 6.951 8.272 -1.321 25881
2198 1 9 . 1 1 31 31 LYS N N 31 118.534 118.534 117.429 1.105 25881
2199 1 9 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.013 -0.223 25881
2200 1 9 . 1 1 31 31 LYS C C 31 179.162 179.162 177.454 1.708 25881
2201 1 9 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.800 1.067 25881
2202 1 9 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.423 0.484 25881
2203 1 9 . 1 1 31 31 LYS H H 31 8.030 8.030 8.386 -0.356 25881
2204 1 9 . 1 1 32 32 CYS N N 32 118.700 118.700 116.252 2.448 25881
2205 1 9 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.711 -0.726 25881
2206 1 9 . 1 1 32 32 CYS C C 32 176.766 176.766 176.361 0.405 25881
2207 1 9 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.363 6.316 25881
2208 1 9 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.927 1.622 25881
2209 1 9 . 1 1 32 32 CYS H H 32 7.424 7.424 7.594 -0.170 25881
2210 1 9 . 1 1 33 33 TYR N N 33 118.151 118.151 123.140 -4.989 25881
2211 1 9 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.463 -0.353 25881
2212 1 9 . 1 1 33 33 TYR C C 33 178.549 178.549 176.563 1.986 25881
2213 1 9 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.803 2.384 25881
2214 1 9 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.761 1.085 25881
2215 1 9 . 1 1 33 33 TYR H H 33 7.918 7.918 7.705 0.213 25881
2216 1 9 . 1 1 34 34 LYS N N 34 114.631 114.631 118.683 -4.052 25881
2217 1 9 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.202 -0.280 25881
2218 1 9 . 1 1 34 34 LYS C C 34 174.991 174.991 175.236 -0.245 25881
2219 1 9 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.572 0.380 25881
2220 1 9 . 1 1 34 34 LYS CB C 34 32.145 32.145 30.903 1.242 25881
2221 1 9 . 1 1 34 34 LYS H H 34 7.939 7.939 7.663 0.276 25881
2222 1 9 . 1 1 35 35 ASP N N 35 121.194 121.194 120.039 1.155 25881
2223 1 9 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.737 -0.443 25881
2224 1 9 . 1 1 35 35 ASP C C 35 175.480 175.480 174.940 0.540 25881
2225 1 9 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.112 1.227 25881
2226 1 9 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.061 -2.700 25881
2227 1 9 . 1 1 35 35 ASP H H 35 7.115 7.115 7.856 -0.741 25881
2228 1 9 . 1 1 36 36 ALA N N 36 130.311 130.311 125.669 4.642 25881
2229 1 9 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.965 -1.078 25881
2230 1 9 . 1 1 36 36 ALA C C 36 177.717 177.717 176.879 0.838 25881
2231 1 9 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.837 1.689 25881
2232 1 9 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.464 -0.753 25881
2233 1 9 . 1 1 36 36 ALA H H 36 8.073 8.073 8.445 -0.372 25881
2234 1 9 . 1 1 37 37 ALA N N 37 117.133 117.133 122.889 -5.756 25881
2235 1 9 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.307 -0.221 25881
2236 1 9 . 1 1 37 37 ALA C C 37 178.989 178.989 178.773 0.216 25881
2237 1 9 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.925 -0.715 25881
2238 1 9 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.045 -0.898 25881
2239 1 9 . 1 1 37 37 ALA H H 37 7.839 7.839 8.534 -0.695 25881
2240 1 9 . 1 1 38 38 LYS N N 38 114.127 114.127 115.922 -1.795 25881
2241 1 9 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.489 -0.194 25881
2242 1 9 . 1 1 38 38 LYS C C 38 175.690 175.690 176.761 -1.071 25881
2243 1 9 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.799 -0.596 25881
2244 1 9 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.456 1.692 25881
2245 1 9 . 1 1 38 38 LYS H H 38 7.292 7.292 9.139 -1.847 25881
2246 1 9 . 1 1 39 39 HIS N N 39 122.110 122.110 122.203 -0.093 25881
2247 1 9 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.559 0.204 25881
2248 1 9 . 1 1 39 39 HIS C C 39 171.783 171.783 173.289 -1.506 25881
2249 1 9 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.845 -3.210 25881
2250 1 9 . 1 1 39 39 HIS CB C 39 27.629 27.629 30.045 -2.416 25881
2251 1 9 . 1 1 39 39 HIS H H 39 8.393 8.393 8.045 0.348 25881
2252 1 9 . 1 1 40 40 VAL N N 40 123.393 123.393 127.485 -4.092 25881
2253 1 9 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.335 -0.588 25881
2254 1 9 . 1 1 40 40 VAL C C 40 175.292 175.292 175.034 0.258 25881
2255 1 9 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.429 -0.265 25881
2256 1 9 . 1 1 40 40 VAL CB C 40 34.132 34.132 34.832 -0.700 25881
2257 1 9 . 1 1 40 40 VAL H H 40 7.811 7.811 8.516 -0.705 25881
2258 1 9 . 1 1 41 41 HIS N N 41 125.669 125.669 126.802 -1.133 25881
2259 1 9 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.767 0.111 25881
2260 1 9 . 1 1 41 41 HIS C C 41 174.640 174.640 175.350 -0.710 25881
2261 1 9 . 1 1 41 41 HIS CA C 41 52.900 52.900 55.545 -2.645 25881
2262 1 9 . 1 1 41 41 HIS CB C 41 30.067 30.067 30.130 -0.063 25881
2263 1 9 . 1 1 41 41 HIS H H 41 8.512 8.512 8.563 -0.051 25881
2264 1 9 . 1 1 42 42 LYS N N 42 123.564 123.564 125.637 -2.073 25881
2265 1 9 . 1 1 42 42 LYS C C 42 176.739 176.739 176.221 0.518 25881
2266 1 9 . 1 1 42 42 LYS CA C 42 56.320 56.320 55.411 0.909 25881
2267 1 9 . 1 1 42 42 LYS CB C 42 33.229 33.229 33.202 0.027 25881
2268 1 9 . 1 1 42 42 LYS H H 42 8.668 8.668 8.526 0.142 25881
2269 1 9 . 1 1 43 43 GLU N N 43 122.633 122.633 120.387 2.246 25881
2270 1 9 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.194 -0.084 25881
2271 1 9 . 1 1 43 43 GLU C C 43 176.569 176.569 175.778 0.791 25881
2272 1 9 . 1 1 43 43 GLU CA C 43 57.097 57.097 56.974 0.123 25881
2273 1 9 . 1 1 43 43 GLU CB C 43 29.948 29.948 28.903 1.045 25881
2274 1 9 . 1 1 43 43 GLU H H 43 8.590 8.590 8.545 0.045 25881
2275 1 9 . 1 1 44 44 SER N N 44 115.147 115.147 118.860 -3.713 25881
2276 1 9 . 1 1 44 44 SER HA H 44 4.268 4.268 4.468 -0.200 25881
2277 1 9 . 1 1 44 44 SER C C 44 174.336 174.336 175.330 -0.994 25881
2278 1 9 . 1 1 44 44 SER CA C 44 58.348 58.348 59.163 -0.814 25881
2279 1 9 . 1 1 44 44 SER CB C 44 63.724 63.724 63.978 -0.254 25881
2280 1 9 . 1 1 44 44 SER H H 44 8.105 8.105 8.142 -0.037 25881
2281 1 9 . 1 1 45 45 GLU N N 45 122.849 122.849 122.309 0.540 25881
2282 1 9 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.373 -0.210 25881
2283 1 9 . 1 1 45 45 GLU C C 45 175.304 175.304 176.001 -0.697 25881
2284 1 9 . 1 1 45 45 GLU CA C 45 56.412 56.412 56.084 0.328 25881
2285 1 9 . 1 1 45 45 GLU CB C 45 30.130 30.130 27.803 2.327 25881
2286 1 9 . 1 1 45 45 GLU H H 45 8.183 8.183 8.556 -0.373 25881
2287 1 10 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.289 0.004 25881
2288 1 10 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 64.191 -1.189 25881
2289 1 10 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 31.936 0.282 25881
2290 1 10 . 1 1 1 1 MET HA H 1 3.967 3.967 4.651 -0.684 25881
2291 1 10 . 1 1 1 1 MET CA C 1 57.335 57.335 54.356 2.979 25881
2292 1 10 . 1 1 1 1 MET CB C 1 34.180 34.180 34.552 -0.372 25881
2293 1 10 . 1 1 2 2 VAL C C 2 175.654 175.654 176.395 -0.741 25881
2294 1 10 . 1 1 2 2 VAL CA C 2 55.183 55.183 62.623 -7.440 25881
2295 1 10 . 1 1 2 2 VAL CB C 2 33.173 33.173 32.196 0.977 25881
2296 1 10 . 1 1 3 3 SER N N 3 121.996 121.996 115.517 6.479 25881
2297 1 10 . 1 1 3 3 SER HA H 3 4.323 4.323 4.528 -0.205 25881
2298 1 10 . 1 1 3 3 SER C C 3 176.021 176.021 173.717 2.304 25881
2299 1 10 . 1 1 3 3 SER CA C 3 62.208 62.208 58.489 3.719 25881
2300 1 10 . 1 1 3 3 SER H H 3 8.103 8.103 7.841 0.262 25881
2301 1 10 . 1 1 4 4 SER N N 4 119.715 119.715 114.663 5.052 25881
2302 1 10 . 1 1 4 4 SER HA H 4 4.317 4.317 4.220 0.097 25881
2303 1 10 . 1 1 4 4 SER C C 4 174.010 174.010 173.156 0.854 25881
2304 1 10 . 1 1 4 4 SER CA C 4 58.177 58.177 59.079 -0.902 25881
2305 1 10 . 1 1 4 4 SER CB C 4 63.763 63.763 61.725 2.038 25881
2306 1 10 . 1 1 4 4 SER H H 4 8.298 8.298 8.532 -0.234 25881
2307 1 10 . 1 1 5 5 ALA N N 5 126.016 126.016 122.458 3.558 25881
2308 1 10 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.642 -0.473 25881
2309 1 10 . 1 1 5 5 ALA C C 5 177.297 177.297 175.903 1.394 25881
2310 1 10 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.440 0.944 25881
2311 1 10 . 1 1 5 5 ALA CB C 5 19.106 19.106 21.251 -2.145 25881
2312 1 10 . 1 1 5 5 ALA H H 5 8.119 8.119 7.862 0.257 25881
2313 1 10 . 1 1 6 6 VAL N N 6 119.174 119.174 120.405 -1.231 25881
2314 1 10 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.382 -0.434 25881
2315 1 10 . 1 1 6 6 VAL C C 6 175.743 175.743 174.612 1.131 25881
2316 1 10 . 1 1 6 6 VAL CA C 6 61.668 61.668 61.112 0.555 25881
2317 1 10 . 1 1 6 6 VAL CB C 6 32.841 32.841 35.074 -2.233 25881
2318 1 10 . 1 1 6 6 VAL H H 6 7.861 7.861 8.186 -0.325 25881
2319 1 10 . 1 1 7 7 LYS N N 7 123.999 123.999 124.829 -0.830 25881
2320 1 10 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.664 -0.497 25881
2321 1 10 . 1 1 7 7 LYS C C 7 175.665 175.665 176.043 -0.378 25881
2322 1 10 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.023 1.267 25881
2323 1 10 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.355 0.186 25881
2324 1 10 . 1 1 7 7 LYS H H 7 8.054 8.054 8.308 -0.254 25881
2325 1 10 . 1 1 8 8 CYS N N 8 121.428 121.428 122.713 -1.285 25881
2326 1 10 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.429 -0.786 25881
2327 1 10 . 1 1 8 8 CYS C C 8 177.383 177.383 176.380 1.003 25881
2328 1 10 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.565 0.201 25881
2329 1 10 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.590 4.319 25881
2330 1 10 . 1 1 8 8 CYS H H 8 8.539 8.539 8.827 -0.288 25881
2331 1 10 . 1 1 9 9 GLY N N 9 118.862 118.862 116.787 2.075 25881
2332 1 10 . 1 1 9 9 GLY C C 9 172.770 172.770 174.280 -1.510 25881
2333 1 10 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.508 0.636 25881
2334 1 10 . 1 1 9 9 GLY H H 9 9.365 9.365 9.016 0.349 25881
2335 1 10 . 1 1 10 10 ILE N N 10 122.885 122.885 117.825 5.060 25881
2336 1 10 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.336 -0.354 25881
2337 1 10 . 1 1 10 10 ILE C C 10 175.980 175.980 174.974 1.006 25881
2338 1 10 . 1 1 10 10 ILE CA C 10 63.056 63.056 61.911 1.145 25881
2339 1 10 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.550 -1.606 25881
2340 1 10 . 1 1 10 10 ILE H H 10 8.972 8.972 7.303 1.669 25881
2341 1 10 . 1 1 11 11 CYS N N 11 118.245 118.245 113.649 4.596 25881
2342 1 10 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.906 -0.257 25881
2343 1 10 . 1 1 11 11 CYS C C 11 176.780 176.780 175.215 1.565 25881
2344 1 10 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.873 1.221 25881
2345 1 10 . 1 1 11 11 CYS CB C 11 31.972 31.972 30.354 1.618 25881
2346 1 10 . 1 1 11 11 CYS H H 11 8.466 8.466 7.674 0.792 25881
2347 1 10 . 1 1 12 12 ARG N N 12 116.067 116.067 119.621 -3.554 25881
2348 1 10 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.136 0.080 25881
2349 1 10 . 1 1 12 12 ARG C C 12 175.637 175.637 176.134 -0.497 25881
2350 1 10 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.904 1.056 25881
2351 1 10 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.805 0.299 25881
2352 1 10 . 1 1 12 12 ARG H H 12 7.255 7.255 8.560 -1.305 25881
2353 1 10 . 1 1 13 13 GLY N N 13 109.951 109.951 105.664 4.287 25881
2354 1 10 . 1 1 13 13 GLY C C 13 173.169 173.169 173.689 -0.520 25881
2355 1 10 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.772 -1.468 25881
2356 1 10 . 1 1 13 13 GLY H H 13 8.795 8.795 7.910 0.885 25881
2357 1 10 . 1 1 14 14 VAL N N 14 113.644 113.644 116.281 -2.637 25881
2358 1 10 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.728 -0.684 25881
2359 1 10 . 1 1 14 14 VAL C C 14 174.970 174.970 174.506 0.464 25881
2360 1 10 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.918 2.313 25881
2361 1 10 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.325 0.513 25881
2362 1 10 . 1 1 14 14 VAL H H 14 7.266 7.266 7.845 -0.579 25881
2363 1 10 . 1 1 15 15 ASP N N 15 119.913 119.913 118.464 1.449 25881
2364 1 10 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.655 -0.424 25881
2365 1 10 . 1 1 15 15 ASP C C 15 176.279 176.279 176.735 -0.456 25881
2366 1 10 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.704 0.319 25881
2367 1 10 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.736 -0.789 25881
2368 1 10 . 1 1 15 15 ASP H H 15 8.223 8.223 8.380 -0.157 25881
2369 1 10 . 1 1 16 16 GLY N N 16 109.534 109.534 107.268 2.266 25881
2370 1 10 . 1 1 16 16 GLY C C 16 173.120 173.120 175.012 -1.892 25881
2371 1 10 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.138 1.958 25881
2372 1 10 . 1 1 16 16 GLY H H 16 8.617 8.617 8.871 -0.254 25881
2373 1 10 . 1 1 17 17 LYS N N 17 121.534 121.534 122.881 -1.347 25881
2374 1 10 . 1 1 17 17 LYS HA H 17 3.645 3.645 3.981 -0.336 25881
2375 1 10 . 1 1 17 17 LYS C C 17 175.029 175.029 177.166 -2.137 25881
2376 1 10 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.596 -1.085 25881
2377 1 10 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.616 0.528 25881
2378 1 10 . 1 1 17 17 LYS H H 17 7.318 7.318 7.781 -0.463 25881
2379 1 10 . 1 1 18 18 TYR N N 18 119.391 119.391 120.035 -0.644 25881
2380 1 10 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.623 -0.171 25881
2381 1 10 . 1 1 18 18 TYR C C 18 174.241 174.241 174.782 -0.541 25881
2382 1 10 . 1 1 18 18 TYR CA C 18 55.548 55.548 57.585 -2.037 25881
2383 1 10 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.656 -2.160 25881
2384 1 10 . 1 1 18 18 TYR H H 18 7.661 7.661 8.107 -0.446 25881
2385 1 10 . 1 1 19 19 LYS N N 19 120.140 120.140 121.723 -1.583 25881
2386 1 10 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.524 0.417 25881
2387 1 10 . 1 1 19 19 LYS C C 19 176.321 176.321 174.395 1.926 25881
2388 1 10 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.087 0.477 25881
2389 1 10 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.862 0.156 25881
2390 1 10 . 1 1 19 19 LYS H H 19 8.395 8.395 8.216 0.179 25881
2391 1 10 . 1 1 20 20 CYS N N 20 131.127 131.127 124.745 6.382 25881
2392 1 10 . 1 1 20 20 CYS HA H 20 4.931 4.931 4.966 -0.035 25881
2393 1 10 . 1 1 20 20 CYS C C 20 176.321 176.321 174.228 2.093 25881
2394 1 10 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.667 1.625 25881
2395 1 10 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.631 4.235 25881
2396 1 10 . 1 1 20 20 CYS H H 20 9.391 9.391 8.569 0.822 25881
2397 1 10 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.358 0.042 25881
2398 1 10 . 1 1 21 21 PRO C C 21 176.764 176.764 176.843 -0.079 25881
2399 1 10 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.569 -0.134 25881
2400 1 10 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.616 0.709 25881
2401 1 10 . 1 1 22 22 LYS N N 22 120.217 120.217 119.062 1.155 25881
2402 1 10 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.279 -0.081 25881
2403 1 10 . 1 1 22 22 LYS C C 22 176.798 176.798 177.827 -1.029 25881
2404 1 10 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.585 0.042 25881
2405 1 10 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.171 1.091 25881
2406 1 10 . 1 1 22 22 LYS H H 22 8.550 8.550 8.557 -0.007 25881
2407 1 10 . 1 1 23 23 CYS N N 23 115.450 115.450 114.191 1.259 25881
2408 1 10 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.723 0.264 25881
2409 1 10 . 1 1 23 23 CYS C C 23 176.434 176.434 175.922 0.512 25881
2410 1 10 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.039 0.116 25881
2411 1 10 . 1 1 23 23 CYS CB C 23 32.482 32.482 30.304 2.178 25881
2412 1 10 . 1 1 23 23 CYS H H 23 7.886 7.886 8.227 -0.341 25881
2413 1 10 . 1 1 24 24 GLY N N 24 112.961 112.961 110.117 2.844 25881
2414 1 10 . 1 1 24 24 GLY C C 24 173.369 173.369 174.016 -0.647 25881
2415 1 10 . 1 1 24 24 GLY CA C 24 46.152 46.152 44.608 1.544 25881
2416 1 10 . 1 1 24 24 GLY H H 24 7.958 7.958 8.104 -0.146 25881
2417 1 10 . 1 1 25 25 VAL N N 25 123.968 123.968 118.970 4.998 25881
2418 1 10 . 1 1 25 25 VAL HA H 25 3.979 3.979 3.999 -0.020 25881
2419 1 10 . 1 1 25 25 VAL C C 25 173.934 173.934 174.274 -0.340 25881
2420 1 10 . 1 1 25 25 VAL CA C 25 63.136 63.136 61.050 2.086 25881
2421 1 10 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.253 -1.294 25881
2422 1 10 . 1 1 25 25 VAL H H 25 8.348 8.348 7.334 1.014 25881
2423 1 10 . 1 1 26 26 ARG N N 26 125.641 125.641 124.670 0.971 25881
2424 1 10 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.736 0.524 25881
2425 1 10 . 1 1 26 26 ARG C C 26 177.008 177.008 175.421 1.587 25881
2426 1 10 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.715 -0.387 25881
2427 1 10 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.446 -2.123 25881
2428 1 10 . 1 1 26 26 ARG H H 26 8.379 8.379 8.442 -0.063 25881
2429 1 10 . 1 1 27 27 TYR N N 27 117.706 117.706 118.622 -0.916 25881
2430 1 10 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.095 1.598 25881
2431 1 10 . 1 1 27 27 TYR C C 27 175.404 175.404 176.173 -0.769 25881
2432 1 10 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.166 1.310 25881
2433 1 10 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.844 2.059 25881
2434 1 10 . 1 1 27 27 TYR H H 27 8.631 8.631 8.322 0.309 25881
2435 1 10 . 1 1 28 28 CYS N N 28 118.515 118.515 116.584 1.931 25881
2436 1 10 . 1 1 28 28 CYS HA H 28 4.905 4.905 5.081 -0.176 25881
2437 1 10 . 1 1 28 28 CYS C C 28 176.186 176.186 175.522 0.664 25881
2438 1 10 . 1 1 28 28 CYS CA C 28 58.614 58.614 57.769 0.845 25881
2439 1 10 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.663 7.164 25881
2440 1 10 . 1 1 28 28 CYS H H 28 8.817 8.817 8.405 0.412 25881
2441 1 10 . 1 1 29 29 SER N N 29 114.067 114.067 112.578 1.489 25881
2442 1 10 . 1 1 29 29 SER HA H 29 4.877 4.877 4.193 0.684 25881
2443 1 10 . 1 1 29 29 SER C C 29 178.077 178.077 173.601 4.476 25881
2444 1 10 . 1 1 29 29 SER CA C 29 57.260 57.260 57.087 0.173 25881
2445 1 10 . 1 1 29 29 SER CB C 29 65.051 65.051 63.837 1.214 25881
2446 1 10 . 1 1 29 29 SER H H 29 7.400 7.400 7.379 0.021 25881
2447 1 10 . 1 1 30 30 LEU HA H 30 4.039 4.039 3.964 0.075 25881
2448 1 10 . 1 1 30 30 LEU C C 30 178.077 178.077 178.017 0.060 25881
2449 1 10 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.276 0.175 25881
2450 1 10 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.432 -0.203 25881
2451 1 10 . 1 1 30 30 LEU H H 30 6.951 6.951 8.409 -1.458 25881
2452 1 10 . 1 1 31 31 LYS N N 31 118.534 118.534 118.101 0.433 25881
2453 1 10 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.026 -0.236 25881
2454 1 10 . 1 1 31 31 LYS C C 31 179.162 179.162 177.022 2.140 25881
2455 1 10 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.600 1.267 25881
2456 1 10 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.624 0.283 25881
2457 1 10 . 1 1 31 31 LYS H H 31 8.030 8.030 8.361 -0.331 25881
2458 1 10 . 1 1 32 32 CYS N N 32 118.700 118.700 115.204 3.496 25881
2459 1 10 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.651 -0.666 25881
2460 1 10 . 1 1 32 32 CYS C C 32 176.766 176.766 176.626 0.140 25881
2461 1 10 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.153 6.526 25881
2462 1 10 . 1 1 32 32 CYS CB C 32 29.549 29.549 28.195 1.354 25881
2463 1 10 . 1 1 32 32 CYS H H 32 7.424 7.424 7.496 -0.072 25881
2464 1 10 . 1 1 33 33 TYR N N 33 118.151 118.151 123.646 -5.495 25881
2465 1 10 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.169 -0.059 25881
2466 1 10 . 1 1 33 33 TYR C C 33 178.549 178.549 175.606 2.943 25881
2467 1 10 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.564 2.623 25881
2468 1 10 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.845 1.001 25881
2469 1 10 . 1 1 33 33 TYR H H 33 7.918 7.918 7.939 -0.021 25881
2470 1 10 . 1 1 34 34 LYS N N 34 114.631 114.631 117.877 -3.246 25881
2471 1 10 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.257 -0.335 25881
2472 1 10 . 1 1 34 34 LYS C C 34 174.991 174.991 175.495 -0.504 25881
2473 1 10 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.649 0.302 25881
2474 1 10 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.015 1.130 25881
2475 1 10 . 1 1 34 34 LYS H H 34 7.939 7.939 7.574 0.365 25881
2476 1 10 . 1 1 35 35 ASP N N 35 121.194 121.194 120.458 0.736 25881
2477 1 10 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.694 -0.400 25881
2478 1 10 . 1 1 35 35 ASP C C 35 175.480 175.480 175.039 0.441 25881
2479 1 10 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.240 1.099 25881
2480 1 10 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.794 -3.433 25881
2481 1 10 . 1 1 35 35 ASP H H 35 7.115 7.115 7.968 -0.853 25881
2482 1 10 . 1 1 36 36 ALA N N 36 130.311 130.311 125.768 4.543 25881
2483 1 10 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.938 -1.051 25881
2484 1 10 . 1 1 36 36 ALA C C 36 177.717 177.717 176.679 1.038 25881
2485 1 10 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.816 1.710 25881
2486 1 10 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.347 -0.636 25881
2487 1 10 . 1 1 36 36 ALA H H 36 8.073 8.073 8.567 -0.494 25881
2488 1 10 . 1 1 37 37 ALA N N 37 117.133 117.133 122.790 -5.657 25881
2489 1 10 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.362 -0.276 25881
2490 1 10 . 1 1 37 37 ALA C C 37 178.989 178.989 178.600 0.389 25881
2491 1 10 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.750 -0.539 25881
2492 1 10 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.237 -1.090 25881
2493 1 10 . 1 1 37 37 ALA H H 37 7.839 7.839 8.669 -0.830 25881
2494 1 10 . 1 1 38 38 LYS N N 38 114.127 114.127 115.484 -1.357 25881
2495 1 10 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.518 -0.223 25881
2496 1 10 . 1 1 38 38 LYS C C 38 175.690 175.690 176.705 -1.015 25881
2497 1 10 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.628 -0.425 25881
2498 1 10 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.862 1.286 25881
2499 1 10 . 1 1 38 38 LYS H H 38 7.292 7.292 9.204 -1.912 25881
2500 1 10 . 1 1 39 39 HIS N N 39 122.110 122.110 122.795 -0.685 25881
2501 1 10 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.511 0.252 25881
2502 1 10 . 1 1 39 39 HIS C C 39 171.783 171.783 173.234 -1.451 25881
2503 1 10 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.782 -3.147 25881
2504 1 10 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.617 -1.988 25881
2505 1 10 . 1 1 39 39 HIS H H 39 8.393 8.393 8.433 -0.040 25881
2506 1 10 . 1 1 40 40 VAL N N 40 123.393 123.393 126.606 -3.213 25881
2507 1 10 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.248 -0.501 25881
2508 1 10 . 1 1 40 40 VAL C C 40 175.292 175.292 175.122 0.170 25881
2509 1 10 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.482 -0.318 25881
2510 1 10 . 1 1 40 40 VAL CB C 40 34.132 34.132 34.550 -0.418 25881
2511 1 10 . 1 1 40 40 VAL H H 40 7.811 7.811 7.817 -0.006 25881
2512 1 10 . 1 1 41 41 HIS N N 41 125.669 125.669 126.420 -0.751 25881
2513 1 10 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.688 0.190 25881
2514 1 10 . 1 1 41 41 HIS C C 41 174.640 174.640 174.218 0.422 25881
2515 1 10 . 1 1 41 41 HIS CA C 41 52.900 52.900 55.404 -2.504 25881
2516 1 10 . 1 1 41 41 HIS CB C 41 30.067 30.067 29.676 0.391 25881
2517 1 10 . 1 1 41 41 HIS H H 41 8.512 8.512 8.842 -0.330 25881
2518 1 10 . 1 1 42 42 LYS N N 42 123.564 123.564 122.050 1.514 25881
2519 1 10 . 1 1 42 42 LYS C C 42 176.739 176.739 175.838 0.901 25881
2520 1 10 . 1 1 42 42 LYS CA C 42 56.320 56.320 56.253 0.067 25881
2521 1 10 . 1 1 42 42 LYS CB C 42 33.229 33.229 33.072 0.157 25881
2522 1 10 . 1 1 42 42 LYS H H 42 8.668 8.668 7.814 0.854 25881
2523 1 10 . 1 1 43 43 GLU N N 43 122.633 122.633 119.858 2.775 25881
2524 1 10 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.078 0.032 25881
2525 1 10 . 1 1 43 43 GLU C C 43 176.569 176.569 174.926 1.643 25881
2526 1 10 . 1 1 43 43 GLU CA C 43 57.097 57.097 57.476 -0.379 25881
2527 1 10 . 1 1 43 43 GLU CB C 43 29.948 29.948 28.894 1.054 25881
2528 1 10 . 1 1 43 43 GLU H H 43 8.590 8.590 8.676 -0.086 25881
2529 1 10 . 1 1 44 44 SER N N 44 115.147 115.147 114.475 0.672 25881
2530 1 10 . 1 1 44 44 SER HA H 44 4.268 4.268 4.643 -0.375 25881
2531 1 10 . 1 1 44 44 SER C C 44 174.336 174.336 175.020 -0.684 25881
2532 1 10 . 1 1 44 44 SER CA C 44 58.348 58.348 57.477 0.871 25881
2533 1 10 . 1 1 44 44 SER CB C 44 63.724 63.724 64.290 -0.566 25881
2534 1 10 . 1 1 44 44 SER H H 44 8.105 8.105 7.665 0.440 25881
2535 1 10 . 1 1 45 45 GLU N N 45 122.849 122.849 120.440 2.409 25881
2536 1 10 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.017 0.146 25881
2537 1 10 . 1 1 45 45 GLU C C 45 175.304 175.304 175.040 0.264 25881
2538 1 10 . 1 1 45 45 GLU CA C 45 56.412 56.412 57.778 -1.366 25881
2539 1 10 . 1 1 45 45 GLU CB C 45 30.130 30.130 28.860 1.270 25881
2540 1 10 . 1 1 45 45 GLU H H 45 8.183 8.183 8.947 -0.764 25881
2541 1 11 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.260 0.033 25881
2542 1 11 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 64.256 -1.254 25881
2543 1 11 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 32.083 0.135 25881
2544 1 11 . 1 1 1 1 MET HA H 1 3.967 3.967 4.351 -0.384 25881
2545 1 11 . 1 1 1 1 MET CA C 1 57.335 57.335 55.326 2.009 25881
2546 1 11 . 1 1 1 1 MET CB C 1 34.180 34.180 32.767 1.413 25881
2547 1 11 . 1 1 2 2 VAL C C 2 175.654 175.654 174.107 1.547 25881
2548 1 11 . 1 1 2 2 VAL CA C 2 55.183 55.183 63.075 -7.892 25881
2549 1 11 . 1 1 2 2 VAL CB C 2 33.173 33.173 31.304 1.869 25881
2550 1 11 . 1 1 3 3 SER N N 3 121.996 121.996 116.260 5.736 25881
2551 1 11 . 1 1 3 3 SER HA H 3 4.323 4.323 4.746 -0.423 25881
2552 1 11 . 1 1 3 3 SER C C 3 176.021 176.021 174.360 1.661 25881
2553 1 11 . 1 1 3 3 SER CA C 3 62.208 62.208 58.549 3.659 25881
2554 1 11 . 1 1 3 3 SER H H 3 8.103 8.103 8.163 -0.060 25881
2555 1 11 . 1 1 4 4 SER N N 4 119.715 119.715 117.292 2.423 25881
2556 1 11 . 1 1 4 4 SER HA H 4 4.317 4.317 4.533 -0.216 25881
2557 1 11 . 1 1 4 4 SER C C 4 174.010 174.010 174.127 -0.117 25881
2558 1 11 . 1 1 4 4 SER CA C 4 58.177 58.177 57.858 0.319 25881
2559 1 11 . 1 1 4 4 SER CB C 4 63.763 63.763 62.953 0.810 25881
2560 1 11 . 1 1 4 4 SER H H 4 8.298 8.298 7.899 0.399 25881
2561 1 11 . 1 1 5 5 ALA N N 5 126.016 126.016 122.828 3.188 25881
2562 1 11 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.124 0.045 25881
2563 1 11 . 1 1 5 5 ALA C C 5 177.297 177.297 175.576 1.721 25881
2564 1 11 . 1 1 5 5 ALA CA C 5 52.384 52.384 52.864 -0.480 25881
2565 1 11 . 1 1 5 5 ALA CB C 5 19.106 19.106 18.216 0.890 25881
2566 1 11 . 1 1 5 5 ALA H H 5 8.119 8.119 7.906 0.213 25881
2567 1 11 . 1 1 6 6 VAL N N 6 119.174 119.174 118.353 0.821 25881
2568 1 11 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.254 -0.306 25881
2569 1 11 . 1 1 6 6 VAL C C 6 175.743 175.743 174.419 1.324 25881
2570 1 11 . 1 1 6 6 VAL CA C 6 61.668 61.668 61.390 0.278 25881
2571 1 11 . 1 1 6 6 VAL CB C 6 32.841 32.841 36.019 -3.178 25881
2572 1 11 . 1 1 6 6 VAL H H 6 7.861 7.861 8.353 -0.492 25881
2573 1 11 . 1 1 7 7 LYS N N 7 123.999 123.999 124.770 -0.771 25881
2574 1 11 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.884 -0.717 25881
2575 1 11 . 1 1 7 7 LYS C C 7 175.665 175.665 176.193 -0.528 25881
2576 1 11 . 1 1 7 7 LYS CA C 7 55.290 55.290 53.668 1.622 25881
2577 1 11 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.170 0.371 25881
2578 1 11 . 1 1 7 7 LYS H H 7 8.054 8.054 8.310 -0.256 25881
2579 1 11 . 1 1 8 8 CYS N N 8 121.428 121.428 122.490 -1.062 25881
2580 1 11 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.408 -0.765 25881
2581 1 11 . 1 1 8 8 CYS C C 8 177.383 177.383 176.210 1.173 25881
2582 1 11 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.728 0.038 25881
2583 1 11 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.736 4.173 25881
2584 1 11 . 1 1 8 8 CYS H H 8 8.539 8.539 8.881 -0.342 25881
2585 1 11 . 1 1 9 9 GLY N N 9 118.862 118.862 116.680 2.182 25881
2586 1 11 . 1 1 9 9 GLY C C 9 172.770 172.770 174.375 -1.605 25881
2587 1 11 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.578 0.566 25881
2588 1 11 . 1 1 9 9 GLY H H 9 9.365 9.365 8.815 0.550 25881
2589 1 11 . 1 1 10 10 ILE N N 10 122.885 122.885 119.063 3.822 25881
2590 1 11 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.213 -0.231 25881
2591 1 11 . 1 1 10 10 ILE C C 10 175.980 175.980 175.977 0.003 25881
2592 1 11 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.600 0.456 25881
2593 1 11 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.205 -1.261 25881
2594 1 11 . 1 1 10 10 ILE H H 10 8.972 8.972 7.344 1.628 25881
2595 1 11 . 1 1 11 11 CYS N N 11 118.245 118.245 114.238 4.007 25881
2596 1 11 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.869 -0.220 25881
2597 1 11 . 1 1 11 11 CYS C C 11 176.780 176.780 175.076 1.704 25881
2598 1 11 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.931 1.163 25881
2599 1 11 . 1 1 11 11 CYS CB C 11 31.972 31.972 30.717 1.255 25881
2600 1 11 . 1 1 11 11 CYS H H 11 8.466 8.466 7.772 0.694 25881
2601 1 11 . 1 1 12 12 ARG N N 12 116.067 116.067 120.352 -4.285 25881
2602 1 11 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.156 0.060 25881
2603 1 11 . 1 1 12 12 ARG C C 12 175.637 175.637 176.362 -0.725 25881
2604 1 11 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.620 1.341 25881
2605 1 11 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.688 0.416 25881
2606 1 11 . 1 1 12 12 ARG H H 12 7.255 7.255 8.452 -1.197 25881
2607 1 11 . 1 1 13 13 GLY N N 13 109.951 109.951 107.791 2.160 25881
2608 1 11 . 1 1 13 13 GLY C C 13 173.169 173.169 173.944 -0.775 25881
2609 1 11 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.866 -1.562 25881
2610 1 11 . 1 1 13 13 GLY H H 13 8.795 8.795 8.131 0.664 25881
2611 1 11 . 1 1 14 14 VAL N N 14 113.644 113.644 116.785 -3.141 25881
2612 1 11 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.707 -0.663 25881
2613 1 11 . 1 1 14 14 VAL C C 14 174.970 174.970 174.593 0.377 25881
2614 1 11 . 1 1 14 14 VAL CA C 14 61.231 61.231 59.203 2.027 25881
2615 1 11 . 1 1 14 14 VAL CB C 14 33.838 33.838 32.932 0.906 25881
2616 1 11 . 1 1 14 14 VAL H H 14 7.266 7.266 8.006 -0.740 25881
2617 1 11 . 1 1 15 15 ASP N N 15 119.913 119.913 120.620 -0.707 25881
2618 1 11 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.761 -0.530 25881
2619 1 11 . 1 1 15 15 ASP C C 15 176.279 176.279 177.313 -1.034 25881
2620 1 11 . 1 1 15 15 ASP CA C 15 55.023 55.023 56.191 -1.168 25881
2621 1 11 . 1 1 15 15 ASP CB C 15 39.947 39.947 41.039 -1.092 25881
2622 1 11 . 1 1 15 15 ASP H H 15 8.223 8.223 8.408 -0.185 25881
2623 1 11 . 1 1 16 16 GLY N N 16 109.534 109.534 109.104 0.430 25881
2624 1 11 . 1 1 16 16 GLY C C 16 173.120 173.120 174.887 -1.767 25881
2625 1 11 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.570 1.526 25881
2626 1 11 . 1 1 16 16 GLY H H 16 8.617 8.617 8.881 -0.264 25881
2627 1 11 . 1 1 17 17 LYS N N 17 121.534 121.534 124.071 -2.537 25881
2628 1 11 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.028 -0.383 25881
2629 1 11 . 1 1 17 17 LYS C C 17 175.029 175.029 177.164 -2.135 25881
2630 1 11 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.461 -0.950 25881
2631 1 11 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.704 0.440 25881
2632 1 11 . 1 1 17 17 LYS H H 17 7.318 7.318 7.838 -0.520 25881
2633 1 11 . 1 1 18 18 TYR N N 18 119.391 119.391 119.839 -0.448 25881
2634 1 11 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.634 -0.182 25881
2635 1 11 . 1 1 18 18 TYR C C 18 174.241 174.241 174.790 -0.549 25881
2636 1 11 . 1 1 18 18 TYR CA C 18 55.548 55.548 57.290 -1.742 25881
2637 1 11 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.692 -2.196 25881
2638 1 11 . 1 1 18 18 TYR H H 18 7.661 7.661 8.020 -0.359 25881
2639 1 11 . 1 1 19 19 LYS N N 19 120.140 120.140 122.570 -2.430 25881
2640 1 11 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.490 0.451 25881
2641 1 11 . 1 1 19 19 LYS C C 19 176.321 176.321 174.470 1.851 25881
2642 1 11 . 1 1 19 19 LYS CA C 19 54.564 54.564 53.932 0.632 25881
2643 1 11 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.305 0.713 25881
2644 1 11 . 1 1 19 19 LYS H H 19 8.395 8.395 8.216 0.179 25881
2645 1 11 . 1 1 20 20 CYS N N 20 131.127 131.127 125.723 5.404 25881
2646 1 11 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.090 -0.159 25881
2647 1 11 . 1 1 20 20 CYS C C 20 176.321 176.321 174.251 2.070 25881
2648 1 11 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.522 1.770 25881
2649 1 11 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.738 4.128 25881
2650 1 11 . 1 1 20 20 CYS H H 20 9.391 9.391 8.609 0.782 25881
2651 1 11 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.400 0.000 25881
2652 1 11 . 1 1 21 21 PRO C C 21 176.764 176.764 176.571 0.193 25881
2653 1 11 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.361 0.075 25881
2654 1 11 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.518 0.807 25881
2655 1 11 . 1 1 22 22 LYS N N 22 120.217 120.217 119.073 1.144 25881
2656 1 11 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.354 -0.156 25881
2657 1 11 . 1 1 22 22 LYS C C 22 176.798 176.798 177.683 -0.885 25881
2658 1 11 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.398 0.229 25881
2659 1 11 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.514 0.748 25881
2660 1 11 . 1 1 22 22 LYS H H 22 8.550 8.550 8.408 0.142 25881
2661 1 11 . 1 1 23 23 CYS N N 23 115.450 115.450 114.698 0.752 25881
2662 1 11 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.956 0.031 25881
2663 1 11 . 1 1 23 23 CYS C C 23 176.434 176.434 176.334 0.100 25881
2664 1 11 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.555 -0.400 25881
2665 1 11 . 1 1 23 23 CYS CB C 23 32.482 32.482 30.029 2.453 25881
2666 1 11 . 1 1 23 23 CYS H H 23 7.886 7.886 8.444 -0.558 25881
2667 1 11 . 1 1 24 24 GLY N N 24 112.961 112.961 110.693 2.268 25881
2668 1 11 . 1 1 24 24 GLY C C 24 173.369 173.369 173.548 -0.179 25881
2669 1 11 . 1 1 24 24 GLY CA C 24 46.152 46.152 45.135 1.017 25881
2670 1 11 . 1 1 24 24 GLY H H 24 7.958 7.958 8.304 -0.346 25881
2671 1 11 . 1 1 25 25 VAL N N 25 123.968 123.968 119.484 4.484 25881
2672 1 11 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.108 -0.129 25881
2673 1 11 . 1 1 25 25 VAL C C 25 173.934 173.934 174.672 -0.738 25881
2674 1 11 . 1 1 25 25 VAL CA C 25 63.136 63.136 60.556 2.579 25881
2675 1 11 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.932 -1.973 25881
2676 1 11 . 1 1 25 25 VAL H H 25 8.348 8.348 7.265 1.083 25881
2677 1 11 . 1 1 26 26 ARG N N 26 125.641 125.641 124.712 0.929 25881
2678 1 11 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.567 0.693 25881
2679 1 11 . 1 1 26 26 ARG C C 26 177.008 177.008 175.307 1.701 25881
2680 1 11 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.871 -0.543 25881
2681 1 11 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.547 -2.224 25881
2682 1 11 . 1 1 26 26 ARG H H 26 8.379 8.379 8.234 0.145 25881
2683 1 11 . 1 1 27 27 TYR N N 27 117.706 117.706 118.204 -0.498 25881
2684 1 11 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.066 1.627 25881
2685 1 11 . 1 1 27 27 TYR C C 27 175.404 175.404 176.186 -0.782 25881
2686 1 11 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.223 1.253 25881
2687 1 11 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.661 2.242 25881
2688 1 11 . 1 1 27 27 TYR H H 27 8.631 8.631 8.398 0.233 25881
2689 1 11 . 1 1 28 28 CYS N N 28 118.515 118.515 116.393 2.122 25881
2690 1 11 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.944 -0.039 25881
2691 1 11 . 1 1 28 28 CYS C C 28 176.186 176.186 174.980 1.206 25881
2692 1 11 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.203 0.410 25881
2693 1 11 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.325 7.502 25881
2694 1 11 . 1 1 28 28 CYS H H 28 8.817 8.817 8.433 0.384 25881
2695 1 11 . 1 1 29 29 SER N N 29 114.067 114.067 111.596 2.471 25881
2696 1 11 . 1 1 29 29 SER HA H 29 4.877 4.877 4.177 0.700 25881
2697 1 11 . 1 1 29 29 SER C C 29 178.077 178.077 173.627 4.450 25881
2698 1 11 . 1 1 29 29 SER CA C 29 57.260 57.260 57.353 -0.093 25881
2699 1 11 . 1 1 29 29 SER CB C 29 65.051 65.051 63.767 1.284 25881
2700 1 11 . 1 1 29 29 SER H H 29 7.400 7.400 7.349 0.051 25881
2701 1 11 . 1 1 30 30 LEU HA H 30 4.039 4.039 4.028 0.011 25881
2702 1 11 . 1 1 30 30 LEU C C 30 178.077 178.077 178.016 0.061 25881
2703 1 11 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.439 0.012 25881
2704 1 11 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.507 -0.278 25881
2705 1 11 . 1 1 30 30 LEU H H 30 6.951 6.951 8.323 -1.372 25881
2706 1 11 . 1 1 31 31 LYS N N 31 118.534 118.534 118.056 0.478 25881
2707 1 11 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.055 -0.265 25881
2708 1 11 . 1 1 31 31 LYS C C 31 179.162 179.162 177.039 2.123 25881
2709 1 11 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.516 1.351 25881
2710 1 11 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.560 0.347 25881
2711 1 11 . 1 1 31 31 LYS H H 31 8.030 8.030 8.366 -0.336 25881
2712 1 11 . 1 1 32 32 CYS N N 32 118.700 118.700 115.464 3.236 25881
2713 1 11 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.654 -0.669 25881
2714 1 11 . 1 1 32 32 CYS C C 32 176.766 176.766 177.045 -0.279 25881
2715 1 11 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.447 6.232 25881
2716 1 11 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.951 1.598 25881
2717 1 11 . 1 1 32 32 CYS H H 32 7.424 7.424 7.496 -0.072 25881
2718 1 11 . 1 1 33 33 TYR N N 33 118.151 118.151 124.005 -5.854 25881
2719 1 11 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.339 -0.229 25881
2720 1 11 . 1 1 33 33 TYR C C 33 178.549 178.549 175.971 2.578 25881
2721 1 11 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.972 2.215 25881
2722 1 11 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.844 1.002 25881
2723 1 11 . 1 1 33 33 TYR H H 33 7.918 7.918 8.146 -0.228 25881
2724 1 11 . 1 1 34 34 LYS N N 34 114.631 114.631 117.152 -2.521 25881
2725 1 11 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.286 -0.364 25881
2726 1 11 . 1 1 34 34 LYS C C 34 174.991 174.991 175.625 -0.634 25881
2727 1 11 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.576 0.375 25881
2728 1 11 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.433 0.712 25881
2729 1 11 . 1 1 34 34 LYS H H 34 7.939 7.939 7.608 0.331 25881
2730 1 11 . 1 1 35 35 ASP N N 35 121.194 121.194 119.514 1.680 25881
2731 1 11 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.657 -0.363 25881
2732 1 11 . 1 1 35 35 ASP C C 35 175.480 175.480 175.124 0.356 25881
2733 1 11 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.480 0.859 25881
2734 1 11 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.003 -2.642 25881
2735 1 11 . 1 1 35 35 ASP H H 35 7.115 7.115 7.992 -0.877 25881
2736 1 11 . 1 1 36 36 ALA N N 36 130.311 130.311 126.341 3.970 25881
2737 1 11 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.933 -1.046 25881
2738 1 11 . 1 1 36 36 ALA C C 36 177.717 177.717 176.668 1.049 25881
2739 1 11 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.646 1.880 25881
2740 1 11 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.032 -0.321 25881
2741 1 11 . 1 1 36 36 ALA H H 36 8.073 8.073 8.566 -0.493 25881
2742 1 11 . 1 1 37 37 ALA N N 37 117.133 117.133 122.911 -5.778 25881
2743 1 11 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.365 -0.279 25881
2744 1 11 . 1 1 37 37 ALA C C 37 178.989 178.989 178.774 0.215 25881
2745 1 11 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.883 -0.672 25881
2746 1 11 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.151 -1.004 25881
2747 1 11 . 1 1 37 37 ALA H H 37 7.839 7.839 8.560 -0.721 25881
2748 1 11 . 1 1 38 38 LYS N N 38 114.127 114.127 116.522 -2.395 25881
2749 1 11 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.522 -0.227 25881
2750 1 11 . 1 1 38 38 LYS C C 38 175.690 175.690 176.727 -1.037 25881
2751 1 11 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.774 -0.571 25881
2752 1 11 . 1 1 38 38 LYS CB C 38 36.148 36.148 33.941 2.207 25881
2753 1 11 . 1 1 38 38 LYS H H 38 7.292 7.292 8.989 -1.697 25881
2754 1 11 . 1 1 39 39 HIS N N 39 122.110 122.110 121.478 0.632 25881
2755 1 11 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.495 0.268 25881
2756 1 11 . 1 1 39 39 HIS C C 39 171.783 171.783 173.555 -1.772 25881
2757 1 11 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.930 -3.295 25881
2758 1 11 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.583 -1.954 25881
2759 1 11 . 1 1 39 39 HIS H H 39 8.393 8.393 7.857 0.536 25881
2760 1 11 . 1 1 40 40 VAL N N 40 123.393 123.393 126.226 -2.833 25881
2761 1 11 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.294 -0.547 25881
2762 1 11 . 1 1 40 40 VAL C C 40 175.292 175.292 175.163 0.129 25881
2763 1 11 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.306 -0.142 25881
2764 1 11 . 1 1 40 40 VAL CB C 40 34.132 34.132 34.371 -0.239 25881
2765 1 11 . 1 1 40 40 VAL H H 40 7.811 7.811 8.342 -0.531 25881
2766 1 11 . 1 1 41 41 HIS N N 41 125.669 125.669 126.229 -0.560 25881
2767 1 11 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.765 0.113 25881
2768 1 11 . 1 1 41 41 HIS C C 41 174.640 174.640 175.415 -0.775 25881
2769 1 11 . 1 1 41 41 HIS CA C 41 52.900 52.900 54.345 -1.445 25881
2770 1 11 . 1 1 41 41 HIS CB C 41 30.067 30.067 33.562 -3.495 25881
2771 1 11 . 1 1 41 41 HIS H H 41 8.512 8.512 8.336 0.176 25881
2772 1 11 . 1 1 42 42 LYS N N 42 123.564 123.564 122.242 1.322 25881
2773 1 11 . 1 1 42 42 LYS C C 42 176.739 176.739 177.798 -1.059 25881
2774 1 11 . 1 1 42 42 LYS CA C 42 56.320 56.320 57.227 -0.908 25881
2775 1 11 . 1 1 42 42 LYS CB C 42 33.229 33.229 32.357 0.872 25881
2776 1 11 . 1 1 42 42 LYS H H 42 8.668 8.668 8.648 0.020 25881
2777 1 11 . 1 1 43 43 GLU N N 43 122.633 122.633 118.733 3.900 25881
2778 1 11 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.307 -0.197 25881
2779 1 11 . 1 1 43 43 GLU C C 43 176.569 176.569 177.047 -0.478 25881
2780 1 11 . 1 1 43 43 GLU CA C 43 57.097 57.097 58.170 -1.073 25881
2781 1 11 . 1 1 43 43 GLU CB C 43 29.948 29.948 28.805 1.143 25881
2782 1 11 . 1 1 43 43 GLU H H 43 8.590 8.590 8.568 0.022 25881
2783 1 11 . 1 1 44 44 SER N N 44 115.147 115.147 115.558 -0.411 25881
2784 1 11 . 1 1 44 44 SER HA H 44 4.268 4.268 4.565 -0.297 25881
2785 1 11 . 1 1 44 44 SER C C 44 174.336 174.336 173.959 0.377 25881
2786 1 11 . 1 1 44 44 SER CA C 44 58.348 58.348 57.880 0.468 25881
2787 1 11 . 1 1 44 44 SER CB C 44 63.724 63.724 63.502 0.222 25881
2788 1 11 . 1 1 44 44 SER H H 44 8.105 8.105 7.561 0.544 25881
2789 1 11 . 1 1 45 45 GLU N N 45 122.849 122.849 122.535 0.314 25881
2790 1 11 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.330 -0.167 25881
2791 1 11 . 1 1 45 45 GLU C C 45 175.304 175.304 175.457 -0.153 25881
2792 1 11 . 1 1 45 45 GLU CA C 45 56.412 56.412 55.916 0.496 25881
2793 1 11 . 1 1 45 45 GLU CB C 45 30.130 30.130 27.619 2.511 25881
2794 1 11 . 1 1 45 45 GLU H H 45 8.183 8.183 8.144 0.039 25881
2795 1 12 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.263 0.030 25881
2796 1 12 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 64.017 -1.015 25881
2797 1 12 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 32.097 0.121 25881
2798 1 12 . 1 1 1 1 MET HA H 1 3.967 3.967 4.191 -0.224 25881
2799 1 12 . 1 1 1 1 MET CA C 1 57.335 57.335 55.250 2.085 25881
2800 1 12 . 1 1 1 1 MET CB C 1 34.180 34.180 30.435 3.745 25881
2801 1 12 . 1 1 2 2 VAL C C 2 175.654 175.654 176.302 -0.648 25881
2802 1 12 . 1 1 2 2 VAL CA C 2 55.183 55.183 63.675 -8.492 25881
2803 1 12 . 1 1 2 2 VAL CB C 2 33.173 33.173 32.452 0.722 25881
2804 1 12 . 1 1 3 3 SER N N 3 121.996 121.996 116.950 5.046 25881
2805 1 12 . 1 1 3 3 SER HA H 3 4.323 4.323 4.460 -0.137 25881
2806 1 12 . 1 1 3 3 SER C C 3 176.021 176.021 174.412 1.609 25881
2807 1 12 . 1 1 3 3 SER CA C 3 62.208 62.208 59.411 2.797 25881
2808 1 12 . 1 1 3 3 SER H H 3 8.103 8.103 8.031 0.072 25881
2809 1 12 . 1 1 4 4 SER N N 4 119.715 119.715 119.598 0.117 25881
2810 1 12 . 1 1 4 4 SER HA H 4 4.317 4.317 4.250 0.067 25881
2811 1 12 . 1 1 4 4 SER C C 4 174.010 174.010 174.488 -0.478 25881
2812 1 12 . 1 1 4 4 SER CA C 4 58.177 58.177 60.209 -2.032 25881
2813 1 12 . 1 1 4 4 SER CB C 4 63.763 63.763 63.550 0.213 25881
2814 1 12 . 1 1 4 4 SER H H 4 8.298 8.298 8.147 0.151 25881
2815 1 12 . 1 1 5 5 ALA N N 5 126.016 126.016 123.096 2.920 25881
2816 1 12 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.482 -0.313 25881
2817 1 12 . 1 1 5 5 ALA C C 5 177.297 177.297 175.998 1.299 25881
2818 1 12 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.441 0.942 25881
2819 1 12 . 1 1 5 5 ALA CB C 5 19.106 19.106 20.222 -1.116 25881
2820 1 12 . 1 1 5 5 ALA H H 5 8.119 8.119 7.845 0.274 25881
2821 1 12 . 1 1 6 6 VAL N N 6 119.174 119.174 119.961 -0.787 25881
2822 1 12 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.352 -0.404 25881
2823 1 12 . 1 1 6 6 VAL C C 6 175.743 175.743 175.075 0.668 25881
2824 1 12 . 1 1 6 6 VAL CA C 6 61.668 61.668 59.930 1.738 25881
2825 1 12 . 1 1 6 6 VAL CB C 6 32.841 32.841 34.868 -2.027 25881
2826 1 12 . 1 1 6 6 VAL H H 6 7.861 7.861 8.170 -0.309 25881
2827 1 12 . 1 1 7 7 LYS N N 7 123.999 123.999 124.753 -0.754 25881
2828 1 12 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.778 -0.611 25881
2829 1 12 . 1 1 7 7 LYS C C 7 175.665 175.665 175.740 -0.075 25881
2830 1 12 . 1 1 7 7 LYS CA C 7 55.290 55.290 53.795 1.495 25881
2831 1 12 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.152 0.389 25881
2832 1 12 . 1 1 7 7 LYS H H 7 8.054 8.054 8.300 -0.246 25881
2833 1 12 . 1 1 8 8 CYS N N 8 121.428 121.428 121.928 -0.500 25881
2834 1 12 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.349 -0.706 25881
2835 1 12 . 1 1 8 8 CYS C C 8 177.383 177.383 176.481 0.902 25881
2836 1 12 . 1 1 8 8 CYS CA C 8 59.766 59.766 60.133 -0.367 25881
2837 1 12 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.734 4.175 25881
2838 1 12 . 1 1 8 8 CYS H H 8 8.539 8.539 8.903 -0.364 25881
2839 1 12 . 1 1 9 9 GLY N N 9 118.862 118.862 117.518 1.344 25881
2840 1 12 . 1 1 9 9 GLY C C 9 172.770 172.770 174.724 -1.954 25881
2841 1 12 . 1 1 9 9 GLY CA C 9 46.144 46.144 46.003 0.141 25881
2842 1 12 . 1 1 9 9 GLY H H 9 9.365 9.365 9.014 0.351 25881
2843 1 12 . 1 1 10 10 ILE N N 10 122.885 122.885 118.765 4.120 25881
2844 1 12 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.364 -0.382 25881
2845 1 12 . 1 1 10 10 ILE C C 10 175.980 175.980 175.672 0.308 25881
2846 1 12 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.653 0.404 25881
2847 1 12 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.557 -1.613 25881
2848 1 12 . 1 1 10 10 ILE H H 10 8.972 8.972 7.438 1.534 25881
2849 1 12 . 1 1 11 11 CYS N N 11 118.245 118.245 113.922 4.323 25881
2850 1 12 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.844 -0.195 25881
2851 1 12 . 1 1 11 11 CYS C C 11 176.780 176.780 175.105 1.675 25881
2852 1 12 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.716 1.378 25881
2853 1 12 . 1 1 11 11 CYS CB C 11 31.972 31.972 29.919 2.053 25881
2854 1 12 . 1 1 11 11 CYS H H 11 8.466 8.466 7.640 0.826 25881
2855 1 12 . 1 1 12 12 ARG N N 12 116.067 116.067 120.106 -4.039 25881
2856 1 12 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.123 0.093 25881
2857 1 12 . 1 1 12 12 ARG C C 12 175.637 175.637 176.590 -0.953 25881
2858 1 12 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.572 1.388 25881
2859 1 12 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.655 0.449 25881
2860 1 12 . 1 1 12 12 ARG H H 12 7.255 7.255 8.504 -1.249 25881
2861 1 12 . 1 1 13 13 GLY N N 13 109.951 109.951 107.521 2.430 25881
2862 1 12 . 1 1 13 13 GLY C C 13 173.169 173.169 173.911 -0.742 25881
2863 1 12 . 1 1 13 13 GLY CA C 13 44.304 44.304 46.018 -1.714 25881
2864 1 12 . 1 1 13 13 GLY H H 13 8.795 8.795 8.006 0.789 25881
2865 1 12 . 1 1 14 14 VAL N N 14 113.644 113.644 115.251 -1.607 25881
2866 1 12 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.758 -0.714 25881
2867 1 12 . 1 1 14 14 VAL C C 14 174.970 174.970 174.409 0.561 25881
2868 1 12 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.944 2.287 25881
2869 1 12 . 1 1 14 14 VAL CB C 14 33.838 33.838 34.047 -0.209 25881
2870 1 12 . 1 1 14 14 VAL H H 14 7.266 7.266 7.785 -0.519 25881
2871 1 12 . 1 1 15 15 ASP N N 15 119.913 119.913 119.207 0.706 25881
2872 1 12 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.696 -0.465 25881
2873 1 12 . 1 1 15 15 ASP C C 15 176.279 176.279 176.642 -0.363 25881
2874 1 12 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.609 0.414 25881
2875 1 12 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.924 -0.977 25881
2876 1 12 . 1 1 15 15 ASP H H 15 8.223 8.223 8.382 -0.159 25881
2877 1 12 . 1 1 16 16 GLY N N 16 109.534 109.534 107.248 2.286 25881
2878 1 12 . 1 1 16 16 GLY C C 16 173.120 173.120 174.871 -1.751 25881
2879 1 12 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.046 2.050 25881
2880 1 12 . 1 1 16 16 GLY H H 16 8.617 8.617 8.834 -0.217 25881
2881 1 12 . 1 1 17 17 LYS N N 17 121.534 121.534 123.534 -2.000 25881
2882 1 12 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.033 -0.388 25881
2883 1 12 . 1 1 17 17 LYS C C 17 175.029 175.029 177.216 -2.187 25881
2884 1 12 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.413 -0.902 25881
2885 1 12 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.660 0.484 25881
2886 1 12 . 1 1 17 17 LYS H H 17 7.318 7.318 7.726 -0.408 25881
2887 1 12 . 1 1 18 18 TYR N N 18 119.391 119.391 120.386 -0.995 25881
2888 1 12 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.551 -0.099 25881
2889 1 12 . 1 1 18 18 TYR C C 18 174.241 174.241 174.926 -0.685 25881
2890 1 12 . 1 1 18 18 TYR CA C 18 55.548 55.548 58.285 -2.737 25881
2891 1 12 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.138 -1.642 25881
2892 1 12 . 1 1 18 18 TYR H H 18 7.661 7.661 8.028 -0.367 25881
2893 1 12 . 1 1 19 19 LYS N N 19 120.140 120.140 122.315 -2.175 25881
2894 1 12 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.535 0.406 25881
2895 1 12 . 1 1 19 19 LYS C C 19 176.321 176.321 174.398 1.923 25881
2896 1 12 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.094 0.470 25881
2897 1 12 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.913 0.105 25881
2898 1 12 . 1 1 19 19 LYS H H 19 8.395 8.395 8.171 0.224 25881
2899 1 12 . 1 1 20 20 CYS N N 20 131.127 131.127 124.430 6.697 25881
2900 1 12 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.048 -0.117 25881
2901 1 12 . 1 1 20 20 CYS C C 20 176.321 176.321 174.063 2.258 25881
2902 1 12 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.589 1.703 25881
2903 1 12 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.919 3.946 25881
2904 1 12 . 1 1 20 20 CYS H H 20 9.391 9.391 8.649 0.742 25881
2905 1 12 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.384 0.016 25881
2906 1 12 . 1 1 21 21 PRO C C 21 176.764 176.764 176.724 0.040 25881
2907 1 12 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.534 -0.100 25881
2908 1 12 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.576 0.749 25881
2909 1 12 . 1 1 22 22 LYS N N 22 120.217 120.217 117.828 2.389 25881
2910 1 12 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.444 -0.246 25881
2911 1 12 . 1 1 22 22 LYS C C 22 176.798 176.798 177.809 -1.011 25881
2912 1 12 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.705 -0.078 25881
2913 1 12 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.775 0.487 25881
2914 1 12 . 1 1 22 22 LYS H H 22 8.550 8.550 8.070 0.480 25881
2915 1 12 . 1 1 23 23 CYS N N 23 115.450 115.450 113.833 1.617 25881
2916 1 12 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.949 0.038 25881
2917 1 12 . 1 1 23 23 CYS C C 23 176.434 176.434 176.315 0.119 25881
2918 1 12 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.571 -0.416 25881
2919 1 12 . 1 1 23 23 CYS CB C 23 32.482 32.482 29.775 2.707 25881
2920 1 12 . 1 1 23 23 CYS H H 23 7.886 7.886 7.967 -0.081 25881
2921 1 12 . 1 1 24 24 GLY N N 24 112.961 112.961 110.671 2.290 25881
2922 1 12 . 1 1 24 24 GLY C C 24 173.369 173.369 173.680 -0.311 25881
2923 1 12 . 1 1 24 24 GLY CA C 24 46.152 46.152 44.987 1.165 25881
2924 1 12 . 1 1 24 24 GLY H H 24 7.958 7.958 8.328 -0.370 25881
2925 1 12 . 1 1 25 25 VAL N N 25 123.968 123.968 119.103 4.865 25881
2926 1 12 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.070 -0.091 25881
2927 1 12 . 1 1 25 25 VAL C C 25 173.934 173.934 174.396 -0.462 25881
2928 1 12 . 1 1 25 25 VAL CA C 25 63.136 63.136 60.842 2.294 25881
2929 1 12 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.293 -1.334 25881
2930 1 12 . 1 1 25 25 VAL H H 25 8.348 8.348 7.291 1.057 25881
2931 1 12 . 1 1 26 26 ARG N N 26 125.641 125.641 123.891 1.750 25881
2932 1 12 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.684 0.576 25881
2933 1 12 . 1 1 26 26 ARG C C 26 177.008 177.008 175.405 1.603 25881
2934 1 12 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.755 -0.427 25881
2935 1 12 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.603 -2.280 25881
2936 1 12 . 1 1 26 26 ARG H H 26 8.379 8.379 8.282 0.097 25881
2937 1 12 . 1 1 27 27 TYR N N 27 117.706 117.706 118.550 -0.844 25881
2938 1 12 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.080 1.613 25881
2939 1 12 . 1 1 27 27 TYR C C 27 175.404 175.404 176.338 -0.934 25881
2940 1 12 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.443 1.033 25881
2941 1 12 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.721 2.182 25881
2942 1 12 . 1 1 27 27 TYR H H 27 8.631 8.631 8.258 0.373 25881
2943 1 12 . 1 1 28 28 CYS N N 28 118.515 118.515 116.029 2.486 25881
2944 1 12 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.958 -0.053 25881
2945 1 12 . 1 1 28 28 CYS C C 28 176.186 176.186 174.945 1.241 25881
2946 1 12 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.795 -0.181 25881
2947 1 12 . 1 1 28 28 CYS CB C 28 34.827 34.827 28.211 6.616 25881
2948 1 12 . 1 1 28 28 CYS H H 28 8.817 8.817 8.386 0.431 25881
2949 1 12 . 1 1 29 29 SER N N 29 114.067 114.067 112.054 2.013 25881
2950 1 12 . 1 1 29 29 SER HA H 29 4.877 4.877 4.340 0.537 25881
2951 1 12 . 1 1 29 29 SER C C 29 178.077 178.077 173.801 4.276 25881
2952 1 12 . 1 1 29 29 SER CA C 29 57.260 57.260 57.009 0.251 25881
2953 1 12 . 1 1 29 29 SER CB C 29 65.051 65.051 64.581 0.470 25881
2954 1 12 . 1 1 29 29 SER H H 29 7.400 7.400 7.569 -0.169 25881
2955 1 12 . 1 1 30 30 LEU HA H 30 4.039 4.039 3.930 0.109 25881
2956 1 12 . 1 1 30 30 LEU C C 30 178.077 178.077 178.204 -0.127 25881
2957 1 12 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.897 -0.445 25881
2958 1 12 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.510 -0.281 25881
2959 1 12 . 1 1 30 30 LEU H H 30 6.951 6.951 8.442 -1.491 25881
2960 1 12 . 1 1 31 31 LYS N N 31 118.534 118.534 119.057 -0.523 25881
2961 1 12 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.021 -0.231 25881
2962 1 12 . 1 1 31 31 LYS C C 31 179.162 179.162 177.436 1.726 25881
2963 1 12 . 1 1 31 31 LYS CA C 31 59.867 59.867 59.135 0.732 25881
2964 1 12 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.664 0.243 25881
2965 1 12 . 1 1 31 31 LYS H H 31 8.030 8.030 8.357 -0.327 25881
2966 1 12 . 1 1 32 32 CYS N N 32 118.700 118.700 117.047 1.653 25881
2967 1 12 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.616 -0.631 25881
2968 1 12 . 1 1 32 32 CYS C C 32 176.766 176.766 176.815 -0.049 25881
2969 1 12 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.830 5.849 25881
2970 1 12 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.040 2.509 25881
2971 1 12 . 1 1 32 32 CYS H H 32 7.424 7.424 7.757 -0.333 25881
2972 1 12 . 1 1 33 33 TYR N N 33 118.151 118.151 123.401 -5.250 25881
2973 1 12 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.274 -0.164 25881
2974 1 12 . 1 1 33 33 TYR C C 33 178.549 178.549 176.257 2.292 25881
2975 1 12 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.711 2.476 25881
2976 1 12 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.745 1.101 25881
2977 1 12 . 1 1 33 33 TYR H H 33 7.918 7.918 8.170 -0.252 25881
2978 1 12 . 1 1 34 34 LYS N N 34 114.631 114.631 117.826 -3.195 25881
2979 1 12 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.293 -0.371 25881
2980 1 12 . 1 1 34 34 LYS C C 34 174.991 174.991 175.353 -0.362 25881
2981 1 12 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.550 0.401 25881
2982 1 12 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.122 1.023 25881
2983 1 12 . 1 1 34 34 LYS H H 34 7.939 7.939 7.736 0.203 25881
2984 1 12 . 1 1 35 35 ASP N N 35 121.194 121.194 120.186 1.008 25881
2985 1 12 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.720 -0.426 25881
2986 1 12 . 1 1 35 35 ASP C C 35 175.480 175.480 174.756 0.724 25881
2987 1 12 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.367 0.972 25881
2988 1 12 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.162 -2.801 25881
2989 1 12 . 1 1 35 35 ASP H H 35 7.115 7.115 7.839 -0.724 25881
2990 1 12 . 1 1 36 36 ALA N N 36 130.311 130.311 126.348 3.963 25881
2991 1 12 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.970 -1.083 25881
2992 1 12 . 1 1 36 36 ALA C C 36 177.717 177.717 176.508 1.209 25881
2993 1 12 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.598 1.928 25881
2994 1 12 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.169 -0.458 25881
2995 1 12 . 1 1 36 36 ALA H H 36 8.073 8.073 8.548 -0.475 25881
2996 1 12 . 1 1 37 37 ALA N N 37 117.133 117.133 122.599 -5.466 25881
2997 1 12 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.405 -0.319 25881
2998 1 12 . 1 1 37 37 ALA C C 37 178.989 178.989 178.568 0.421 25881
2999 1 12 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.515 -0.304 25881
3000 1 12 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.244 -1.097 25881
3001 1 12 . 1 1 37 37 ALA H H 37 7.839 7.839 8.806 -0.967 25881
3002 1 12 . 1 1 38 38 LYS N N 38 114.127 114.127 116.791 -2.664 25881
3003 1 12 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.463 -0.168 25881
3004 1 12 . 1 1 38 38 LYS C C 38 175.690 175.690 176.963 -1.273 25881
3005 1 12 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.971 -0.768 25881
3006 1 12 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.105 2.043 25881
3007 1 12 . 1 1 38 38 LYS H H 38 7.292 7.292 9.185 -1.893 25881
3008 1 12 . 1 1 39 39 HIS N N 39 122.110 122.110 121.716 0.394 25881
3009 1 12 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.471 0.292 25881
3010 1 12 . 1 1 39 39 HIS C C 39 171.783 171.783 173.471 -1.688 25881
3011 1 12 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.826 -3.191 25881
3012 1 12 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.931 -2.302 25881
3013 1 12 . 1 1 39 39 HIS H H 39 8.393 8.393 8.223 0.170 25881
3014 1 12 . 1 1 40 40 VAL N N 40 123.393 123.393 125.592 -2.199 25881
3015 1 12 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.291 -0.544 25881
3016 1 12 . 1 1 40 40 VAL C C 40 175.292 175.292 175.412 -0.120 25881
3017 1 12 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.240 -0.076 25881
3018 1 12 . 1 1 40 40 VAL CB C 40 34.132 34.132 33.976 0.156 25881
3019 1 12 . 1 1 40 40 VAL H H 40 7.811 7.811 8.629 -0.818 25881
3020 1 12 . 1 1 41 41 HIS N N 41 125.669 125.669 125.321 0.348 25881
3021 1 12 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.768 0.110 25881
3022 1 12 . 1 1 41 41 HIS C C 41 174.640 174.640 175.046 -0.406 25881
3023 1 12 . 1 1 41 41 HIS CA C 41 52.900 52.900 54.039 -1.139 25881
3024 1 12 . 1 1 41 41 HIS CB C 41 30.067 30.067 32.396 -2.329 25881
3025 1 12 . 1 1 41 41 HIS H H 41 8.512 8.512 8.369 0.143 25881
3026 1 12 . 1 1 42 42 LYS N N 42 123.564 123.564 120.745 2.819 25881
3027 1 12 . 1 1 42 42 LYS C C 42 176.739 176.739 176.261 0.478 25881
3028 1 12 . 1 1 42 42 LYS CA C 42 56.320 56.320 57.081 -0.761 25881
3029 1 12 . 1 1 42 42 LYS CB C 42 33.229 33.229 33.141 0.088 25881
3030 1 12 . 1 1 42 42 LYS H H 42 8.668 8.668 8.302 0.366 25881
3031 1 12 . 1 1 43 43 GLU N N 43 122.633 122.633 122.652 -0.019 25881
3032 1 12 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.377 -0.267 25881
3033 1 12 . 1 1 43 43 GLU C C 43 176.569 176.569 175.818 0.751 25881
3034 1 12 . 1 1 43 43 GLU CA C 43 57.097 57.097 56.819 0.278 25881
3035 1 12 . 1 1 43 43 GLU CB C 43 29.948 29.948 30.419 -0.471 25881
3036 1 12 . 1 1 43 43 GLU H H 43 8.590 8.590 8.747 -0.157 25881
3037 1 12 . 1 1 44 44 SER N N 44 115.147 115.147 116.959 -1.812 25881
3038 1 12 . 1 1 44 44 SER HA H 44 4.268 4.268 4.707 -0.439 25881
3039 1 12 . 1 1 44 44 SER C C 44 174.336 174.336 174.459 -0.123 25881
3040 1 12 . 1 1 44 44 SER CA C 44 58.348 58.348 58.785 -0.437 25881
3041 1 12 . 1 1 44 44 SER CB C 44 63.724 63.724 63.096 0.628 25881
3042 1 12 . 1 1 44 44 SER H H 44 8.105 8.105 8.290 -0.185 25881
3043 1 12 . 1 1 45 45 GLU N N 45 122.849 122.849 121.214 1.635 25881
3044 1 12 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.437 -0.274 25881
3045 1 12 . 1 1 45 45 GLU C C 45 175.304 175.304 176.522 -1.218 25881
3046 1 12 . 1 1 45 45 GLU CA C 45 56.412 56.412 56.378 0.034 25881
3047 1 12 . 1 1 45 45 GLU CB C 45 30.130 30.130 29.984 0.146 25881
3048 1 12 . 1 1 45 45 GLU H H 45 8.183 8.183 8.572 -0.389 25881
3049 1 13 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.601 -0.308 25881
3050 1 13 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 63.044 -0.042 25881
3051 1 13 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 31.633 0.585 25881
3052 1 13 . 1 1 1 1 MET HA H 1 3.967 3.967 4.428 -0.461 25881
3053 1 13 . 1 1 1 1 MET CA C 1 57.335 57.335 54.519 2.816 25881
3054 1 13 . 1 1 1 1 MET CB C 1 34.180 34.180 35.369 -1.189 25881
3055 1 13 . 1 1 2 2 VAL C C 2 175.654 175.654 175.589 0.065 25881
3056 1 13 . 1 1 2 2 VAL CA C 2 55.183 55.183 62.530 -7.347 25881
3057 1 13 . 1 1 2 2 VAL CB C 2 33.173 33.173 32.100 1.073 25881
3058 1 13 . 1 1 3 3 SER N N 3 121.996 121.996 115.445 6.551 25881
3059 1 13 . 1 1 3 3 SER HA H 3 4.323 4.323 4.608 -0.285 25881
3060 1 13 . 1 1 3 3 SER C C 3 176.021 176.021 173.826 2.195 25881
3061 1 13 . 1 1 3 3 SER CA C 3 62.208 62.208 57.705 4.503 25881
3062 1 13 . 1 1 3 3 SER H H 3 8.103 8.103 7.892 0.211 25881
3063 1 13 . 1 1 4 4 SER N N 4 119.715 119.715 116.226 3.489 25881
3064 1 13 . 1 1 4 4 SER HA H 4 4.317 4.317 4.572 -0.255 25881
3065 1 13 . 1 1 4 4 SER C C 4 174.010 174.010 173.795 0.215 25881
3066 1 13 . 1 1 4 4 SER CA C 4 58.177 58.177 58.372 -0.195 25881
3067 1 13 . 1 1 4 4 SER CB C 4 63.763 63.763 63.061 0.702 25881
3068 1 13 . 1 1 4 4 SER H H 4 8.298 8.298 8.353 -0.055 25881
3069 1 13 . 1 1 5 5 ALA N N 5 126.016 126.016 123.301 2.715 25881
3070 1 13 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.556 -0.387 25881
3071 1 13 . 1 1 5 5 ALA C C 5 177.297 177.297 174.772 2.525 25881
3072 1 13 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.950 0.434 25881
3073 1 13 . 1 1 5 5 ALA CB C 5 19.106 19.106 20.730 -1.624 25881
3074 1 13 . 1 1 5 5 ALA H H 5 8.119 8.119 7.484 0.635 25881
3075 1 13 . 1 1 6 6 VAL N N 6 119.174 119.174 119.507 -0.333 25881
3076 1 13 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.374 -0.426 25881
3077 1 13 . 1 1 6 6 VAL C C 6 175.743 175.743 174.025 1.718 25881
3078 1 13 . 1 1 6 6 VAL CA C 6 61.668 61.668 60.348 1.320 25881
3079 1 13 . 1 1 6 6 VAL CB C 6 32.841 32.841 34.011 -1.170 25881
3080 1 13 . 1 1 6 6 VAL H H 6 7.861 7.861 8.246 -0.385 25881
3081 1 13 . 1 1 7 7 LYS N N 7 123.999 123.999 124.330 -0.331 25881
3082 1 13 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.663 -0.496 25881
3083 1 13 . 1 1 7 7 LYS C C 7 175.665 175.665 176.008 -0.343 25881
3084 1 13 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.086 1.204 25881
3085 1 13 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.679 -0.138 25881
3086 1 13 . 1 1 7 7 LYS H H 7 8.054 8.054 8.285 -0.231 25881
3087 1 13 . 1 1 8 8 CYS N N 8 121.428 121.428 122.942 -1.514 25881
3088 1 13 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.526 -0.883 25881
3089 1 13 . 1 1 8 8 CYS C C 8 177.383 177.383 176.318 1.065 25881
3090 1 13 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.511 0.255 25881
3091 1 13 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.806 4.103 25881
3092 1 13 . 1 1 8 8 CYS H H 8 8.539 8.539 8.848 -0.309 25881
3093 1 13 . 1 1 9 9 GLY N N 9 118.862 118.862 116.237 2.625 25881
3094 1 13 . 1 1 9 9 GLY C C 9 172.770 172.770 174.685 -1.915 25881
3095 1 13 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.585 0.559 25881
3096 1 13 . 1 1 9 9 GLY H H 9 9.365 9.365 9.045 0.320 25881
3097 1 13 . 1 1 10 10 ILE N N 10 122.885 122.885 118.192 4.693 25881
3098 1 13 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.244 -0.262 25881
3099 1 13 . 1 1 10 10 ILE C C 10 175.980 175.980 175.187 0.793 25881
3100 1 13 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.306 0.750 25881
3101 1 13 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.268 -1.324 25881
3102 1 13 . 1 1 10 10 ILE H H 10 8.972 8.972 7.307 1.665 25881
3103 1 13 . 1 1 11 11 CYS N N 11 118.245 118.245 113.301 4.944 25881
3104 1 13 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.878 -0.229 25881
3105 1 13 . 1 1 11 11 CYS C C 11 176.780 176.780 175.180 1.600 25881
3106 1 13 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.648 1.446 25881
3107 1 13 . 1 1 11 11 CYS CB C 11 31.972 31.972 29.953 2.019 25881
3108 1 13 . 1 1 11 11 CYS H H 11 8.466 8.466 7.657 0.809 25881
3109 1 13 . 1 1 12 12 ARG N N 12 116.067 116.067 119.700 -3.633 25881
3110 1 13 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.152 0.064 25881
3111 1 13 . 1 1 12 12 ARG C C 12 175.637 175.637 176.248 -0.611 25881
3112 1 13 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.911 1.049 25881
3113 1 13 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.926 0.178 25881
3114 1 13 . 1 1 12 12 ARG H H 12 7.255 7.255 8.493 -1.238 25881
3115 1 13 . 1 1 13 13 GLY N N 13 109.951 109.951 105.534 4.417 25881
3116 1 13 . 1 1 13 13 GLY C C 13 173.169 173.169 173.496 -0.327 25881
3117 1 13 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.873 -1.569 25881
3118 1 13 . 1 1 13 13 GLY H H 13 8.795 8.795 7.894 0.901 25881
3119 1 13 . 1 1 14 14 VAL N N 14 113.644 113.644 116.279 -2.635 25881
3120 1 13 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.668 -0.624 25881
3121 1 13 . 1 1 14 14 VAL C C 14 174.970 174.970 174.503 0.467 25881
3122 1 13 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.805 2.426 25881
3123 1 13 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.514 0.324 25881
3124 1 13 . 1 1 14 14 VAL H H 14 7.266 7.266 7.725 -0.459 25881
3125 1 13 . 1 1 15 15 ASP N N 15 119.913 119.913 118.855 1.058 25881
3126 1 13 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.719 -0.488 25881
3127 1 13 . 1 1 15 15 ASP C C 15 176.279 176.279 176.843 -0.564 25881
3128 1 13 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.416 0.607 25881
3129 1 13 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.879 -0.932 25881
3130 1 13 . 1 1 15 15 ASP H H 15 8.223 8.223 8.350 -0.127 25881
3131 1 13 . 1 1 16 16 GLY N N 16 109.534 109.534 107.450 2.084 25881
3132 1 13 . 1 1 16 16 GLY C C 16 173.120 173.120 174.874 -1.754 25881
3133 1 13 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.198 1.898 25881
3134 1 13 . 1 1 16 16 GLY H H 16 8.617 8.617 8.754 -0.137 25881
3135 1 13 . 1 1 17 17 LYS N N 17 121.534 121.534 123.669 -2.135 25881
3136 1 13 . 1 1 17 17 LYS HA H 17 3.645 3.645 3.997 -0.352 25881
3137 1 13 . 1 1 17 17 LYS C C 17 175.029 175.029 177.070 -2.041 25881
3138 1 13 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.392 -0.881 25881
3139 1 13 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.656 0.488 25881
3140 1 13 . 1 1 17 17 LYS H H 17 7.318 7.318 7.779 -0.461 25881
3141 1 13 . 1 1 18 18 TYR N N 18 119.391 119.391 119.624 -0.233 25881
3142 1 13 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.696 -0.244 25881
3143 1 13 . 1 1 18 18 TYR C C 18 174.241 174.241 174.504 -0.263 25881
3144 1 13 . 1 1 18 18 TYR CA C 18 55.548 55.548 57.427 -1.879 25881
3145 1 13 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.905 -2.409 25881
3146 1 13 . 1 1 18 18 TYR H H 18 7.661 7.661 8.022 -0.361 25881
3147 1 13 . 1 1 19 19 LYS N N 19 120.140 120.140 121.423 -1.283 25881
3148 1 13 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.627 0.314 25881
3149 1 13 . 1 1 19 19 LYS C C 19 176.321 176.321 174.547 1.774 25881
3150 1 13 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.159 0.405 25881
3151 1 13 . 1 1 19 19 LYS CB C 19 36.018 36.018 36.128 -0.110 25881
3152 1 13 . 1 1 19 19 LYS H H 19 8.395 8.395 8.427 -0.032 25881
3153 1 13 . 1 1 20 20 CYS N N 20 131.127 131.127 124.742 6.385 25881
3154 1 13 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.077 -0.146 25881
3155 1 13 . 1 1 20 20 CYS C C 20 176.321 176.321 173.952 2.369 25881
3156 1 13 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.542 1.750 25881
3157 1 13 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.766 4.100 25881
3158 1 13 . 1 1 20 20 CYS H H 20 9.391 9.391 8.613 0.778 25881
3159 1 13 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.368 0.032 25881
3160 1 13 . 1 1 21 21 PRO C C 21 176.764 176.764 176.913 -0.149 25881
3161 1 13 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.555 -0.120 25881
3162 1 13 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.573 0.752 25881
3163 1 13 . 1 1 22 22 LYS N N 22 120.217 120.217 118.958 1.259 25881
3164 1 13 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.224 -0.026 25881
3165 1 13 . 1 1 22 22 LYS C C 22 176.798 176.798 177.687 -0.889 25881
3166 1 13 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.874 -0.247 25881
3167 1 13 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.171 1.091 25881
3168 1 13 . 1 1 22 22 LYS H H 22 8.550 8.550 8.581 -0.031 25881
3169 1 13 . 1 1 23 23 CYS N N 23 115.450 115.450 113.863 1.587 25881
3170 1 13 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.807 0.180 25881
3171 1 13 . 1 1 23 23 CYS C C 23 176.434 176.434 176.527 -0.093 25881
3172 1 13 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.625 -0.470 25881
3173 1 13 . 1 1 23 23 CYS CB C 23 32.482 32.482 30.054 2.428 25881
3174 1 13 . 1 1 23 23 CYS H H 23 7.886 7.886 8.178 -0.292 25881
3175 1 13 . 1 1 24 24 GLY N N 24 112.961 112.961 110.804 2.157 25881
3176 1 13 . 1 1 24 24 GLY C C 24 173.369 173.369 173.613 -0.244 25881
3177 1 13 . 1 1 24 24 GLY CA C 24 46.152 46.152 44.922 1.230 25881
3178 1 13 . 1 1 24 24 GLY H H 24 7.958 7.958 8.421 -0.463 25881
3179 1 13 . 1 1 25 25 VAL N N 25 123.968 123.968 119.223 4.745 25881
3180 1 13 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.123 -0.144 25881
3181 1 13 . 1 1 25 25 VAL C C 25 173.934 173.934 174.581 -0.647 25881
3182 1 13 . 1 1 25 25 VAL CA C 25 63.136 63.136 60.963 2.173 25881
3183 1 13 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.417 -1.458 25881
3184 1 13 . 1 1 25 25 VAL H H 25 8.348 8.348 7.345 1.003 25881
3185 1 13 . 1 1 26 26 ARG N N 26 125.641 125.641 125.007 0.634 25881
3186 1 13 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.712 0.548 25881
3187 1 13 . 1 1 26 26 ARG C C 26 177.008 177.008 175.336 1.672 25881
3188 1 13 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.740 -0.412 25881
3189 1 13 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.112 -1.789 25881
3190 1 13 . 1 1 26 26 ARG H H 26 8.379 8.379 8.314 0.065 25881
3191 1 13 . 1 1 27 27 TYR N N 27 117.706 117.706 119.387 -1.681 25881
3192 1 13 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.078 1.615 25881
3193 1 13 . 1 1 27 27 TYR C C 27 175.404 175.404 176.563 -1.159 25881
3194 1 13 . 1 1 27 27 TYR CA C 27 55.476 55.476 53.776 1.700 25881
3195 1 13 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.359 2.544 25881
3196 1 13 . 1 1 27 27 TYR H H 27 8.631 8.631 8.004 0.627 25881
3197 1 13 . 1 1 28 28 CYS N N 28 118.515 118.515 117.151 1.364 25881
3198 1 13 . 1 1 28 28 CYS HA H 28 4.905 4.905 5.010 -0.105 25881
3199 1 13 . 1 1 28 28 CYS C C 28 176.186 176.186 175.115 1.071 25881
3200 1 13 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.733 -0.119 25881
3201 1 13 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.944 6.883 25881
3202 1 13 . 1 1 28 28 CYS H H 28 8.817 8.817 8.397 0.420 25881
3203 1 13 . 1 1 29 29 SER N N 29 114.067 114.067 112.972 1.095 25881
3204 1 13 . 1 1 29 29 SER HA H 29 4.877 4.877 4.244 0.633 25881
3205 1 13 . 1 1 29 29 SER C C 29 178.077 178.077 173.436 4.641 25881
3206 1 13 . 1 1 29 29 SER CA C 29 57.260 57.260 57.513 -0.253 25881
3207 1 13 . 1 1 29 29 SER CB C 29 65.051 65.051 64.112 0.939 25881
3208 1 13 . 1 1 29 29 SER H H 29 7.400 7.400 7.396 0.004 25881
3209 1 13 . 1 1 30 30 LEU HA H 30 4.039 4.039 4.078 -0.039 25881
3210 1 13 . 1 1 30 30 LEU C C 30 178.077 178.077 177.396 0.681 25881
3211 1 13 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.096 0.355 25881
3212 1 13 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.662 -0.433 25881
3213 1 13 . 1 1 30 30 LEU H H 30 6.951 6.951 8.439 -1.488 25881
3214 1 13 . 1 1 31 31 LYS N N 31 118.534 118.534 119.696 -1.162 25881
3215 1 13 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.029 -0.239 25881
3216 1 13 . 1 1 31 31 LYS C C 31 179.162 179.162 177.625 1.537 25881
3217 1 13 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.650 1.218 25881
3218 1 13 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.464 0.443 25881
3219 1 13 . 1 1 31 31 LYS H H 31 8.030 8.030 7.651 0.379 25881
3220 1 13 . 1 1 32 32 CYS N N 32 118.700 118.700 116.674 2.026 25881
3221 1 13 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.582 -0.597 25881
3222 1 13 . 1 1 32 32 CYS C C 32 176.766 176.766 176.793 -0.027 25881
3223 1 13 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.290 6.389 25881
3224 1 13 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.312 2.236 25881
3225 1 13 . 1 1 32 32 CYS H H 32 7.424 7.424 7.651 -0.227 25881
3226 1 13 . 1 1 33 33 TYR N N 33 118.151 118.151 123.805 -5.654 25881
3227 1 13 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.249 -0.139 25881
3228 1 13 . 1 1 33 33 TYR C C 33 178.549 178.549 175.693 2.856 25881
3229 1 13 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.573 2.614 25881
3230 1 13 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.815 1.031 25881
3231 1 13 . 1 1 33 33 TYR H H 33 7.918 7.918 7.566 0.352 25881
3232 1 13 . 1 1 34 34 LYS N N 34 114.631 114.631 117.043 -2.412 25881
3233 1 13 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.165 -0.243 25881
3234 1 13 . 1 1 34 34 LYS C C 34 174.991 174.991 175.502 -0.511 25881
3235 1 13 . 1 1 34 34 LYS CA C 34 55.951 55.951 56.164 -0.213 25881
3236 1 13 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.112 1.033 25881
3237 1 13 . 1 1 34 34 LYS H H 34 7.939 7.939 7.441 0.498 25881
3238 1 13 . 1 1 35 35 ASP N N 35 121.194 121.194 119.691 1.503 25881
3239 1 13 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.734 -0.440 25881
3240 1 13 . 1 1 35 35 ASP C C 35 175.480 175.480 174.866 0.614 25881
3241 1 13 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.159 1.180 25881
3242 1 13 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.490 -3.129 25881
3243 1 13 . 1 1 35 35 ASP H H 35 7.115 7.115 7.875 -0.760 25881
3244 1 13 . 1 1 36 36 ALA N N 36 130.311 130.311 125.743 4.568 25881
3245 1 13 . 1 1 36 36 ALA HA H 36 3.887 3.887 5.007 -1.120 25881
3246 1 13 . 1 1 36 36 ALA C C 36 177.717 177.717 176.271 1.446 25881
3247 1 13 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.555 1.971 25881
3248 1 13 . 1 1 36 36 ALA CB C 36 18.711 18.711 18.829 -0.118 25881
3249 1 13 . 1 1 36 36 ALA H H 36 8.073 8.073 8.571 -0.498 25881
3250 1 13 . 1 1 37 37 ALA N N 37 117.133 117.133 122.426 -5.293 25881
3251 1 13 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.462 -0.376 25881
3252 1 13 . 1 1 37 37 ALA C C 37 178.989 178.989 178.351 0.638 25881
3253 1 13 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.323 -0.112 25881
3254 1 13 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.447 -1.300 25881
3255 1 13 . 1 1 37 37 ALA H H 37 7.839 7.839 9.009 -1.170 25881
3256 1 13 . 1 1 38 38 LYS N N 38 114.127 114.127 116.788 -2.661 25881
3257 1 13 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.502 -0.207 25881
3258 1 13 . 1 1 38 38 LYS C C 38 175.690 175.690 176.939 -1.249 25881
3259 1 13 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.846 -0.643 25881
3260 1 13 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.516 1.632 25881
3261 1 13 . 1 1 38 38 LYS H H 38 7.292 7.292 9.182 -1.890 25881
3262 1 13 . 1 1 39 39 HIS N N 39 122.110 122.110 122.540 -0.430 25881
3263 1 13 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.499 0.264 25881
3264 1 13 . 1 1 39 39 HIS C C 39 171.783 171.783 173.615 -1.832 25881
3265 1 13 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.471 -2.836 25881
3266 1 13 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.698 -2.069 25881
3267 1 13 . 1 1 39 39 HIS H H 39 8.393 8.393 8.722 -0.329 25881
3268 1 13 . 1 1 40 40 VAL N N 40 123.393 123.393 127.242 -3.849 25881
3269 1 13 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.100 -0.353 25881
3270 1 13 . 1 1 40 40 VAL C C 40 175.292 175.292 175.244 0.048 25881
3271 1 13 . 1 1 40 40 VAL CA C 40 61.164 61.164 62.243 -1.079 25881
3272 1 13 . 1 1 40 40 VAL CB C 40 34.132 34.132 32.511 1.621 25881
3273 1 13 . 1 1 40 40 VAL H H 40 7.811 7.811 7.913 -0.102 25881
3274 1 13 . 1 1 41 41 HIS N N 41 125.669 125.669 126.459 -0.790 25881
3275 1 13 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.766 0.112 25881
3276 1 13 . 1 1 41 41 HIS C C 41 174.640 174.640 174.510 0.130 25881
3277 1 13 . 1 1 41 41 HIS CA C 41 52.900 52.900 55.720 -2.820 25881
3278 1 13 . 1 1 41 41 HIS CB C 41 30.067 30.067 32.178 -2.111 25881
3279 1 13 . 1 1 41 41 HIS H H 41 8.512 8.512 8.664 -0.152 25881
3280 1 13 . 1 1 42 42 LYS N N 42 123.564 123.564 122.583 0.981 25881
3281 1 13 . 1 1 42 42 LYS C C 42 176.739 176.739 175.552 1.187 25881
3282 1 13 . 1 1 42 42 LYS CA C 42 56.320 56.320 55.860 0.460 25881
3283 1 13 . 1 1 42 42 LYS CB C 42 33.229 33.229 33.065 0.165 25881
3284 1 13 . 1 1 42 42 LYS H H 42 8.668 8.668 8.546 0.122 25881
3285 1 13 . 1 1 43 43 GLU N N 43 122.633 122.633 118.768 3.865 25881
3286 1 13 . 1 1 43 43 GLU HA H 43 4.110 4.110 3.939 0.171 25881
3287 1 13 . 1 1 43 43 GLU C C 43 176.569 176.569 175.604 0.965 25881
3288 1 13 . 1 1 43 43 GLU CA C 43 57.097 57.097 56.948 0.149 25881
3289 1 13 . 1 1 43 43 GLU CB C 43 29.948 29.948 27.977 1.971 25881
3290 1 13 . 1 1 43 43 GLU H H 43 8.590 8.590 8.450 0.140 25881
3291 1 13 . 1 1 44 44 SER N N 44 115.147 115.147 111.141 4.006 25881
3292 1 13 . 1 1 44 44 SER HA H 44 4.268 4.268 4.120 0.148 25881
3293 1 13 . 1 1 44 44 SER C C 44 174.336 174.336 174.211 0.125 25881
3294 1 13 . 1 1 44 44 SER CA C 44 58.348 58.348 59.014 -0.666 25881
3295 1 13 . 1 1 44 44 SER CB C 44 63.724 63.724 63.567 0.157 25881
3296 1 13 . 1 1 44 44 SER H H 44 8.105 8.105 8.190 -0.085 25881
3297 1 13 . 1 1 45 45 GLU N N 45 122.849 122.849 121.935 0.914 25881
3298 1 13 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.212 -0.049 25881
3299 1 13 . 1 1 45 45 GLU C C 45 175.304 175.304 176.059 -0.755 25881
3300 1 13 . 1 1 45 45 GLU CA C 45 56.412 56.412 56.345 0.067 25881
3301 1 13 . 1 1 45 45 GLU CB C 45 30.130 30.130 28.863 1.267 25881
3302 1 13 . 1 1 45 45 GLU H H 45 8.183 8.183 8.645 -0.462 25881
3303 1 14 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.294 -0.001 25881
3304 1 14 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 63.669 -0.667 25881
3305 1 14 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 31.785 0.433 25881
3306 1 14 . 1 1 1 1 MET HA H 1 3.967 3.967 4.688 -0.721 25881
3307 1 14 . 1 1 1 1 MET CA C 1 57.335 57.335 54.928 2.407 25881
3308 1 14 . 1 1 1 1 MET CB C 1 34.180 34.180 35.531 -1.351 25881
3309 1 14 . 1 1 2 2 VAL C C 2 175.654 175.654 176.223 -0.569 25881
3310 1 14 . 1 1 2 2 VAL CA C 2 55.183 55.183 62.628 -7.445 25881
3311 1 14 . 1 1 2 2 VAL CB C 2 33.173 33.173 31.894 1.279 25881
3312 1 14 . 1 1 3 3 SER N N 3 121.996 121.996 114.768 7.228 25881
3313 1 14 . 1 1 3 3 SER HA H 3 4.323 4.323 4.275 0.048 25881
3314 1 14 . 1 1 3 3 SER C C 3 176.021 176.021 174.157 1.864 25881
3315 1 14 . 1 1 3 3 SER CA C 3 62.208 62.208 59.370 2.838 25881
3316 1 14 . 1 1 3 3 SER H H 3 8.103 8.103 8.369 -0.266 25881
3317 1 14 . 1 1 4 4 SER N N 4 119.715 119.715 115.937 3.778 25881
3318 1 14 . 1 1 4 4 SER HA H 4 4.317 4.317 4.470 -0.153 25881
3319 1 14 . 1 1 4 4 SER C C 4 174.010 174.010 174.272 -0.262 25881
3320 1 14 . 1 1 4 4 SER CA C 4 58.177 58.177 58.697 -0.520 25881
3321 1 14 . 1 1 4 4 SER CB C 4 63.763 63.763 63.145 0.618 25881
3322 1 14 . 1 1 4 4 SER H H 4 8.298 8.298 8.280 0.018 25881
3323 1 14 . 1 1 5 5 ALA N N 5 126.016 126.016 122.665 3.351 25881
3324 1 14 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.589 -0.420 25881
3325 1 14 . 1 1 5 5 ALA C C 5 177.297 177.297 176.103 1.194 25881
3326 1 14 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.240 1.144 25881
3327 1 14 . 1 1 5 5 ALA CB C 5 19.106 19.106 20.280 -1.174 25881
3328 1 14 . 1 1 5 5 ALA H H 5 8.119 8.119 7.308 0.811 25881
3329 1 14 . 1 1 6 6 VAL N N 6 119.174 119.174 118.132 1.042 25881
3330 1 14 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.341 -0.393 25881
3331 1 14 . 1 1 6 6 VAL C C 6 175.743 175.743 174.420 1.323 25881
3332 1 14 . 1 1 6 6 VAL CA C 6 61.668 61.668 61.029 0.639 25881
3333 1 14 . 1 1 6 6 VAL CB C 6 32.841 32.841 35.010 -2.169 25881
3334 1 14 . 1 1 6 6 VAL H H 6 7.861 7.861 8.227 -0.366 25881
3335 1 14 . 1 1 7 7 LYS N N 7 123.999 123.999 124.702 -0.703 25881
3336 1 14 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.694 -0.527 25881
3337 1 14 . 1 1 7 7 LYS C C 7 175.665 175.665 176.026 -0.361 25881
3338 1 14 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.034 1.256 25881
3339 1 14 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.021 0.520 25881
3340 1 14 . 1 1 7 7 LYS H H 7 8.054 8.054 8.325 -0.271 25881
3341 1 14 . 1 1 8 8 CYS N N 8 121.428 121.428 121.752 -0.324 25881
3342 1 14 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.412 -0.769 25881
3343 1 14 . 1 1 8 8 CYS C C 8 177.383 177.383 176.187 1.196 25881
3344 1 14 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.806 -0.040 25881
3345 1 14 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.594 4.315 25881
3346 1 14 . 1 1 8 8 CYS H H 8 8.539 8.539 8.918 -0.379 25881
3347 1 14 . 1 1 9 9 GLY N N 9 118.862 118.862 116.623 2.239 25881
3348 1 14 . 1 1 9 9 GLY C C 9 172.770 172.770 174.518 -1.748 25881
3349 1 14 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.799 0.345 25881
3350 1 14 . 1 1 9 9 GLY H H 9 9.365 9.365 8.815 0.550 25881
3351 1 14 . 1 1 10 10 ILE N N 10 122.885 122.885 118.924 3.961 25881
3352 1 14 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.205 -0.223 25881
3353 1 14 . 1 1 10 10 ILE C C 10 175.980 175.980 175.991 -0.011 25881
3354 1 14 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.625 0.431 25881
3355 1 14 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.102 -1.158 25881
3356 1 14 . 1 1 10 10 ILE H H 10 8.972 8.972 7.339 1.633 25881
3357 1 14 . 1 1 11 11 CYS N N 11 118.245 118.245 114.149 4.096 25881
3358 1 14 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.881 -0.232 25881
3359 1 14 . 1 1 11 11 CYS C C 11 176.780 176.780 175.101 1.679 25881
3360 1 14 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.900 1.194 25881
3361 1 14 . 1 1 11 11 CYS CB C 11 31.972 31.972 30.713 1.259 25881
3362 1 14 . 1 1 11 11 CYS H H 11 8.466 8.466 7.747 0.719 25881
3363 1 14 . 1 1 12 12 ARG N N 12 116.067 116.067 119.370 -3.303 25881
3364 1 14 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.125 0.091 25881
3365 1 14 . 1 1 12 12 ARG C C 12 175.637 175.637 176.477 -0.840 25881
3366 1 14 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.996 0.964 25881
3367 1 14 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.887 0.217 25881
3368 1 14 . 1 1 12 12 ARG H H 12 7.255 7.255 8.536 -1.281 25881
3369 1 14 . 1 1 13 13 GLY N N 13 109.951 109.951 107.229 2.722 25881
3370 1 14 . 1 1 13 13 GLY C C 13 173.169 173.169 174.182 -1.013 25881
3371 1 14 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.885 -1.581 25881
3372 1 14 . 1 1 13 13 GLY H H 13 8.795 8.795 7.888 0.907 25881
3373 1 14 . 1 1 14 14 VAL N N 14 113.644 113.644 115.430 -1.786 25881
3374 1 14 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.595 -0.551 25881
3375 1 14 . 1 1 14 14 VAL C C 14 174.970 174.970 174.595 0.375 25881
3376 1 14 . 1 1 14 14 VAL CA C 14 61.231 61.231 59.462 1.769 25881
3377 1 14 . 1 1 14 14 VAL CB C 14 33.838 33.838 34.252 -0.414 25881
3378 1 14 . 1 1 14 14 VAL H H 14 7.266 7.266 7.840 -0.574 25881
3379 1 14 . 1 1 15 15 ASP N N 15 119.913 119.913 119.060 0.853 25881
3380 1 14 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.676 -0.445 25881
3381 1 14 . 1 1 15 15 ASP C C 15 176.279 176.279 176.737 -0.458 25881
3382 1 14 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.676 0.347 25881
3383 1 14 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.796 -0.849 25881
3384 1 14 . 1 1 15 15 ASP H H 15 8.223 8.223 8.388 -0.165 25881
3385 1 14 . 1 1 16 16 GLY N N 16 109.534 109.534 107.066 2.468 25881
3386 1 14 . 1 1 16 16 GLY C C 16 173.120 173.120 174.868 -1.748 25881
3387 1 14 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.116 1.980 25881
3388 1 14 . 1 1 16 16 GLY H H 16 8.617 8.617 8.790 -0.173 25881
3389 1 14 . 1 1 17 17 LYS N N 17 121.534 121.534 122.930 -1.396 25881
3390 1 14 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.011 -0.366 25881
3391 1 14 . 1 1 17 17 LYS C C 17 175.029 175.029 177.134 -2.105 25881
3392 1 14 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.305 -0.794 25881
3393 1 14 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.620 0.524 25881
3394 1 14 . 1 1 17 17 LYS H H 17 7.318 7.318 7.725 -0.407 25881
3395 1 14 . 1 1 18 18 TYR N N 18 119.391 119.391 120.229 -0.838 25881
3396 1 14 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.594 -0.142 25881
3397 1 14 . 1 1 18 18 TYR C C 18 174.241 174.241 174.839 -0.598 25881
3398 1 14 . 1 1 18 18 TYR CA C 18 55.548 55.548 58.000 -2.452 25881
3399 1 14 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.381 -1.885 25881
3400 1 14 . 1 1 18 18 TYR H H 18 7.661 7.661 8.039 -0.378 25881
3401 1 14 . 1 1 19 19 LYS N N 19 120.140 120.140 122.529 -2.389 25881
3402 1 14 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.486 0.455 25881
3403 1 14 . 1 1 19 19 LYS C C 19 176.321 176.321 174.382 1.939 25881
3404 1 14 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.132 0.432 25881
3405 1 14 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.884 0.134 25881
3406 1 14 . 1 1 19 19 LYS H H 19 8.395 8.395 8.219 0.176 25881
3407 1 14 . 1 1 20 20 CYS N N 20 131.127 131.127 124.805 6.322 25881
3408 1 14 . 1 1 20 20 CYS HA H 20 4.931 4.931 4.992 -0.061 25881
3409 1 14 . 1 1 20 20 CYS C C 20 176.321 176.321 174.035 2.286 25881
3410 1 14 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.597 1.694 25881
3411 1 14 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.781 4.085 25881
3412 1 14 . 1 1 20 20 CYS H H 20 9.391 9.391 8.517 0.874 25881
3413 1 14 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.394 0.006 25881
3414 1 14 . 1 1 21 21 PRO C C 21 176.764 176.764 176.559 0.205 25881
3415 1 14 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.438 -0.003 25881
3416 1 14 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.509 0.816 25881
3417 1 14 . 1 1 22 22 LYS N N 22 120.217 120.217 118.985 1.232 25881
3418 1 14 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.383 -0.185 25881
3419 1 14 . 1 1 22 22 LYS C C 22 176.798 176.798 177.709 -0.911 25881
3420 1 14 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.341 0.286 25881
3421 1 14 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.715 0.547 25881
3422 1 14 . 1 1 22 22 LYS H H 22 8.550 8.550 8.177 0.373 25881
3423 1 14 . 1 1 23 23 CYS N N 23 115.450 115.450 114.501 0.949 25881
3424 1 14 . 1 1 23 23 CYS HA H 23 4.987 4.987 5.027 -0.040 25881
3425 1 14 . 1 1 23 23 CYS C C 23 176.434 176.434 176.685 -0.251 25881
3426 1 14 . 1 1 23 23 CYS CA C 23 58.155 58.155 57.992 0.163 25881
3427 1 14 . 1 1 23 23 CYS CB C 23 32.482 32.482 30.097 2.385 25881
3428 1 14 . 1 1 23 23 CYS H H 23 7.886 7.886 8.070 -0.184 25881
3429 1 14 . 1 1 24 24 GLY N N 24 112.961 112.961 110.673 2.288 25881
3430 1 14 . 1 1 24 24 GLY C C 24 173.369 173.369 173.707 -0.338 25881
3431 1 14 . 1 1 24 24 GLY CA C 24 46.152 46.152 45.123 1.029 25881
3432 1 14 . 1 1 24 24 GLY H H 24 7.958 7.958 8.280 -0.322 25881
3433 1 14 . 1 1 25 25 VAL N N 25 123.968 123.968 119.839 4.129 25881
3434 1 14 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.107 -0.128 25881
3435 1 14 . 1 1 25 25 VAL C C 25 173.934 173.934 174.485 -0.551 25881
3436 1 14 . 1 1 25 25 VAL CA C 25 63.136 63.136 60.888 2.248 25881
3437 1 14 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.545 -1.586 25881
3438 1 14 . 1 1 25 25 VAL H H 25 8.348 8.348 7.300 1.048 25881
3439 1 14 . 1 1 26 26 ARG N N 26 125.641 125.641 124.269 1.372 25881
3440 1 14 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.593 0.667 25881
3441 1 14 . 1 1 26 26 ARG C C 26 177.008 177.008 175.443 1.565 25881
3442 1 14 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.618 -0.290 25881
3443 1 14 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.495 -2.172 25881
3444 1 14 . 1 1 26 26 ARG H H 26 8.379 8.379 8.221 0.158 25881
3445 1 14 . 1 1 27 27 TYR N N 27 117.706 117.706 118.310 -0.604 25881
3446 1 14 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.064 1.629 25881
3447 1 14 . 1 1 27 27 TYR C C 27 175.404 175.404 176.301 -0.897 25881
3448 1 14 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.515 0.961 25881
3449 1 14 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.600 2.303 25881
3450 1 14 . 1 1 27 27 TYR H H 27 8.631 8.631 8.336 0.295 25881
3451 1 14 . 1 1 28 28 CYS N N 28 118.515 118.515 116.542 1.973 25881
3452 1 14 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.932 -0.027 25881
3453 1 14 . 1 1 28 28 CYS C C 28 176.186 176.186 174.969 1.217 25881
3454 1 14 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.941 -0.327 25881
3455 1 14 . 1 1 28 28 CYS CB C 28 34.827 34.827 28.126 6.701 25881
3456 1 14 . 1 1 28 28 CYS H H 28 8.817 8.817 8.392 0.425 25881
3457 1 14 . 1 1 29 29 SER N N 29 114.067 114.067 112.031 2.036 25881
3458 1 14 . 1 1 29 29 SER HA H 29 4.877 4.877 4.217 0.660 25881
3459 1 14 . 1 1 29 29 SER C C 29 178.077 178.077 173.839 4.238 25881
3460 1 14 . 1 1 29 29 SER CA C 29 57.260 57.260 56.953 0.307 25881
3461 1 14 . 1 1 29 29 SER CB C 29 65.051 65.051 64.743 0.308 25881
3462 1 14 . 1 1 29 29 SER H H 29 7.400 7.400 7.550 -0.150 25881
3463 1 14 . 1 1 30 30 LEU HA H 30 4.039 4.039 3.922 0.117 25881
3464 1 14 . 1 1 30 30 LEU C C 30 178.077 178.077 178.008 0.069 25881
3465 1 14 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.739 -0.288 25881
3466 1 14 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.418 -0.189 25881
3467 1 14 . 1 1 30 30 LEU H H 30 6.951 6.951 8.344 -1.393 25881
3468 1 14 . 1 1 31 31 LYS N N 31 118.534 118.534 117.719 0.815 25881
3469 1 14 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.038 -0.248 25881
3470 1 14 . 1 1 31 31 LYS C C 31 179.162 179.162 177.489 1.673 25881
3471 1 14 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.651 1.216 25881
3472 1 14 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.586 0.321 25881
3473 1 14 . 1 1 31 31 LYS H H 31 8.030 8.030 8.386 -0.356 25881
3474 1 14 . 1 1 32 32 CYS N N 32 118.700 118.700 116.034 2.666 25881
3475 1 14 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.676 -0.691 25881
3476 1 14 . 1 1 32 32 CYS C C 32 176.766 176.766 176.870 -0.104 25881
3477 1 14 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.492 6.188 25881
3478 1 14 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.909 1.640 25881
3479 1 14 . 1 1 32 32 CYS H H 32 7.424 7.424 7.591 -0.167 25881
3480 1 14 . 1 1 33 33 TYR N N 33 118.151 118.151 123.595 -5.444 25881
3481 1 14 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.189 -0.079 25881
3482 1 14 . 1 1 33 33 TYR C C 33 178.549 178.549 176.177 2.372 25881
3483 1 14 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.693 2.494 25881
3484 1 14 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.739 1.107 25881
3485 1 14 . 1 1 33 33 TYR H H 33 7.918 7.918 7.993 -0.075 25881
3486 1 14 . 1 1 34 34 LYS N N 34 114.631 114.631 117.832 -3.201 25881
3487 1 14 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.237 -0.315 25881
3488 1 14 . 1 1 34 34 LYS C C 34 174.991 174.991 175.461 -0.470 25881
3489 1 14 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.625 0.326 25881
3490 1 14 . 1 1 34 34 LYS CB C 34 32.145 32.145 30.998 1.147 25881
3491 1 14 . 1 1 34 34 LYS H H 34 7.939 7.939 7.848 0.091 25881
3492 1 14 . 1 1 35 35 ASP N N 35 121.194 121.194 119.407 1.787 25881
3493 1 14 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.741 -0.447 25881
3494 1 14 . 1 1 35 35 ASP C C 35 175.480 175.480 174.925 0.555 25881
3495 1 14 . 1 1 35 35 ASP CA C 35 54.339 54.339 52.911 1.428 25881
3496 1 14 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.506 -3.145 25881
3497 1 14 . 1 1 35 35 ASP H H 35 7.115 7.115 7.832 -0.717 25881
3498 1 14 . 1 1 36 36 ALA N N 36 130.311 130.311 125.161 5.150 25881
3499 1 14 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.926 -1.039 25881
3500 1 14 . 1 1 36 36 ALA C C 36 177.717 177.717 176.953 0.764 25881
3501 1 14 . 1 1 36 36 ALA CA C 36 53.526 53.526 52.244 1.282 25881
3502 1 14 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.097 -0.386 25881
3503 1 14 . 1 1 36 36 ALA H H 36 8.073 8.073 8.463 -0.390 25881
3504 1 14 . 1 1 37 37 ALA N N 37 117.133 117.133 121.050 -3.917 25881
3505 1 14 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.261 -0.175 25881
3506 1 14 . 1 1 37 37 ALA C C 37 178.989 178.989 178.814 0.175 25881
3507 1 14 . 1 1 37 37 ALA CA C 37 53.211 53.211 54.334 -1.123 25881
3508 1 14 . 1 1 37 37 ALA CB C 37 19.147 19.147 19.052 0.095 25881
3509 1 14 . 1 1 37 37 ALA H H 37 7.839 7.839 8.257 -0.418 25881
3510 1 14 . 1 1 38 38 LYS N N 38 114.127 114.127 116.162 -2.035 25881
3511 1 14 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.450 -0.155 25881
3512 1 14 . 1 1 38 38 LYS C C 38 175.690 175.690 177.362 -1.672 25881
3513 1 14 . 1 1 38 38 LYS CA C 38 56.203 56.203 57.158 -0.955 25881
3514 1 14 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.197 1.951 25881
3515 1 14 . 1 1 38 38 LYS H H 38 7.292 7.292 9.080 -1.788 25881
3516 1 14 . 1 1 39 39 HIS N N 39 122.110 122.110 121.544 0.566 25881
3517 1 14 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.540 0.223 25881
3518 1 14 . 1 1 39 39 HIS C C 39 171.783 171.783 173.543 -1.760 25881
3519 1 14 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.248 -2.613 25881
3520 1 14 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.432 -1.803 25881
3521 1 14 . 1 1 39 39 HIS H H 39 8.393 8.393 8.660 -0.267 25881
3522 1 14 . 1 1 40 40 VAL N N 40 123.393 123.393 127.441 -4.048 25881
3523 1 14 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.139 -0.392 25881
3524 1 14 . 1 1 40 40 VAL C C 40 175.292 175.292 175.531 -0.239 25881
3525 1 14 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.531 -0.367 25881
3526 1 14 . 1 1 40 40 VAL CB C 40 34.132 34.132 32.389 1.743 25881
3527 1 14 . 1 1 40 40 VAL H H 40 7.811 7.811 7.827 -0.016 25881
3528 1 14 . 1 1 41 41 HIS N N 41 125.669 125.669 126.299 -0.630 25881
3529 1 14 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.685 0.193 25881
3530 1 14 . 1 1 41 41 HIS C C 41 174.640 174.640 174.894 -0.254 25881
3531 1 14 . 1 1 41 41 HIS CA C 41 52.900 52.900 55.621 -2.721 25881
3532 1 14 . 1 1 41 41 HIS CB C 41 30.067 30.067 30.365 -0.298 25881
3533 1 14 . 1 1 41 41 HIS H H 41 8.512 8.512 8.576 -0.064 25881
3534 1 14 . 1 1 42 42 LYS N N 42 123.564 123.564 125.014 -1.450 25881
3535 1 14 . 1 1 42 42 LYS C C 42 176.739 176.739 176.526 0.213 25881
3536 1 14 . 1 1 42 42 LYS CA C 42 56.320 56.320 56.144 0.176 25881
3537 1 14 . 1 1 42 42 LYS CB C 42 33.229 33.229 33.360 -0.131 25881
3538 1 14 . 1 1 42 42 LYS H H 42 8.668 8.668 8.611 0.057 25881
3539 1 14 . 1 1 43 43 GLU N N 43 122.633 122.633 120.312 2.321 25881
3540 1 14 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.103 0.007 25881
3541 1 14 . 1 1 43 43 GLU C C 43 176.569 176.569 177.187 -0.618 25881
3542 1 14 . 1 1 43 43 GLU CA C 43 57.097 57.097 58.065 -0.968 25881
3543 1 14 . 1 1 43 43 GLU CB C 43 29.948 29.948 29.284 0.664 25881
3544 1 14 . 1 1 43 43 GLU H H 43 8.590 8.590 8.539 0.051 25881
3545 1 14 . 1 1 44 44 SER N N 44 115.147 115.147 115.232 -0.085 25881
3546 1 14 . 1 1 44 44 SER HA H 44 4.268 4.268 4.458 -0.190 25881
3547 1 14 . 1 1 44 44 SER C C 44 174.336 174.336 173.817 0.519 25881
3548 1 14 . 1 1 44 44 SER CA C 44 58.348 58.348 57.572 0.776 25881
3549 1 14 . 1 1 44 44 SER CB C 44 63.724 63.724 63.972 -0.248 25881
3550 1 14 . 1 1 44 44 SER H H 44 8.105 8.105 8.019 0.086 25881
3551 1 14 . 1 1 45 45 GLU N N 45 122.849 122.849 127.035 -4.186 25881
3552 1 14 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.291 -0.128 25881
3553 1 14 . 1 1 45 45 GLU C C 45 175.304 175.304 176.217 -0.913 25881
3554 1 14 . 1 1 45 45 GLU CA C 45 56.412 56.412 56.691 -0.279 25881
3555 1 14 . 1 1 45 45 GLU CB C 45 30.130 30.130 29.222 0.908 25881
3556 1 14 . 1 1 45 45 GLU H H 45 8.183 8.183 8.811 -0.628 25881
3557 1 15 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.393 -0.100 25881
3558 1 15 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 63.774 -0.772 25881
3559 1 15 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 32.295 -0.077 25881
3560 1 15 . 1 1 1 1 MET HA H 1 3.967 3.967 4.405 -0.438 25881
3561 1 15 . 1 1 1 1 MET CA C 1 57.335 57.335 55.321 2.014 25881
3562 1 15 . 1 1 1 1 MET CB C 1 34.180 34.180 33.245 0.935 25881
3563 1 15 . 1 1 2 2 VAL C C 2 175.654 175.654 176.785 -1.131 25881
3564 1 15 . 1 1 2 2 VAL CA C 2 55.183 55.183 64.569 -9.386 25881
3565 1 15 . 1 1 2 2 VAL CB C 2 33.173 33.173 31.496 1.677 25881
3566 1 15 . 1 1 3 3 SER N N 3 121.996 121.996 117.140 4.856 25881
3567 1 15 . 1 1 3 3 SER HA H 3 4.323 4.323 4.493 -0.170 25881
3568 1 15 . 1 1 3 3 SER C C 3 176.021 176.021 173.187 2.834 25881
3569 1 15 . 1 1 3 3 SER CA C 3 62.208 62.208 57.781 4.427 25881
3570 1 15 . 1 1 3 3 SER H H 3 8.103 8.103 8.164 -0.061 25881
3571 1 15 . 1 1 4 4 SER N N 4 119.715 119.715 117.791 1.924 25881
3572 1 15 . 1 1 4 4 SER HA H 4 4.317 4.317 4.243 0.074 25881
3573 1 15 . 1 1 4 4 SER C C 4 174.010 174.010 174.330 -0.320 25881
3574 1 15 . 1 1 4 4 SER CA C 4 58.177 58.177 58.668 -0.491 25881
3575 1 15 . 1 1 4 4 SER CB C 4 63.763 63.763 63.039 0.724 25881
3576 1 15 . 1 1 4 4 SER H H 4 8.298 8.298 7.733 0.565 25881
3577 1 15 . 1 1 5 5 ALA N N 5 126.016 126.016 128.045 -2.029 25881
3578 1 15 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.743 -0.574 25881
3579 1 15 . 1 1 5 5 ALA C C 5 177.297 177.297 175.574 1.723 25881
3580 1 15 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.628 0.756 25881
3581 1 15 . 1 1 5 5 ALA CB C 5 19.106 19.106 21.719 -2.613 25881
3582 1 15 . 1 1 5 5 ALA H H 5 8.119 8.119 8.300 -0.181 25881
3583 1 15 . 1 1 6 6 VAL N N 6 119.174 119.174 120.550 -1.376 25881
3584 1 15 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.415 -0.467 25881
3585 1 15 . 1 1 6 6 VAL C C 6 175.743 175.743 174.741 1.002 25881
3586 1 15 . 1 1 6 6 VAL CA C 6 61.668 61.668 60.614 1.054 25881
3587 1 15 . 1 1 6 6 VAL CB C 6 32.841 32.841 34.423 -1.582 25881
3588 1 15 . 1 1 6 6 VAL H H 6 7.861 7.861 8.590 -0.729 25881
3589 1 15 . 1 1 7 7 LYS N N 7 123.999 123.999 124.570 -0.571 25881
3590 1 15 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.640 -0.473 25881
3591 1 15 . 1 1 7 7 LYS C C 7 175.665 175.665 175.426 0.239 25881
3592 1 15 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.158 1.132 25881
3593 1 15 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.525 0.016 25881
3594 1 15 . 1 1 7 7 LYS H H 7 8.054 8.054 8.202 -0.148 25881
3595 1 15 . 1 1 8 8 CYS N N 8 121.428 121.428 122.454 -1.026 25881
3596 1 15 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.397 -0.754 25881
3597 1 15 . 1 1 8 8 CYS C C 8 177.383 177.383 176.816 0.567 25881
3598 1 15 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.778 -0.012 25881
3599 1 15 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.640 4.269 25881
3600 1 15 . 1 1 8 8 CYS H H 8 8.539 8.539 8.668 -0.129 25881
3601 1 15 . 1 1 9 9 GLY N N 9 118.862 118.862 116.440 2.422 25881
3602 1 15 . 1 1 9 9 GLY C C 9 172.770 172.770 175.130 -2.360 25881
3603 1 15 . 1 1 9 9 GLY CA C 9 46.144 46.144 46.309 -0.165 25881
3604 1 15 . 1 1 9 9 GLY H H 9 9.365 9.365 9.112 0.253 25881
3605 1 15 . 1 1 10 10 ILE N N 10 122.885 122.885 118.939 3.946 25881
3606 1 15 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.245 -0.263 25881
3607 1 15 . 1 1 10 10 ILE C C 10 175.980 175.980 175.587 0.393 25881
3608 1 15 . 1 1 10 10 ILE CA C 10 63.056 63.056 63.007 0.049 25881
3609 1 15 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.165 -1.221 25881
3610 1 15 . 1 1 10 10 ILE H H 10 8.972 8.972 7.399 1.573 25881
3611 1 15 . 1 1 11 11 CYS N N 11 118.245 118.245 113.513 4.732 25881
3612 1 15 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.738 -0.089 25881
3613 1 15 . 1 1 11 11 CYS C C 11 176.780 176.780 175.204 1.576 25881
3614 1 15 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.806 1.288 25881
3615 1 15 . 1 1 11 11 CYS CB C 11 31.972 31.972 29.900 2.072 25881
3616 1 15 . 1 1 11 11 CYS H H 11 8.466 8.466 7.582 0.883 25881
3617 1 15 . 1 1 12 12 ARG N N 12 116.067 116.067 120.564 -4.497 25881
3618 1 15 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.094 0.122 25881
3619 1 15 . 1 1 12 12 ARG C C 12 175.637 175.637 176.544 -0.907 25881
3620 1 15 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.698 1.262 25881
3621 1 15 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.991 0.113 25881
3622 1 15 . 1 1 12 12 ARG H H 12 7.255 7.255 8.540 -1.285 25881
3623 1 15 . 1 1 13 13 GLY N N 13 109.951 109.951 106.616 3.335 25881
3624 1 15 . 1 1 13 13 GLY C C 13 173.169 173.169 173.878 -0.709 25881
3625 1 15 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.748 -1.444 25881
3626 1 15 . 1 1 13 13 GLY H H 13 8.795 8.795 8.067 0.728 25881
3627 1 15 . 1 1 14 14 VAL N N 14 113.644 113.644 114.929 -1.285 25881
3628 1 15 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.762 -0.718 25881
3629 1 15 . 1 1 14 14 VAL C C 14 174.970 174.970 174.024 0.946 25881
3630 1 15 . 1 1 14 14 VAL CA C 14 61.231 61.231 59.210 2.021 25881
3631 1 15 . 1 1 14 14 VAL CB C 14 33.838 33.838 34.340 -0.502 25881
3632 1 15 . 1 1 14 14 VAL H H 14 7.266 7.266 7.587 -0.321 25881
3633 1 15 . 1 1 15 15 ASP N N 15 119.913 119.913 120.335 -0.422 25881
3634 1 15 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.671 -0.440 25881
3635 1 15 . 1 1 15 15 ASP C C 15 176.279 176.279 177.365 -1.086 25881
3636 1 15 . 1 1 15 15 ASP CA C 15 55.023 55.023 55.297 -0.274 25881
3637 1 15 . 1 1 15 15 ASP CB C 15 39.947 39.947 41.305 -1.358 25881
3638 1 15 . 1 1 15 15 ASP H H 15 8.223 8.223 8.492 -0.269 25881
3639 1 15 . 1 1 16 16 GLY N N 16 109.534 109.534 112.445 -2.911 25881
3640 1 15 . 1 1 16 16 GLY C C 16 173.120 173.120 174.731 -1.611 25881
3641 1 15 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.384 1.712 25881
3642 1 15 . 1 1 16 16 GLY H H 16 8.617 8.617 8.836 -0.219 25881
3643 1 15 . 1 1 17 17 LYS N N 17 121.534 121.534 123.460 -1.926 25881
3644 1 15 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.139 -0.494 25881
3645 1 15 . 1 1 17 17 LYS C C 17 175.029 175.029 176.935 -1.906 25881
3646 1 15 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.159 -0.648 25881
3647 1 15 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.695 0.449 25881
3648 1 15 . 1 1 17 17 LYS H H 17 7.318 7.318 7.780 -0.462 25881
3649 1 15 . 1 1 18 18 TYR N N 18 119.391 119.391 120.540 -1.149 25881
3650 1 15 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.554 -0.102 25881
3651 1 15 . 1 1 18 18 TYR C C 18 174.241 174.241 174.949 -0.708 25881
3652 1 15 . 1 1 18 18 TYR CA C 18 55.548 55.548 58.415 -2.867 25881
3653 1 15 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.254 -1.758 25881
3654 1 15 . 1 1 18 18 TYR H H 18 7.661 7.661 8.094 -0.433 25881
3655 1 15 . 1 1 19 19 LYS N N 19 120.140 120.140 122.102 -1.962 25881
3656 1 15 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.518 0.423 25881
3657 1 15 . 1 1 19 19 LYS C C 19 176.321 176.321 174.467 1.854 25881
3658 1 15 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.255 0.309 25881
3659 1 15 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.844 0.174 25881
3660 1 15 . 1 1 19 19 LYS H H 19 8.395 8.395 8.194 0.202 25881
3661 1 15 . 1 1 20 20 CYS N N 20 131.127 131.127 124.609 6.518 25881
3662 1 15 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.022 -0.091 25881
3663 1 15 . 1 1 20 20 CYS C C 20 176.321 176.321 174.076 2.245 25881
3664 1 15 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.592 1.700 25881
3665 1 15 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.865 4.001 25881
3666 1 15 . 1 1 20 20 CYS H H 20 9.391 9.391 8.656 0.735 25881
3667 1 15 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.361 0.039 25881
3668 1 15 . 1 1 21 21 PRO C C 21 176.764 176.764 176.914 -0.150 25881
3669 1 15 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.692 -0.257 25881
3670 1 15 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.667 0.658 25881
3671 1 15 . 1 1 22 22 LYS N N 22 120.217 120.217 118.911 1.306 25881
3672 1 15 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.318 -0.120 25881
3673 1 15 . 1 1 22 22 LYS C C 22 176.798 176.798 177.841 -1.043 25881
3674 1 15 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.564 0.063 25881
3675 1 15 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.363 0.899 25881
3676 1 15 . 1 1 22 22 LYS H H 22 8.550 8.550 8.539 0.011 25881
3677 1 15 . 1 1 23 23 CYS N N 23 115.450 115.450 113.612 1.838 25881
3678 1 15 . 1 1 23 23 CYS HA H 23 4.987 4.987 5.006 -0.019 25881
3679 1 15 . 1 1 23 23 CYS C C 23 176.434 176.434 176.312 0.122 25881
3680 1 15 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.544 -0.390 25881
3681 1 15 . 1 1 23 23 CYS CB C 23 32.482 32.482 30.592 1.890 25881
3682 1 15 . 1 1 23 23 CYS H H 23 7.886 7.886 8.259 -0.373 25881
3683 1 15 . 1 1 24 24 GLY N N 24 112.961 112.961 110.063 2.898 25881
3684 1 15 . 1 1 24 24 GLY C C 24 173.369 173.369 173.861 -0.492 25881
3685 1 15 . 1 1 24 24 GLY CA C 24 46.152 46.152 44.935 1.217 25881
3686 1 15 . 1 1 24 24 GLY H H 24 7.958 7.958 8.387 -0.429 25881
3687 1 15 . 1 1 25 25 VAL N N 25 123.968 123.968 120.901 3.067 25881
3688 1 15 . 1 1 25 25 VAL HA H 25 3.979 3.979 3.948 0.031 25881
3689 1 15 . 1 1 25 25 VAL C C 25 173.934 173.934 174.238 -0.304 25881
3690 1 15 . 1 1 25 25 VAL CA C 25 63.136 63.136 61.572 1.564 25881
3691 1 15 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.204 -1.245 25881
3692 1 15 . 1 1 25 25 VAL H H 25 8.348 8.348 7.178 1.170 25881
3693 1 15 . 1 1 26 26 ARG N N 26 125.641 125.641 125.464 0.177 25881
3694 1 15 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.670 0.590 25881
3695 1 15 . 1 1 26 26 ARG C C 26 177.008 177.008 175.283 1.725 25881
3696 1 15 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.773 -0.445 25881
3697 1 15 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.356 -2.033 25881
3698 1 15 . 1 1 26 26 ARG H H 26 8.379 8.379 8.373 0.006 25881
3699 1 15 . 1 1 27 27 TYR N N 27 117.706 117.706 118.956 -1.250 25881
3700 1 15 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.068 1.625 25881
3701 1 15 . 1 1 27 27 TYR C C 27 175.404 175.404 176.427 -1.023 25881
3702 1 15 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.243 1.233 25881
3703 1 15 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.646 2.257 25881
3704 1 15 . 1 1 27 27 TYR H H 27 8.631 8.631 8.174 0.457 25881
3705 1 15 . 1 1 28 28 CYS N N 28 118.515 118.515 116.625 1.890 25881
3706 1 15 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.942 -0.037 25881
3707 1 15 . 1 1 28 28 CYS C C 28 176.186 176.186 175.268 0.918 25881
3708 1 15 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.785 -0.171 25881
3709 1 15 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.933 6.894 25881
3710 1 15 . 1 1 28 28 CYS H H 28 8.817 8.817 8.412 0.405 25881
3711 1 15 . 1 1 29 29 SER N N 29 114.067 114.067 112.482 1.585 25881
3712 1 15 . 1 1 29 29 SER HA H 29 4.877 4.877 4.349 0.528 25881
3713 1 15 . 1 1 29 29 SER C C 29 178.077 178.077 173.717 4.360 25881
3714 1 15 . 1 1 29 29 SER CA C 29 57.260 57.260 57.114 0.145 25881
3715 1 15 . 1 1 29 29 SER CB C 29 65.051 65.051 64.490 0.561 25881
3716 1 15 . 1 1 29 29 SER H H 29 7.400 7.400 7.600 -0.200 25881
3717 1 15 . 1 1 30 30 LEU HA H 30 4.039 4.039 3.950 0.089 25881
3718 1 15 . 1 1 30 30 LEU C C 30 178.077 178.077 177.939 0.138 25881
3719 1 15 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.599 -0.148 25881
3720 1 15 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.542 -0.313 25881
3721 1 15 . 1 1 30 30 LEU H H 30 6.951 6.951 8.361 -1.410 25881
3722 1 15 . 1 1 31 31 LYS N N 31 118.534 118.534 117.876 0.658 25881
3723 1 15 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.030 -0.240 25881
3724 1 15 . 1 1 31 31 LYS C C 31 179.162 179.162 177.512 1.650 25881
3725 1 15 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.699 1.169 25881
3726 1 15 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.574 0.333 25881
3727 1 15 . 1 1 31 31 LYS H H 31 8.030 8.030 8.390 -0.360 25881
3728 1 15 . 1 1 32 32 CYS N N 32 118.700 118.700 116.165 2.535 25881
3729 1 15 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.646 -0.661 25881
3730 1 15 . 1 1 32 32 CYS C C 32 176.766 176.766 176.903 -0.137 25881
3731 1 15 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.587 6.093 25881
3732 1 15 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.683 1.867 25881
3733 1 15 . 1 1 32 32 CYS H H 32 7.424 7.424 7.589 -0.165 25881
3734 1 15 . 1 1 33 33 TYR N N 33 118.151 118.151 123.505 -5.354 25881
3735 1 15 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.415 -0.305 25881
3736 1 15 . 1 1 33 33 TYR C C 33 178.549 178.549 176.145 2.404 25881
3737 1 15 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.593 2.594 25881
3738 1 15 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.787 1.059 25881
3739 1 15 . 1 1 33 33 TYR H H 33 7.918 7.918 7.779 0.139 25881
3740 1 15 . 1 1 34 34 LYS N N 34 114.631 114.631 117.910 -3.279 25881
3741 1 15 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.289 -0.367 25881
3742 1 15 . 1 1 34 34 LYS C C 34 174.991 174.991 175.433 -0.442 25881
3743 1 15 . 1 1 34 34 LYS CA C 34 55.951 55.951 56.225 -0.274 25881
3744 1 15 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.150 0.995 25881
3745 1 15 . 1 1 34 34 LYS H H 34 7.939 7.939 7.893 0.046 25881
3746 1 15 . 1 1 35 35 ASP N N 35 121.194 121.194 119.801 1.393 25881
3747 1 15 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.756 -0.462 25881
3748 1 15 . 1 1 35 35 ASP C C 35 175.480 175.480 174.861 0.619 25881
3749 1 15 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.056 1.284 25881
3750 1 15 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.419 -3.058 25881
3751 1 15 . 1 1 35 35 ASP H H 35 7.115 7.115 7.860 -0.745 25881
3752 1 15 . 1 1 36 36 ALA N N 36 130.311 130.311 125.908 4.403 25881
3753 1 15 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.890 -1.003 25881
3754 1 15 . 1 1 36 36 ALA C C 36 177.717 177.717 176.786 0.931 25881
3755 1 15 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.337 2.189 25881
3756 1 15 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.734 -1.023 25881
3757 1 15 . 1 1 36 36 ALA H H 36 8.073 8.073 8.513 -0.440 25881
3758 1 15 . 1 1 37 37 ALA N N 37 117.133 117.133 122.499 -5.366 25881
3759 1 15 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.295 -0.209 25881
3760 1 15 . 1 1 37 37 ALA C C 37 178.989 178.989 178.647 0.342 25881
3761 1 15 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.745 -0.534 25881
3762 1 15 . 1 1 37 37 ALA CB C 37 19.147 19.147 19.912 -0.765 25881
3763 1 15 . 1 1 37 37 ALA H H 37 7.839 7.839 8.211 -0.372 25881
3764 1 15 . 1 1 38 38 LYS N N 38 114.127 114.127 115.281 -1.154 25881
3765 1 15 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.504 -0.209 25881
3766 1 15 . 1 1 38 38 LYS C C 38 175.690 175.690 176.941 -1.251 25881
3767 1 15 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.601 -0.398 25881
3768 1 15 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.241 1.907 25881
3769 1 15 . 1 1 38 38 LYS H H 38 7.292 7.292 8.829 -1.537 25881
3770 1 15 . 1 1 39 39 HIS N N 39 122.110 122.110 121.716 0.394 25881
3771 1 15 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.562 0.201 25881
3772 1 15 . 1 1 39 39 HIS C C 39 171.783 171.783 173.663 -1.880 25881
3773 1 15 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.178 -2.543 25881
3774 1 15 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.811 -2.182 25881
3775 1 15 . 1 1 39 39 HIS H H 39 8.393 8.393 7.744 0.649 25881
3776 1 15 . 1 1 40 40 VAL N N 40 123.393 123.393 127.197 -3.804 25881
3777 1 15 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.070 -0.323 25881
3778 1 15 . 1 1 40 40 VAL C C 40 175.292 175.292 175.508 -0.216 25881
3779 1 15 . 1 1 40 40 VAL CA C 40 61.164 61.164 62.486 -1.322 25881
3780 1 15 . 1 1 40 40 VAL CB C 40 34.132 34.132 32.404 1.728 25881
3781 1 15 . 1 1 40 40 VAL H H 40 7.811 7.811 8.677 -0.866 25881
3782 1 15 . 1 1 41 41 HIS N N 41 125.669 125.669 126.811 -1.142 25881
3783 1 15 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.551 0.327 25881
3784 1 15 . 1 1 41 41 HIS C C 41 174.640 174.640 175.419 -0.779 25881
3785 1 15 . 1 1 41 41 HIS CA C 41 52.900 52.900 56.129 -3.229 25881
3786 1 15 . 1 1 41 41 HIS CB C 41 30.067 30.067 31.462 -1.395 25881
3787 1 15 . 1 1 41 41 HIS H H 41 8.512 8.512 8.742 -0.230 25881
3788 1 15 . 1 1 42 42 LYS N N 42 123.564 123.564 118.409 5.155 25881
3789 1 15 . 1 1 42 42 LYS C C 42 176.739 176.739 175.125 1.614 25881
3790 1 15 . 1 1 42 42 LYS CA C 42 56.320 56.320 56.382 -0.062 25881
3791 1 15 . 1 1 42 42 LYS CB C 42 33.229 33.229 33.346 -0.117 25881
3792 1 15 . 1 1 42 42 LYS H H 42 8.668 8.668 8.282 0.386 25881
3793 1 15 . 1 1 43 43 GLU N N 43 122.633 122.633 120.186 2.447 25881
3794 1 15 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.521 -0.411 25881
3795 1 15 . 1 1 43 43 GLU C C 43 176.569 176.569 175.747 0.822 25881
3796 1 15 . 1 1 43 43 GLU CA C 43 57.097 57.097 55.817 1.280 25881
3797 1 15 . 1 1 43 43 GLU CB C 43 29.948 29.948 31.013 -1.065 25881
3798 1 15 . 1 1 43 43 GLU H H 43 8.590 8.590 7.997 0.593 25881
3799 1 15 . 1 1 44 44 SER N N 44 115.147 115.147 118.370 -3.223 25881
3800 1 15 . 1 1 44 44 SER HA H 44 4.268 4.268 4.182 0.086 25881
3801 1 15 . 1 1 44 44 SER C C 44 174.336 174.336 174.562 -0.226 25881
3802 1 15 . 1 1 44 44 SER CA C 44 58.348 58.348 59.091 -0.743 25881
3803 1 15 . 1 1 44 44 SER CB C 44 63.724 63.724 63.063 0.661 25881
3804 1 15 . 1 1 44 44 SER H H 44 8.105 8.105 8.910 -0.805 25881
3805 1 15 . 1 1 45 45 GLU N N 45 122.849 122.849 117.625 5.224 25881
3806 1 15 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.439 -0.276 25881
3807 1 15 . 1 1 45 45 GLU C C 45 175.304 175.304 175.742 -0.438 25881
3808 1 15 . 1 1 45 45 GLU CA C 45 56.412 56.412 56.369 0.043 25881
3809 1 15 . 1 1 45 45 GLU CB C 45 30.130 30.130 28.273 1.857 25881
3810 1 15 . 1 1 45 45 GLU H H 45 8.183 8.183 8.557 -0.374 25881
3811 1 16 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.253 0.040 25881
3812 1 16 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 63.163 -0.161 25881
3813 1 16 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 32.072 0.146 25881
3814 1 16 . 1 1 1 1 MET HA H 1 3.967 3.967 4.487 -0.520 25881
3815 1 16 . 1 1 1 1 MET CA C 1 57.335 57.335 54.795 2.540 25881
3816 1 16 . 1 1 1 1 MET CB C 1 34.180 34.180 33.142 1.038 25881
3817 1 16 . 1 1 2 2 VAL C C 2 175.654 175.654 174.741 0.913 25881
3818 1 16 . 1 1 2 2 VAL CA C 2 55.183 55.183 62.984 -7.801 25881
3819 1 16 . 1 1 2 2 VAL CB C 2 33.173 33.173 30.146 3.027 25881
3820 1 16 . 1 1 3 3 SER N N 3 121.996 121.996 117.672 4.324 25881
3821 1 16 . 1 1 3 3 SER HA H 3 4.323 4.323 4.815 -0.492 25881
3822 1 16 . 1 1 3 3 SER C C 3 176.021 176.021 174.436 1.585 25881
3823 1 16 . 1 1 3 3 SER CA C 3 62.208 62.208 57.795 4.413 25881
3824 1 16 . 1 1 3 3 SER H H 3 8.103 8.103 8.201 -0.098 25881
3825 1 16 . 1 1 4 4 SER N N 4 119.715 119.715 119.015 0.700 25881
3826 1 16 . 1 1 4 4 SER HA H 4 4.317 4.317 4.614 -0.297 25881
3827 1 16 . 1 1 4 4 SER C C 4 174.010 174.010 173.580 0.430 25881
3828 1 16 . 1 1 4 4 SER CA C 4 58.177 58.177 58.489 -0.312 25881
3829 1 16 . 1 1 4 4 SER CB C 4 63.763 63.763 63.904 -0.140 25881
3830 1 16 . 1 1 4 4 SER H H 4 8.298 8.298 8.747 -0.449 25881
3831 1 16 . 1 1 5 5 ALA N N 5 126.016 126.016 124.149 1.867 25881
3832 1 16 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.669 -0.500 25881
3833 1 16 . 1 1 5 5 ALA C C 5 177.297 177.297 176.230 1.067 25881
3834 1 16 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.474 0.909 25881
3835 1 16 . 1 1 5 5 ALA CB C 5 19.106 19.106 20.703 -1.597 25881
3836 1 16 . 1 1 5 5 ALA H H 5 8.119 8.119 7.471 0.648 25881
3837 1 16 . 1 1 6 6 VAL N N 6 119.174 119.174 121.223 -2.049 25881
3838 1 16 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.352 -0.404 25881
3839 1 16 . 1 1 6 6 VAL C C 6 175.743 175.743 175.066 0.677 25881
3840 1 16 . 1 1 6 6 VAL CA C 6 61.668 61.668 60.942 0.726 25881
3841 1 16 . 1 1 6 6 VAL CB C 6 32.841 32.841 33.824 -0.983 25881
3842 1 16 . 1 1 6 6 VAL H H 6 7.861 7.861 8.511 -0.650 25881
3843 1 16 . 1 1 7 7 LYS N N 7 123.999 123.999 124.985 -0.986 25881
3844 1 16 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.702 -0.535 25881
3845 1 16 . 1 1 7 7 LYS C C 7 175.665 175.665 175.979 -0.314 25881
3846 1 16 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.116 1.174 25881
3847 1 16 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.948 -0.407 25881
3848 1 16 . 1 1 7 7 LYS H H 7 8.054 8.054 8.208 -0.154 25881
3849 1 16 . 1 1 8 8 CYS N N 8 121.428 121.428 122.302 -0.874 25881
3850 1 16 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.419 -0.776 25881
3851 1 16 . 1 1 8 8 CYS C C 8 177.383 177.383 176.112 1.271 25881
3852 1 16 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.619 0.147 25881
3853 1 16 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.580 4.329 25881
3854 1 16 . 1 1 8 8 CYS H H 8 8.539 8.539 8.837 -0.298 25881
3855 1 16 . 1 1 9 9 GLY N N 9 118.862 118.862 115.948 2.914 25881
3856 1 16 . 1 1 9 9 GLY C C 9 172.770 172.770 175.228 -2.458 25881
3857 1 16 . 1 1 9 9 GLY CA C 9 46.144 46.144 46.057 0.087 25881
3858 1 16 . 1 1 9 9 GLY H H 9 9.365 9.365 8.904 0.461 25881
3859 1 16 . 1 1 10 10 ILE N N 10 122.885 122.885 118.605 4.280 25881
3860 1 16 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.169 -0.187 25881
3861 1 16 . 1 1 10 10 ILE C C 10 175.980 175.980 175.146 0.834 25881
3862 1 16 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.820 0.236 25881
3863 1 16 . 1 1 10 10 ILE CB C 10 37.944 37.944 38.905 -0.961 25881
3864 1 16 . 1 1 10 10 ILE H H 10 8.972 8.972 7.313 1.659 25881
3865 1 16 . 1 1 11 11 CYS N N 11 118.245 118.245 113.052 5.193 25881
3866 1 16 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.853 -0.204 25881
3867 1 16 . 1 1 11 11 CYS C C 11 176.780 176.780 175.091 1.689 25881
3868 1 16 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.715 1.379 25881
3869 1 16 . 1 1 11 11 CYS CB C 11 31.972 31.972 30.018 1.954 25881
3870 1 16 . 1 1 11 11 CYS H H 11 8.466 8.466 7.620 0.846 25881
3871 1 16 . 1 1 12 12 ARG N N 12 116.067 116.067 120.337 -4.270 25881
3872 1 16 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.152 0.064 25881
3873 1 16 . 1 1 12 12 ARG C C 12 175.637 175.637 176.359 -0.722 25881
3874 1 16 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.664 1.296 25881
3875 1 16 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.694 0.410 25881
3876 1 16 . 1 1 12 12 ARG H H 12 7.255 7.255 8.458 -1.203 25881
3877 1 16 . 1 1 13 13 GLY N N 13 109.951 109.951 107.326 2.625 25881
3878 1 16 . 1 1 13 13 GLY C C 13 173.169 173.169 173.718 -0.549 25881
3879 1 16 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.819 -1.515 25881
3880 1 16 . 1 1 13 13 GLY H H 13 8.795 8.795 8.063 0.732 25881
3881 1 16 . 1 1 14 14 VAL N N 14 113.644 113.644 116.424 -2.780 25881
3882 1 16 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.665 -0.621 25881
3883 1 16 . 1 1 14 14 VAL C C 14 174.970 174.970 174.432 0.538 25881
3884 1 16 . 1 1 14 14 VAL CA C 14 61.231 61.231 59.377 1.854 25881
3885 1 16 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.142 0.696 25881
3886 1 16 . 1 1 14 14 VAL H H 14 7.266 7.266 7.847 -0.581 25881
3887 1 16 . 1 1 15 15 ASP N N 15 119.913 119.913 120.442 -0.529 25881
3888 1 16 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.759 -0.528 25881
3889 1 16 . 1 1 15 15 ASP C C 15 176.279 176.279 177.237 -0.958 25881
3890 1 16 . 1 1 15 15 ASP CA C 15 55.023 55.023 56.155 -1.132 25881
3891 1 16 . 1 1 15 15 ASP CB C 15 39.947 39.947 41.084 -1.137 25881
3892 1 16 . 1 1 15 15 ASP H H 15 8.223 8.223 8.465 -0.242 25881
3893 1 16 . 1 1 16 16 GLY N N 16 109.534 109.534 109.515 0.019 25881
3894 1 16 . 1 1 16 16 GLY C C 16 173.120 173.120 174.771 -1.651 25881
3895 1 16 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.519 1.577 25881
3896 1 16 . 1 1 16 16 GLY H H 16 8.617 8.617 8.725 -0.108 25881
3897 1 16 . 1 1 17 17 LYS N N 17 121.534 121.534 123.046 -1.512 25881
3898 1 16 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.102 -0.457 25881
3899 1 16 . 1 1 17 17 LYS C C 17 175.029 175.029 176.856 -1.827 25881
3900 1 16 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.387 -0.876 25881
3901 1 16 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.545 0.599 25881
3902 1 16 . 1 1 17 17 LYS H H 17 7.318 7.318 7.897 -0.579 25881
3903 1 16 . 1 1 18 18 TYR N N 18 119.391 119.391 120.137 -0.746 25881
3904 1 16 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.628 -0.176 25881
3905 1 16 . 1 1 18 18 TYR C C 18 174.241 174.241 174.964 -0.723 25881
3906 1 16 . 1 1 18 18 TYR CA C 18 55.548 55.548 56.955 -1.407 25881
3907 1 16 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.325 -1.829 25881
3908 1 16 . 1 1 18 18 TYR H H 18 7.661 7.661 8.021 -0.360 25881
3909 1 16 . 1 1 19 19 LYS N N 19 120.140 120.140 121.648 -1.508 25881
3910 1 16 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.478 0.463 25881
3911 1 16 . 1 1 19 19 LYS C C 19 176.321 176.321 174.387 1.934 25881
3912 1 16 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.270 0.294 25881
3913 1 16 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.722 0.296 25881
3914 1 16 . 1 1 19 19 LYS H H 19 8.395 8.395 8.189 0.206 25881
3915 1 16 . 1 1 20 20 CYS N N 20 131.127 131.127 124.896 6.231 25881
3916 1 16 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.001 -0.070 25881
3917 1 16 . 1 1 20 20 CYS C C 20 176.321 176.321 174.059 2.262 25881
3918 1 16 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.671 1.621 25881
3919 1 16 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.750 4.116 25881
3920 1 16 . 1 1 20 20 CYS H H 20 9.391 9.391 8.635 0.756 25881
3921 1 16 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.359 0.041 25881
3922 1 16 . 1 1 21 21 PRO C C 21 176.764 176.764 176.848 -0.084 25881
3923 1 16 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.576 -0.141 25881
3924 1 16 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.628 0.697 25881
3925 1 16 . 1 1 22 22 LYS N N 22 120.217 120.217 119.008 1.209 25881
3926 1 16 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.291 -0.093 25881
3927 1 16 . 1 1 22 22 LYS C C 22 176.798 176.798 177.832 -1.034 25881
3928 1 16 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.607 0.020 25881
3929 1 16 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.358 0.905 25881
3930 1 16 . 1 1 22 22 LYS H H 22 8.550 8.550 8.523 0.027 25881
3931 1 16 . 1 1 23 23 CYS N N 23 115.450 115.450 114.570 0.880 25881
3932 1 16 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.734 0.253 25881
3933 1 16 . 1 1 23 23 CYS C C 23 176.434 176.434 176.236 0.198 25881
3934 1 16 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.262 -0.107 25881
3935 1 16 . 1 1 23 23 CYS CB C 23 32.482 32.482 29.541 2.941 25881
3936 1 16 . 1 1 23 23 CYS H H 23 7.886 7.886 8.335 -0.449 25881
3937 1 16 . 1 1 24 24 GLY N N 24 112.961 112.961 110.525 2.436 25881
3938 1 16 . 1 1 24 24 GLY C C 24 173.369 173.369 174.552 -1.183 25881
3939 1 16 . 1 1 24 24 GLY CA C 24 46.152 46.152 44.900 1.252 25881
3940 1 16 . 1 1 24 24 GLY H H 24 7.958 7.958 8.460 -0.502 25881
3941 1 16 . 1 1 25 25 VAL N N 25 123.968 123.968 121.048 2.920 25881
3942 1 16 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.020 -0.041 25881
3943 1 16 . 1 1 25 25 VAL C C 25 173.934 173.934 173.941 -0.007 25881
3944 1 16 . 1 1 25 25 VAL CA C 25 63.136 63.136 61.786 1.350 25881
3945 1 16 . 1 1 25 25 VAL CB C 25 31.959 31.959 32.905 -0.946 25881
3946 1 16 . 1 1 25 25 VAL H H 25 8.348 8.348 7.192 1.156 25881
3947 1 16 . 1 1 26 26 ARG N N 26 125.641 125.641 124.991 0.650 25881
3948 1 16 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.644 0.616 25881
3949 1 16 . 1 1 26 26 ARG C C 26 177.008 177.008 175.516 1.492 25881
3950 1 16 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.562 -0.234 25881
3951 1 16 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.267 -1.944 25881
3952 1 16 . 1 1 26 26 ARG H H 26 8.379 8.379 8.391 -0.012 25881
3953 1 16 . 1 1 27 27 TYR N N 27 117.706 117.706 118.634 -0.928 25881
3954 1 16 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.049 1.644 25881
3955 1 16 . 1 1 27 27 TYR C C 27 175.404 175.404 176.372 -0.968 25881
3956 1 16 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.229 1.247 25881
3957 1 16 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.495 2.408 25881
3958 1 16 . 1 1 27 27 TYR H H 27 8.631 8.631 8.041 0.590 25881
3959 1 16 . 1 1 28 28 CYS N N 28 118.515 118.515 117.063 1.452 25881
3960 1 16 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.921 -0.016 25881
3961 1 16 . 1 1 28 28 CYS C C 28 176.186 176.186 175.157 1.029 25881
3962 1 16 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.977 -0.363 25881
3963 1 16 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.868 6.959 25881
3964 1 16 . 1 1 28 28 CYS H H 28 8.817 8.817 8.413 0.404 25881
3965 1 16 . 1 1 29 29 SER N N 29 114.067 114.067 112.269 1.798 25881
3966 1 16 . 1 1 29 29 SER HA H 29 4.877 4.877 4.064 0.813 25881
3967 1 16 . 1 1 29 29 SER C C 29 178.077 178.077 173.515 4.562 25881
3968 1 16 . 1 1 29 29 SER CA C 29 57.260 57.260 57.161 0.099 25881
3969 1 16 . 1 1 29 29 SER CB C 29 65.051 65.051 64.262 0.789 25881
3970 1 16 . 1 1 29 29 SER H H 29 7.400 7.400 7.434 -0.034 25881
3971 1 16 . 1 1 30 30 LEU HA H 30 4.039 4.039 4.200 -0.161 25881
3972 1 16 . 1 1 30 30 LEU C C 30 178.077 178.077 177.504 0.573 25881
3973 1 16 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.487 -0.036 25881
3974 1 16 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.627 -0.398 25881
3975 1 16 . 1 1 30 30 LEU H H 30 6.951 6.951 8.297 -1.346 25881
3976 1 16 . 1 1 31 31 LYS N N 31 118.534 118.534 118.235 0.299 25881
3977 1 16 . 1 1 31 31 LYS HA H 31 3.790 3.790 3.952 -0.162 25881
3978 1 16 . 1 1 31 31 LYS C C 31 179.162 179.162 176.890 2.272 25881
3979 1 16 . 1 1 31 31 LYS CA C 31 59.867 59.867 59.340 0.527 25881
3980 1 16 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.581 0.326 25881
3981 1 16 . 1 1 31 31 LYS H H 31 8.030 8.030 8.358 -0.328 25881
3982 1 16 . 1 1 32 32 CYS N N 32 118.700 118.700 115.952 2.748 25881
3983 1 16 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.565 -0.580 25881
3984 1 16 . 1 1 32 32 CYS C C 32 176.766 176.766 176.941 -0.175 25881
3985 1 16 . 1 1 32 32 CYS CA C 32 65.679 65.679 60.103 5.575 25881
3986 1 16 . 1 1 32 32 CYS CB C 32 29.549 29.549 26.921 2.628 25881
3987 1 16 . 1 1 32 32 CYS H H 32 7.424 7.424 7.657 -0.233 25881
3988 1 16 . 1 1 33 33 TYR N N 33 118.151 118.151 123.589 -5.438 25881
3989 1 16 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.349 -0.239 25881
3990 1 16 . 1 1 33 33 TYR C C 33 178.549 178.549 176.132 2.417 25881
3991 1 16 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.530 2.657 25881
3992 1 16 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.786 1.060 25881
3993 1 16 . 1 1 33 33 TYR H H 33 7.918 7.918 7.771 0.147 25881
3994 1 16 . 1 1 34 34 LYS N N 34 114.631 114.631 118.258 -3.627 25881
3995 1 16 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.278 -0.356 25881
3996 1 16 . 1 1 34 34 LYS C C 34 174.991 174.991 175.429 -0.438 25881
3997 1 16 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.775 0.176 25881
3998 1 16 . 1 1 34 34 LYS CB C 34 32.145 32.145 30.938 1.208 25881
3999 1 16 . 1 1 34 34 LYS H H 34 7.939 7.939 7.879 0.060 25881
4000 1 16 . 1 1 35 35 ASP N N 35 121.194 121.194 120.571 0.623 25881
4001 1 16 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.679 -0.385 25881
4002 1 16 . 1 1 35 35 ASP C C 35 175.480 175.480 175.002 0.478 25881
4003 1 16 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.244 1.095 25881
4004 1 16 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.452 -3.091 25881
4005 1 16 . 1 1 35 35 ASP H H 35 7.115 7.115 7.980 -0.865 25881
4006 1 16 . 1 1 36 36 ALA N N 36 130.311 130.311 125.385 4.926 25881
4007 1 16 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.941 -1.054 25881
4008 1 16 . 1 1 36 36 ALA C C 36 177.717 177.717 176.599 1.118 25881
4009 1 16 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.795 1.731 25881
4010 1 16 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.376 -0.665 25881
4011 1 16 . 1 1 36 36 ALA H H 36 8.073 8.073 8.496 -0.423 25881
4012 1 16 . 1 1 37 37 ALA N N 37 117.133 117.133 122.766 -5.633 25881
4013 1 16 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.369 -0.283 25881
4014 1 16 . 1 1 37 37 ALA C C 37 178.989 178.989 178.633 0.356 25881
4015 1 16 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.706 -0.495 25881
4016 1 16 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.210 -1.063 25881
4017 1 16 . 1 1 37 37 ALA H H 37 7.839 7.839 8.708 -0.869 25881
4018 1 16 . 1 1 38 38 LYS N N 38 114.127 114.127 115.870 -1.743 25881
4019 1 16 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.425 -0.130 25881
4020 1 16 . 1 1 38 38 LYS C C 38 175.690 175.690 176.381 -0.691 25881
4021 1 16 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.917 -0.714 25881
4022 1 16 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.545 1.603 25881
4023 1 16 . 1 1 38 38 LYS H H 38 7.292 7.292 9.137 -1.845 25881
4024 1 16 . 1 1 39 39 HIS N N 39 122.110 122.110 121.329 0.781 25881
4025 1 16 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.587 0.176 25881
4026 1 16 . 1 1 39 39 HIS C C 39 171.783 171.783 173.209 -1.426 25881
4027 1 16 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.380 -2.745 25881
4028 1 16 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.852 -2.223 25881
4029 1 16 . 1 1 39 39 HIS H H 39 8.393 8.393 8.395 -0.002 25881
4030 1 16 . 1 1 40 40 VAL N N 40 123.393 123.393 127.060 -3.667 25881
4031 1 16 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.232 -0.485 25881
4032 1 16 . 1 1 40 40 VAL C C 40 175.292 175.292 175.390 -0.098 25881
4033 1 16 . 1 1 40 40 VAL CA C 40 61.164 61.164 60.938 0.226 25881
4034 1 16 . 1 1 40 40 VAL CB C 40 34.132 34.132 33.054 1.077 25881
4035 1 16 . 1 1 40 40 VAL H H 40 7.811 7.811 8.140 -0.329 25881
4036 1 16 . 1 1 41 41 HIS N N 41 125.669 125.669 125.528 0.141 25881
4037 1 16 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.472 0.406 25881
4038 1 16 . 1 1 41 41 HIS C C 41 174.640 174.640 176.049 -1.409 25881
4039 1 16 . 1 1 41 41 HIS CA C 41 52.900 52.900 57.200 -4.300 25881
4040 1 16 . 1 1 41 41 HIS CB C 41 30.067 30.067 30.890 -0.823 25881
4041 1 16 . 1 1 41 41 HIS H H 41 8.512 8.512 8.618 -0.106 25881
4042 1 16 . 1 1 42 42 LYS N N 42 123.564 123.564 119.394 4.170 25881
4043 1 16 . 1 1 42 42 LYS C C 42 176.739 176.739 175.852 0.887 25881
4044 1 16 . 1 1 42 42 LYS CA C 42 56.320 56.320 56.251 0.069 25881
4045 1 16 . 1 1 42 42 LYS CB C 42 33.229 33.229 30.254 2.975 25881
4046 1 16 . 1 1 42 42 LYS H H 42 8.668 8.668 8.319 0.349 25881
4047 1 16 . 1 1 43 43 GLU N N 43 122.633 122.633 122.391 0.242 25881
4048 1 16 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.352 -0.242 25881
4049 1 16 . 1 1 43 43 GLU C C 43 176.569 176.569 176.042 0.527 25881
4050 1 16 . 1 1 43 43 GLU CA C 43 57.097 57.097 56.557 0.540 25881
4051 1 16 . 1 1 43 43 GLU CB C 43 29.948 29.948 30.465 -0.517 25881
4052 1 16 . 1 1 43 43 GLU H H 43 8.590 8.590 8.393 0.197 25881
4053 1 16 . 1 1 44 44 SER N N 44 115.147 115.147 114.903 0.244 25881
4054 1 16 . 1 1 44 44 SER HA H 44 4.268 4.268 4.584 -0.316 25881
4055 1 16 . 1 1 44 44 SER C C 44 174.336 174.336 174.394 -0.058 25881
4056 1 16 . 1 1 44 44 SER CA C 44 58.348 58.348 58.700 -0.352 25881
4057 1 16 . 1 1 44 44 SER CB C 44 63.724 63.724 63.727 -0.003 25881
4058 1 16 . 1 1 44 44 SER H H 44 8.105 8.105 8.206 -0.101 25881
4059 1 16 . 1 1 45 45 GLU N N 45 122.849 122.849 125.361 -2.512 25881
4060 1 16 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.634 -0.471 25881
4061 1 16 . 1 1 45 45 GLU C C 45 175.304 175.304 176.218 -0.914 25881
4062 1 16 . 1 1 45 45 GLU CA C 45 56.412 56.412 56.495 -0.083 25881
4063 1 16 . 1 1 45 45 GLU CB C 45 30.130 30.130 29.349 0.781 25881
4064 1 16 . 1 1 45 45 GLU H H 45 8.183 8.183 8.723 -0.540 25881
4065 1 17 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.281 0.012 25881
4066 1 17 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 63.097 -0.095 25881
4067 1 17 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 31.932 0.286 25881
4068 1 17 . 1 1 1 1 MET HA H 1 3.967 3.967 4.484 -0.517 25881
4069 1 17 . 1 1 1 1 MET CA C 1 57.335 57.335 54.883 2.452 25881
4070 1 17 . 1 1 1 1 MET CB C 1 34.180 34.180 33.673 0.506 25881
4071 1 17 . 1 1 2 2 VAL C C 2 175.654 175.654 176.799 -1.145 25881
4072 1 17 . 1 1 2 2 VAL CA C 2 55.183 55.183 65.322 -10.139 25881
4073 1 17 . 1 1 2 2 VAL CB C 2 33.173 33.173 29.809 3.364 25881
4074 1 17 . 1 1 3 3 SER N N 3 121.996 121.996 117.302 4.694 25881
4075 1 17 . 1 1 3 3 SER HA H 3 4.323 4.323 4.519 -0.197 25881
4076 1 17 . 1 1 3 3 SER C C 3 176.021 176.021 174.876 1.145 25881
4077 1 17 . 1 1 3 3 SER CA C 3 62.208 62.208 57.719 4.489 25881
4078 1 17 . 1 1 3 3 SER H H 3 8.103 8.103 8.188 -0.085 25881
4079 1 17 . 1 1 4 4 SER N N 4 119.715 119.715 117.320 2.395 25881
4080 1 17 . 1 1 4 4 SER HA H 4 4.317 4.317 4.383 -0.066 25881
4081 1 17 . 1 1 4 4 SER C C 4 174.010 174.010 174.810 -0.800 25881
4082 1 17 . 1 1 4 4 SER CA C 4 58.177 58.177 58.968 -0.791 25881
4083 1 17 . 1 1 4 4 SER CB C 4 63.763 63.763 63.502 0.261 25881
4084 1 17 . 1 1 4 4 SER H H 4 8.298 8.298 8.123 0.175 25881
4085 1 17 . 1 1 5 5 ALA N N 5 126.016 126.016 123.369 2.647 25881
4086 1 17 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.435 -0.266 25881
4087 1 17 . 1 1 5 5 ALA C C 5 177.297 177.297 175.744 1.553 25881
4088 1 17 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.548 0.836 25881
4089 1 17 . 1 1 5 5 ALA CB C 5 19.106 19.106 19.862 -0.756 25881
4090 1 17 . 1 1 5 5 ALA H H 5 8.119 8.119 7.824 0.295 25881
4091 1 17 . 1 1 6 6 VAL N N 6 119.174 119.174 118.779 0.395 25881
4092 1 17 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.340 -0.392 25881
4093 1 17 . 1 1 6 6 VAL C C 6 175.743 175.743 174.319 1.424 25881
4094 1 17 . 1 1 6 6 VAL CA C 6 61.668 61.668 60.598 1.070 25881
4095 1 17 . 1 1 6 6 VAL CB C 6 32.841 32.841 34.910 -2.069 25881
4096 1 17 . 1 1 6 6 VAL H H 6 7.861 7.861 8.091 -0.230 25881
4097 1 17 . 1 1 7 7 LYS N N 7 123.999 123.999 123.108 0.891 25881
4098 1 17 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.659 -0.492 25881
4099 1 17 . 1 1 7 7 LYS C C 7 175.665 175.665 175.217 0.448 25881
4100 1 17 . 1 1 7 7 LYS CA C 7 55.290 55.290 53.945 1.345 25881
4101 1 17 . 1 1 7 7 LYS CB C 7 33.541 33.541 34.366 -0.825 25881
4102 1 17 . 1 1 7 7 LYS H H 7 8.054 8.054 8.087 -0.033 25881
4103 1 17 . 1 1 8 8 CYS N N 8 121.428 121.428 121.684 -0.256 25881
4104 1 17 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.429 -0.786 25881
4105 1 17 . 1 1 8 8 CYS C C 8 177.383 177.383 176.584 0.799 25881
4106 1 17 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.571 0.195 25881
4107 1 17 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.553 4.356 25881
4108 1 17 . 1 1 8 8 CYS H H 8 8.539 8.539 8.708 -0.169 25881
4109 1 17 . 1 1 9 9 GLY N N 9 118.862 118.862 116.503 2.359 25881
4110 1 17 . 1 1 9 9 GLY C C 9 172.770 172.770 174.828 -2.058 25881
4111 1 17 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.864 0.280 25881
4112 1 17 . 1 1 9 9 GLY H H 9 9.365 9.365 8.834 0.531 25881
4113 1 17 . 1 1 10 10 ILE N N 10 122.885 122.885 118.214 4.671 25881
4114 1 17 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.215 -0.233 25881
4115 1 17 . 1 1 10 10 ILE C C 10 175.980 175.980 175.150 0.830 25881
4116 1 17 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.404 0.652 25881
4117 1 17 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.060 -1.117 25881
4118 1 17 . 1 1 10 10 ILE H H 10 8.972 8.972 7.296 1.676 25881
4119 1 17 . 1 1 11 11 CYS N N 11 118.245 118.245 113.193 5.052 25881
4120 1 17 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.881 -0.232 25881
4121 1 17 . 1 1 11 11 CYS C C 11 176.780 176.780 175.276 1.504 25881
4122 1 17 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.752 1.342 25881
4123 1 17 . 1 1 11 11 CYS CB C 11 31.972 31.972 30.142 1.829 25881
4124 1 17 . 1 1 11 11 CYS H H 11 8.466 8.466 7.654 0.812 25881
4125 1 17 . 1 1 12 12 ARG N N 12 116.067 116.067 120.120 -4.053 25881
4126 1 17 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.113 0.103 25881
4127 1 17 . 1 1 12 12 ARG C C 12 175.637 175.637 176.620 -0.983 25881
4128 1 17 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.785 1.175 25881
4129 1 17 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.764 0.341 25881
4130 1 17 . 1 1 12 12 ARG H H 12 7.255 7.255 8.510 -1.255 25881
4131 1 17 . 1 1 13 13 GLY N N 13 109.951 109.951 107.686 2.265 25881
4132 1 17 . 1 1 13 13 GLY C C 13 173.169 173.169 174.081 -0.912 25881
4133 1 17 . 1 1 13 13 GLY CA C 13 44.304 44.304 46.160 -1.856 25881
4134 1 17 . 1 1 13 13 GLY H H 13 8.795 8.795 8.137 0.658 25881
4135 1 17 . 1 1 14 14 VAL N N 14 113.644 113.644 116.122 -2.478 25881
4136 1 17 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.720 -0.676 25881
4137 1 17 . 1 1 14 14 VAL C C 14 174.970 174.970 174.218 0.752 25881
4138 1 17 . 1 1 14 14 VAL CA C 14 61.231 61.231 59.024 2.207 25881
4139 1 17 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.181 0.657 25881
4140 1 17 . 1 1 14 14 VAL H H 14 7.266 7.266 7.761 -0.494 25881
4141 1 17 . 1 1 15 15 ASP N N 15 119.913 119.913 120.261 -0.348 25881
4142 1 17 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.753 -0.522 25881
4143 1 17 . 1 1 15 15 ASP C C 15 176.279 176.279 176.876 -0.597 25881
4144 1 17 . 1 1 15 15 ASP CA C 15 55.023 55.023 55.960 -0.937 25881
4145 1 17 . 1 1 15 15 ASP CB C 15 39.947 39.947 41.000 -1.053 25881
4146 1 17 . 1 1 15 15 ASP H H 15 8.223 8.223 8.457 -0.234 25881
4147 1 17 . 1 1 16 16 GLY N N 16 109.534 109.534 108.532 1.002 25881
4148 1 17 . 1 1 16 16 GLY C C 16 173.120 173.120 174.706 -1.586 25881
4149 1 17 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.346 1.750 25881
4150 1 17 . 1 1 16 16 GLY H H 16 8.617 8.617 8.675 -0.058 25881
4151 1 17 . 1 1 17 17 LYS N N 17 121.534 121.534 124.285 -2.751 25881
4152 1 17 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.099 -0.454 25881
4153 1 17 . 1 1 17 17 LYS C C 17 175.029 175.029 177.323 -2.294 25881
4154 1 17 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.457 -0.946 25881
4155 1 17 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.727 0.417 25881
4156 1 17 . 1 1 17 17 LYS H H 17 7.318 7.318 7.765 -0.447 25881
4157 1 17 . 1 1 18 18 TYR N N 18 119.391 119.391 120.591 -1.200 25881
4158 1 17 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.582 -0.130 25881
4159 1 17 . 1 1 18 18 TYR C C 18 174.241 174.241 175.152 -0.911 25881
4160 1 17 . 1 1 18 18 TYR CA C 18 55.548 55.548 57.577 -2.029 25881
4161 1 17 . 1 1 18 18 TYR CB C 18 38.496 38.496 39.926 -1.430 25881
4162 1 17 . 1 1 18 18 TYR H H 18 7.661 7.661 8.088 -0.427 25881
4163 1 17 . 1 1 19 19 LYS N N 19 120.140 120.140 121.734 -1.594 25881
4164 1 17 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.430 0.511 25881
4165 1 17 . 1 1 19 19 LYS C C 19 176.321 176.321 174.451 1.870 25881
4166 1 17 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.370 0.194 25881
4167 1 17 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.829 0.189 25881
4168 1 17 . 1 1 19 19 LYS H H 19 8.395 8.395 8.121 0.274 25881
4169 1 17 . 1 1 20 20 CYS N N 20 131.127 131.127 124.708 6.419 25881
4170 1 17 . 1 1 20 20 CYS HA H 20 4.931 4.931 4.975 -0.044 25881
4171 1 17 . 1 1 20 20 CYS C C 20 176.321 176.321 174.217 2.104 25881
4172 1 17 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.739 1.553 25881
4173 1 17 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.889 3.977 25881
4174 1 17 . 1 1 20 20 CYS H H 20 9.391 9.391 8.511 0.880 25881
4175 1 17 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.343 0.057 25881
4176 1 17 . 1 1 21 21 PRO C C 21 176.764 176.764 176.648 0.116 25881
4177 1 17 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.815 -0.380 25881
4178 1 17 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.668 0.657 25881
4179 1 17 . 1 1 22 22 LYS N N 22 120.217 120.217 116.155 4.062 25881
4180 1 17 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.703 -0.505 25881
4181 1 17 . 1 1 22 22 LYS C C 22 176.798 176.798 177.996 -1.198 25881
4182 1 17 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.531 0.096 25881
4183 1 17 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.811 0.451 25881
4184 1 17 . 1 1 22 22 LYS H H 22 8.550 8.550 8.021 0.529 25881
4185 1 17 . 1 1 23 23 CYS N N 23 115.450 115.450 113.042 2.408 25881
4186 1 17 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.909 0.078 25881
4187 1 17 . 1 1 23 23 CYS C C 23 176.434 176.434 176.298 0.136 25881
4188 1 17 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.429 -0.274 25881
4189 1 17 . 1 1 23 23 CYS CB C 23 32.482 32.482 29.552 2.930 25881
4190 1 17 . 1 1 23 23 CYS H H 23 7.886 7.886 7.896 -0.010 25881
4191 1 17 . 1 1 24 24 GLY N N 24 112.961 112.961 110.992 1.969 25881
4192 1 17 . 1 1 24 24 GLY C C 24 173.369 173.369 173.703 -0.334 25881
4193 1 17 . 1 1 24 24 GLY CA C 24 46.152 46.152 45.206 0.945 25881
4194 1 17 . 1 1 24 24 GLY H H 24 7.958 7.958 8.280 -0.322 25881
4195 1 17 . 1 1 25 25 VAL N N 25 123.968 123.968 118.854 5.114 25881
4196 1 17 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.084 -0.105 25881
4197 1 17 . 1 1 25 25 VAL C C 25 173.934 173.934 174.424 -0.490 25881
4198 1 17 . 1 1 25 25 VAL CA C 25 63.136 63.136 60.660 2.475 25881
4199 1 17 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.343 -1.384 25881
4200 1 17 . 1 1 25 25 VAL H H 25 8.348 8.348 7.206 1.142 25881
4201 1 17 . 1 1 26 26 ARG N N 26 125.641 125.641 123.874 1.767 25881
4202 1 17 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.645 0.615 25881
4203 1 17 . 1 1 26 26 ARG C C 26 177.008 177.008 175.301 1.707 25881
4204 1 17 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.765 -0.437 25881
4205 1 17 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.718 -2.395 25881
4206 1 17 . 1 1 26 26 ARG H H 26 8.379 8.379 8.212 0.167 25881
4207 1 17 . 1 1 27 27 TYR N N 27 117.706 117.706 118.254 -0.548 25881
4208 1 17 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.068 1.625 25881
4209 1 17 . 1 1 27 27 TYR C C 27 175.404 175.404 176.265 -0.861 25881
4210 1 17 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.481 0.995 25881
4211 1 17 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.892 2.010 25881
4212 1 17 . 1 1 27 27 TYR H H 27 8.631 8.631 8.326 0.305 25881
4213 1 17 . 1 1 28 28 CYS N N 28 118.515 118.515 116.512 2.003 25881
4214 1 17 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.994 -0.089 25881
4215 1 17 . 1 1 28 28 CYS C C 28 176.186 176.186 175.013 1.173 25881
4216 1 17 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.143 0.471 25881
4217 1 17 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.808 7.019 25881
4218 1 17 . 1 1 28 28 CYS H H 28 8.817 8.817 8.360 0.457 25881
4219 1 17 . 1 1 29 29 SER N N 29 114.067 114.067 113.100 0.967 25881
4220 1 17 . 1 1 29 29 SER HA H 29 4.877 4.877 3.891 0.986 25881
4221 1 17 . 1 1 29 29 SER C C 29 178.077 178.077 173.471 4.606 25881
4222 1 17 . 1 1 29 29 SER CA C 29 57.260 57.260 57.379 -0.119 25881
4223 1 17 . 1 1 29 29 SER CB C 29 65.051 65.051 63.789 1.262 25881
4224 1 17 . 1 1 29 29 SER H H 29 7.400 7.400 7.372 0.028 25881
4225 1 17 . 1 1 30 30 LEU HA H 30 4.039 4.039 4.035 0.004 25881
4226 1 17 . 1 1 30 30 LEU C C 30 178.077 178.077 178.399 -0.322 25881
4227 1 17 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.566 -0.114 25881
4228 1 17 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.470 -0.241 25881
4229 1 17 . 1 1 30 30 LEU H H 30 6.951 6.951 8.479 -1.528 25881
4230 1 17 . 1 1 31 31 LYS N N 31 118.534 118.534 118.075 0.459 25881
4231 1 17 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.065 -0.275 25881
4232 1 17 . 1 1 31 31 LYS C C 31 179.162 179.162 177.208 1.954 25881
4233 1 17 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.655 1.212 25881
4234 1 17 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.924 -0.017 25881
4235 1 17 . 1 1 31 31 LYS H H 31 8.030 8.030 7.653 0.377 25881
4236 1 17 . 1 1 32 32 CYS N N 32 118.700 118.700 115.905 2.795 25881
4237 1 17 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.735 -0.750 25881
4238 1 17 . 1 1 32 32 CYS C C 32 176.766 176.766 177.039 -0.273 25881
4239 1 17 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.338 6.341 25881
4240 1 17 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.999 1.550 25881
4241 1 17 . 1 1 32 32 CYS H H 32 7.424 7.424 7.592 -0.168 25881
4242 1 17 . 1 1 33 33 TYR N N 33 118.151 118.151 123.773 -5.622 25881
4243 1 17 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.363 -0.253 25881
4244 1 17 . 1 1 33 33 TYR C C 33 178.549 178.549 176.197 2.352 25881
4245 1 17 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.892 2.295 25881
4246 1 17 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.740 1.106 25881
4247 1 17 . 1 1 33 33 TYR H H 33 7.918 7.918 7.803 0.115 25881
4248 1 17 . 1 1 34 34 LYS N N 34 114.631 114.631 116.622 -1.991 25881
4249 1 17 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.323 -0.401 25881
4250 1 17 . 1 1 34 34 LYS C C 34 174.991 174.991 175.246 -0.255 25881
4251 1 17 . 1 1 34 34 LYS CA C 34 55.951 55.951 56.044 -0.093 25881
4252 1 17 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.491 0.654 25881
4253 1 17 . 1 1 34 34 LYS H H 34 7.939 7.939 7.891 0.048 25881
4254 1 17 . 1 1 35 35 ASP N N 35 121.194 121.194 120.369 0.825 25881
4255 1 17 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.705 -0.411 25881
4256 1 17 . 1 1 35 35 ASP C C 35 175.480 175.480 175.242 0.238 25881
4257 1 17 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.599 0.740 25881
4258 1 17 . 1 1 35 35 ASP CB C 35 40.361 40.361 42.517 -2.156 25881
4259 1 17 . 1 1 35 35 ASP H H 35 7.115 7.115 7.537 -0.422 25881
4260 1 17 . 1 1 36 36 ALA N N 36 130.311 130.311 128.117 2.194 25881
4261 1 17 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.827 -0.940 25881
4262 1 17 . 1 1 36 36 ALA C C 36 177.717 177.717 176.964 0.753 25881
4263 1 17 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.927 1.599 25881
4264 1 17 . 1 1 36 36 ALA CB C 36 18.711 18.711 18.765 -0.054 25881
4265 1 17 . 1 1 36 36 ALA H H 36 8.073 8.073 8.747 -0.674 25881
4266 1 17 . 1 1 37 37 ALA N N 37 117.133 117.133 122.804 -5.671 25881
4267 1 17 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.309 -0.223 25881
4268 1 17 . 1 1 37 37 ALA C C 37 178.989 178.989 178.876 0.113 25881
4269 1 17 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.786 -0.575 25881
4270 1 17 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.058 -0.911 25881
4271 1 17 . 1 1 37 37 ALA H H 37 7.839 7.839 8.485 -0.646 25881
4272 1 17 . 1 1 38 38 LYS N N 38 114.127 114.127 115.865 -1.738 25881
4273 1 17 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.461 -0.166 25881
4274 1 17 . 1 1 38 38 LYS C C 38 175.690 175.690 176.880 -1.190 25881
4275 1 17 . 1 1 38 38 LYS CA C 38 56.203 56.203 57.061 -0.858 25881
4276 1 17 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.246 1.901 25881
4277 1 17 . 1 1 38 38 LYS H H 38 7.292 7.292 9.051 -1.759 25881
4278 1 17 . 1 1 39 39 HIS N N 39 122.110 122.110 121.140 0.970 25881
4279 1 17 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.669 0.094 25881
4280 1 17 . 1 1 39 39 HIS C C 39 171.783 171.783 173.274 -1.491 25881
4281 1 17 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.062 -2.427 25881
4282 1 17 . 1 1 39 39 HIS CB C 39 27.629 27.629 30.250 -2.621 25881
4283 1 17 . 1 1 39 39 HIS H H 39 8.393 8.393 7.868 0.525 25881
4284 1 17 . 1 1 40 40 VAL N N 40 123.393 123.393 127.104 -3.711 25881
4285 1 17 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.366 -0.619 25881
4286 1 17 . 1 1 40 40 VAL C C 40 175.292 175.292 174.648 0.644 25881
4287 1 17 . 1 1 40 40 VAL CA C 40 61.164 61.164 60.566 0.598 25881
4288 1 17 . 1 1 40 40 VAL CB C 40 34.132 34.132 34.519 -0.387 25881
4289 1 17 . 1 1 40 40 VAL H H 40 7.811 7.811 8.154 -0.343 25881
4290 1 17 . 1 1 41 41 HIS N N 41 125.669 125.669 128.939 -3.270 25881
4291 1 17 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.471 0.407 25881
4292 1 17 . 1 1 41 41 HIS C C 41 174.640 174.640 174.436 0.204 25881
4293 1 17 . 1 1 41 41 HIS CA C 41 52.900 52.900 55.597 -2.697 25881
4294 1 17 . 1 1 41 41 HIS CB C 41 30.067 30.067 29.137 0.930 25881
4295 1 17 . 1 1 41 41 HIS H H 41 8.512 8.512 8.712 -0.200 25881
4296 1 17 . 1 1 42 42 LYS N N 42 123.564 123.564 125.236 -1.672 25881
4297 1 17 . 1 1 42 42 LYS C C 42 176.739 176.739 176.648 0.091 25881
4298 1 17 . 1 1 42 42 LYS CA C 42 56.320 56.320 56.248 0.072 25881
4299 1 17 . 1 1 42 42 LYS CB C 42 33.229 33.229 32.279 0.950 25881
4300 1 17 . 1 1 42 42 LYS H H 42 8.668 8.668 8.115 0.553 25881
4301 1 17 . 1 1 43 43 GLU N N 43 122.633 122.633 123.694 -1.061 25881
4302 1 17 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.020 0.090 25881
4303 1 17 . 1 1 43 43 GLU C C 43 176.569 176.569 175.876 0.693 25881
4304 1 17 . 1 1 43 43 GLU CA C 43 57.097 57.097 57.022 0.075 25881
4305 1 17 . 1 1 43 43 GLU CB C 43 29.948 29.948 27.836 2.112 25881
4306 1 17 . 1 1 43 43 GLU H H 43 8.590 8.590 8.980 -0.390 25881
4307 1 17 . 1 1 44 44 SER N N 44 115.147 115.147 114.898 0.249 25881
4308 1 17 . 1 1 44 44 SER HA H 44 4.268 4.268 4.339 -0.071 25881
4309 1 17 . 1 1 44 44 SER C C 44 174.336 174.336 174.264 0.072 25881
4310 1 17 . 1 1 44 44 SER CA C 44 58.348 58.348 57.614 0.734 25881
4311 1 17 . 1 1 44 44 SER CB C 44 63.724 63.724 61.625 2.099 25881
4312 1 17 . 1 1 44 44 SER H H 44 8.105 8.105 8.506 -0.401 25881
4313 1 17 . 1 1 45 45 GLU N N 45 122.849 122.849 123.233 -0.384 25881
4314 1 17 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.409 -0.246 25881
4315 1 17 . 1 1 45 45 GLU C C 45 175.304 175.304 175.477 -0.173 25881
4316 1 17 . 1 1 45 45 GLU CA C 45 56.412 56.412 55.703 0.709 25881
4317 1 17 . 1 1 45 45 GLU CB C 45 30.130 30.130 29.673 0.457 25881
4318 1 17 . 1 1 45 45 GLU H H 45 8.183 8.183 8.003 0.180 25881
4319 1 18 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.684 -0.391 25881
4320 1 18 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 62.026 0.976 25881
4321 1 18 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 32.325 -0.107 25881
4322 1 18 . 1 1 1 1 MET HA H 1 3.967 3.967 4.137 -0.170 25881
4323 1 18 . 1 1 1 1 MET CA C 1 57.335 57.335 55.112 2.223 25881
4324 1 18 . 1 1 1 1 MET CB C 1 34.180 34.180 30.577 3.603 25881
4325 1 18 . 1 1 2 2 VAL C C 2 175.654 175.654 176.035 -0.381 25881
4326 1 18 . 1 1 2 2 VAL CA C 2 55.183 55.183 62.471 -7.288 25881
4327 1 18 . 1 1 2 2 VAL CB C 2 33.173 33.173 31.811 1.362 25881
4328 1 18 . 1 1 3 3 SER N N 3 121.996 121.996 116.727 5.269 25881
4329 1 18 . 1 1 3 3 SER HA H 3 4.323 4.323 4.371 -0.048 25881
4330 1 18 . 1 1 3 3 SER C C 3 176.021 176.021 174.428 1.593 25881
4331 1 18 . 1 1 3 3 SER CA C 3 62.208 62.208 59.584 2.624 25881
4332 1 18 . 1 1 3 3 SER H H 3 8.103 8.103 7.970 0.133 25881
4333 1 18 . 1 1 4 4 SER N N 4 119.715 119.715 121.770 -2.055 25881
4334 1 18 . 1 1 4 4 SER HA H 4 4.317 4.317 4.448 -0.131 25881
4335 1 18 . 1 1 4 4 SER C C 4 174.010 174.010 173.786 0.224 25881
4336 1 18 . 1 1 4 4 SER CA C 4 58.177 58.177 58.580 -0.403 25881
4337 1 18 . 1 1 4 4 SER CB C 4 63.763 63.763 62.254 1.509 25881
4338 1 18 . 1 1 4 4 SER H H 4 8.298 8.298 8.596 -0.298 25881
4339 1 18 . 1 1 5 5 ALA N N 5 126.016 126.016 126.794 -0.778 25881
4340 1 18 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.618 -0.449 25881
4341 1 18 . 1 1 5 5 ALA C C 5 177.297 177.297 175.610 1.687 25881
4342 1 18 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.717 0.667 25881
4343 1 18 . 1 1 5 5 ALA CB C 5 19.106 19.106 20.538 -1.432 25881
4344 1 18 . 1 1 5 5 ALA H H 5 8.119 8.119 7.806 0.313 25881
4345 1 18 . 1 1 6 6 VAL N N 6 119.174 119.174 121.486 -2.312 25881
4346 1 18 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.311 -0.363 25881
4347 1 18 . 1 1 6 6 VAL C C 6 175.743 175.743 175.214 0.529 25881
4348 1 18 . 1 1 6 6 VAL CA C 6 61.668 61.668 60.918 0.750 25881
4349 1 18 . 1 1 6 6 VAL CB C 6 32.841 32.841 33.631 -0.790 25881
4350 1 18 . 1 1 6 6 VAL H H 6 7.861 7.861 8.450 -0.589 25881
4351 1 18 . 1 1 7 7 LYS N N 7 123.999 123.999 124.344 -0.345 25881
4352 1 18 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.554 -0.387 25881
4353 1 18 . 1 1 7 7 LYS C C 7 175.665 175.665 176.070 -0.405 25881
4354 1 18 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.492 0.798 25881
4355 1 18 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.366 0.175 25881
4356 1 18 . 1 1 7 7 LYS H H 7 8.054 8.054 8.196 -0.142 25881
4357 1 18 . 1 1 8 8 CYS N N 8 121.428 121.428 122.894 -1.466 25881
4358 1 18 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.430 -0.787 25881
4359 1 18 . 1 1 8 8 CYS C C 8 177.383 177.383 176.313 1.070 25881
4360 1 18 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.433 0.333 25881
4361 1 18 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.371 4.538 25881
4362 1 18 . 1 1 8 8 CYS H H 8 8.539 8.539 8.909 -0.370 25881
4363 1 18 . 1 1 9 9 GLY N N 9 118.862 118.862 117.445 1.417 25881
4364 1 18 . 1 1 9 9 GLY C C 9 172.770 172.770 173.708 -0.938 25881
4365 1 18 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.710 0.434 25881
4366 1 18 . 1 1 9 9 GLY H H 9 9.365 9.365 8.974 0.391 25881
4367 1 18 . 1 1 10 10 ILE N N 10 122.885 122.885 116.394 6.491 25881
4368 1 18 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.265 -0.283 25881
4369 1 18 . 1 1 10 10 ILE C C 10 175.980 175.980 175.813 0.167 25881
4370 1 18 . 1 1 10 10 ILE CA C 10 63.056 63.056 61.859 1.197 25881
4371 1 18 . 1 1 10 10 ILE CB C 10 37.944 37.944 40.099 -2.155 25881
4372 1 18 . 1 1 10 10 ILE H H 10 8.972 8.972 7.297 1.675 25881
4373 1 18 . 1 1 11 11 CYS N N 11 118.245 118.245 115.349 2.896 25881
4374 1 18 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.791 -0.142 25881
4375 1 18 . 1 1 11 11 CYS C C 11 176.780 176.780 175.186 1.594 25881
4376 1 18 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.745 1.349 25881
4377 1 18 . 1 1 11 11 CYS CB C 11 31.972 31.972 29.509 2.463 25881
4378 1 18 . 1 1 11 11 CYS H H 11 8.466 8.466 7.660 0.806 25881
4379 1 18 . 1 1 12 12 ARG N N 12 116.067 116.067 120.228 -4.161 25881
4380 1 18 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.089 0.127 25881
4381 1 18 . 1 1 12 12 ARG C C 12 175.637 175.637 176.801 -1.164 25881
4382 1 18 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.862 1.098 25881
4383 1 18 . 1 1 12 12 ARG CB C 12 27.104 27.104 27.083 0.021 25881
4384 1 18 . 1 1 12 12 ARG H H 12 7.255 7.255 8.555 -1.300 25881
4385 1 18 . 1 1 13 13 GLY N N 13 109.951 109.951 106.935 3.016 25881
4386 1 18 . 1 1 13 13 GLY C C 13 173.169 173.169 173.855 -0.686 25881
4387 1 18 . 1 1 13 13 GLY CA C 13 44.304 44.304 46.048 -1.744 25881
4388 1 18 . 1 1 13 13 GLY H H 13 8.795 8.795 8.011 0.784 25881
4389 1 18 . 1 1 14 14 VAL N N 14 113.644 113.644 115.027 -1.383 25881
4390 1 18 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.744 -0.700 25881
4391 1 18 . 1 1 14 14 VAL C C 14 174.970 174.970 174.295 0.675 25881
4392 1 18 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.870 2.361 25881
4393 1 18 . 1 1 14 14 VAL CB C 14 33.838 33.838 34.093 -0.255 25881
4394 1 18 . 1 1 14 14 VAL H H 14 7.266 7.266 7.722 -0.456 25881
4395 1 18 . 1 1 15 15 ASP N N 15 119.913 119.913 119.069 0.844 25881
4396 1 18 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.674 -0.443 25881
4397 1 18 . 1 1 15 15 ASP C C 15 176.279 176.279 176.663 -0.384 25881
4398 1 18 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.603 0.420 25881
4399 1 18 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.887 -0.940 25881
4400 1 18 . 1 1 15 15 ASP H H 15 8.223 8.223 8.361 -0.138 25881
4401 1 18 . 1 1 16 16 GLY N N 16 109.534 109.534 107.226 2.308 25881
4402 1 18 . 1 1 16 16 GLY C C 16 173.120 173.120 174.352 -1.232 25881
4403 1 18 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.086 2.010 25881
4404 1 18 . 1 1 16 16 GLY H H 16 8.617 8.617 8.689 -0.072 25881
4405 1 18 . 1 1 17 17 LYS N N 17 121.534 121.534 121.771 -0.237 25881
4406 1 18 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.077 -0.432 25881
4407 1 18 . 1 1 17 17 LYS C C 17 175.029 175.029 177.243 -2.214 25881
4408 1 18 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.005 -0.494 25881
4409 1 18 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.759 0.385 25881
4410 1 18 . 1 1 17 17 LYS H H 17 7.318 7.318 7.615 -0.297 25881
4411 1 18 . 1 1 18 18 TYR N N 18 119.391 119.391 120.231 -0.840 25881
4412 1 18 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.611 -0.159 25881
4413 1 18 . 1 1 18 18 TYR C C 18 174.241 174.241 175.082 -0.841 25881
4414 1 18 . 1 1 18 18 TYR CA C 18 55.548 55.548 56.727 -1.179 25881
4415 1 18 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.044 -1.548 25881
4416 1 18 . 1 1 18 18 TYR H H 18 7.661 7.661 8.122 -0.461 25881
4417 1 18 . 1 1 19 19 LYS N N 19 120.140 120.140 122.085 -1.945 25881
4418 1 18 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.584 0.357 25881
4419 1 18 . 1 1 19 19 LYS C C 19 176.321 176.321 174.376 1.945 25881
4420 1 18 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.074 0.490 25881
4421 1 18 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.720 0.298 25881
4422 1 18 . 1 1 19 19 LYS H H 19 8.395 8.395 8.191 0.204 25881
4423 1 18 . 1 1 20 20 CYS N N 20 131.127 131.127 124.737 6.390 25881
4424 1 18 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.036 -0.105 25881
4425 1 18 . 1 1 20 20 CYS C C 20 176.321 176.321 173.985 2.336 25881
4426 1 18 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.517 1.775 25881
4427 1 18 . 1 1 20 20 CYS CB C 20 30.866 30.866 27.032 3.834 25881
4428 1 18 . 1 1 20 20 CYS H H 20 9.391 9.391 8.479 0.912 25881
4429 1 18 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.375 0.025 25881
4430 1 18 . 1 1 21 21 PRO C C 21 176.764 176.764 176.872 -0.108 25881
4431 1 18 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.593 -0.158 25881
4432 1 18 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.609 0.716 25881
4433 1 18 . 1 1 22 22 LYS N N 22 120.217 120.217 118.703 1.514 25881
4434 1 18 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.301 -0.103 25881
4435 1 18 . 1 1 22 22 LYS C C 22 176.798 176.798 177.553 -0.755 25881
4436 1 18 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.563 0.064 25881
4437 1 18 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.369 0.893 25881
4438 1 18 . 1 1 22 22 LYS H H 22 8.550 8.550 8.623 -0.073 25881
4439 1 18 . 1 1 23 23 CYS N N 23 115.450 115.450 113.185 2.265 25881
4440 1 18 . 1 1 23 23 CYS HA H 23 4.987 4.987 5.028 -0.041 25881
4441 1 18 . 1 1 23 23 CYS C C 23 176.434 176.434 176.155 0.279 25881
4442 1 18 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.398 -0.243 25881
4443 1 18 . 1 1 23 23 CYS CB C 23 32.482 32.482 31.043 1.439 25881
4444 1 18 . 1 1 23 23 CYS H H 23 7.886 7.886 8.188 -0.302 25881
4445 1 18 . 1 1 24 24 GLY N N 24 112.961 112.961 110.837 2.124 25881
4446 1 18 . 1 1 24 24 GLY C C 24 173.369 173.369 173.286 0.083 25881
4447 1 18 . 1 1 24 24 GLY CA C 24 46.152 46.152 44.962 1.190 25881
4448 1 18 . 1 1 24 24 GLY H H 24 7.958 7.958 8.487 -0.529 25881
4449 1 18 . 1 1 25 25 VAL N N 25 123.968 123.968 119.317 4.651 25881
4450 1 18 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.017 -0.038 25881
4451 1 18 . 1 1 25 25 VAL C C 25 173.934 173.934 173.952 -0.018 25881
4452 1 18 . 1 1 25 25 VAL CA C 25 63.136 63.136 61.379 1.757 25881
4453 1 18 . 1 1 25 25 VAL CB C 25 31.959 31.959 32.965 -1.006 25881
4454 1 18 . 1 1 25 25 VAL H H 25 8.348 8.348 7.278 1.070 25881
4455 1 18 . 1 1 26 26 ARG N N 26 125.641 125.641 124.878 0.763 25881
4456 1 18 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.833 0.427 25881
4457 1 18 . 1 1 26 26 ARG C C 26 177.008 177.008 175.521 1.487 25881
4458 1 18 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.082 0.246 25881
4459 1 18 . 1 1 26 26 ARG CB C 26 29.323 29.323 30.670 -1.347 25881
4460 1 18 . 1 1 26 26 ARG H H 26 8.379 8.379 8.430 -0.051 25881
4461 1 18 . 1 1 27 27 TYR N N 27 117.706 117.706 119.126 -1.420 25881
4462 1 18 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.062 1.631 25881
4463 1 18 . 1 1 27 27 TYR C C 27 175.404 175.404 176.368 -0.964 25881
4464 1 18 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.091 1.385 25881
4465 1 18 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.668 2.235 25881
4466 1 18 . 1 1 27 27 TYR H H 27 8.631 8.631 8.202 0.429 25881
4467 1 18 . 1 1 28 28 CYS N N 28 118.515 118.515 116.533 1.982 25881
4468 1 18 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.879 0.026 25881
4469 1 18 . 1 1 28 28 CYS C C 28 176.186 176.186 175.016 1.170 25881
4470 1 18 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.635 -0.021 25881
4471 1 18 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.943 6.884 25881
4472 1 18 . 1 1 28 28 CYS H H 28 8.817 8.817 8.371 0.446 25881
4473 1 18 . 1 1 29 29 SER N N 29 114.067 114.067 112.170 1.897 25881
4474 1 18 . 1 1 29 29 SER HA H 29 4.877 4.877 3.773 1.104 25881
4475 1 18 . 1 1 29 29 SER C C 29 178.077 178.077 173.535 4.542 25881
4476 1 18 . 1 1 29 29 SER CA C 29 57.260 57.260 57.003 0.257 25881
4477 1 18 . 1 1 29 29 SER CB C 29 65.051 65.051 64.269 0.782 25881
4478 1 18 . 1 1 29 29 SER H H 29 7.400 7.400 7.402 -0.003 25881
4479 1 18 . 1 1 30 30 LEU HA H 30 4.039 4.039 4.281 -0.242 25881
4480 1 18 . 1 1 30 30 LEU C C 30 178.077 178.077 177.347 0.730 25881
4481 1 18 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.835 -0.384 25881
4482 1 18 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.646 -0.417 25881
4483 1 18 . 1 1 30 30 LEU H H 30 6.951 6.951 8.397 -1.446 25881
4484 1 18 . 1 1 31 31 LYS N N 31 118.534 118.534 117.702 0.832 25881
4485 1 18 . 1 1 31 31 LYS HA H 31 3.790 3.790 3.996 -0.206 25881
4486 1 18 . 1 1 31 31 LYS C C 31 179.162 179.162 177.184 1.978 25881
4487 1 18 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.704 1.163 25881
4488 1 18 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.398 0.510 25881
4489 1 18 . 1 1 31 31 LYS H H 31 8.030 8.030 8.385 -0.355 25881
4490 1 18 . 1 1 32 32 CYS N N 32 118.700 118.700 115.857 2.843 25881
4491 1 18 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.512 -0.527 25881
4492 1 18 . 1 1 32 32 CYS C C 32 176.766 176.766 176.934 -0.168 25881
4493 1 18 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.956 5.723 25881
4494 1 18 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.178 2.371 25881
4495 1 18 . 1 1 32 32 CYS H H 32 7.424 7.424 7.602 -0.178 25881
4496 1 18 . 1 1 33 33 TYR N N 33 118.151 118.151 123.321 -5.170 25881
4497 1 18 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.139 -0.029 25881
4498 1 18 . 1 1 33 33 TYR C C 33 178.549 178.549 175.890 2.659 25881
4499 1 18 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.477 2.710 25881
4500 1 18 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.862 0.984 25881
4501 1 18 . 1 1 33 33 TYR H H 33 7.918 7.918 7.694 0.224 25881
4502 1 18 . 1 1 34 34 LYS N N 34 114.631 114.631 117.660 -3.029 25881
4503 1 18 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.280 -0.358 25881
4504 1 18 . 1 1 34 34 LYS C C 34 174.991 174.991 175.527 -0.536 25881
4505 1 18 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.609 0.342 25881
4506 1 18 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.060 1.085 25881
4507 1 18 . 1 1 34 34 LYS H H 34 7.939 7.939 7.729 0.210 25881
4508 1 18 . 1 1 35 35 ASP N N 35 121.194 121.194 120.570 0.624 25881
4509 1 18 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.690 -0.396 25881
4510 1 18 . 1 1 35 35 ASP C C 35 175.480 175.480 175.202 0.278 25881
4511 1 18 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.239 1.101 25881
4512 1 18 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.719 -3.358 25881
4513 1 18 . 1 1 35 35 ASP H H 35 7.115 7.115 7.882 -0.767 25881
4514 1 18 . 1 1 36 36 ALA N N 36 130.311 130.311 125.320 4.991 25881
4515 1 18 . 1 1 36 36 ALA HA H 36 3.887 3.887 5.023 -1.136 25881
4516 1 18 . 1 1 36 36 ALA C C 36 177.717 177.717 177.381 0.336 25881
4517 1 18 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.854 1.672 25881
4518 1 18 . 1 1 36 36 ALA CB C 36 18.711 18.711 20.015 -1.304 25881
4519 1 18 . 1 1 36 36 ALA H H 36 8.073 8.073 8.540 -0.467 25881
4520 1 18 . 1 1 37 37 ALA N N 37 117.133 117.133 122.733 -5.600 25881
4521 1 18 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.310 -0.224 25881
4522 1 18 . 1 1 37 37 ALA C C 37 178.989 178.989 178.872 0.117 25881
4523 1 18 . 1 1 37 37 ALA CA C 37 53.211 53.211 54.605 -1.394 25881
4524 1 18 . 1 1 37 37 ALA CB C 37 19.147 19.147 19.288 -0.141 25881
4525 1 18 . 1 1 37 37 ALA H H 37 7.839 7.839 8.235 -0.396 25881
4526 1 18 . 1 1 38 38 LYS N N 38 114.127 114.127 115.330 -1.203 25881
4527 1 18 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.474 -0.179 25881
4528 1 18 . 1 1 38 38 LYS C C 38 175.690 175.690 177.049 -1.359 25881
4529 1 18 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.785 -0.582 25881
4530 1 18 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.383 1.765 25881
4531 1 18 . 1 1 38 38 LYS H H 38 7.292 7.292 9.127 -1.835 25881
4532 1 18 . 1 1 39 39 HIS N N 39 122.110 122.110 122.306 -0.196 25881
4533 1 18 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.496 0.267 25881
4534 1 18 . 1 1 39 39 HIS C C 39 171.783 171.783 173.734 -1.951 25881
4535 1 18 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.394 -2.759 25881
4536 1 18 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.477 -1.848 25881
4537 1 18 . 1 1 39 39 HIS H H 39 8.393 8.393 8.739 -0.346 25881
4538 1 18 . 1 1 40 40 VAL N N 40 123.393 123.393 126.863 -3.470 25881
4539 1 18 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.010 -0.263 25881
4540 1 18 . 1 1 40 40 VAL C C 40 175.292 175.292 175.882 -0.590 25881
4541 1 18 . 1 1 40 40 VAL CA C 40 61.164 61.164 62.655 -1.491 25881
4542 1 18 . 1 1 40 40 VAL CB C 40 34.132 34.132 32.130 2.002 25881
4543 1 18 . 1 1 40 40 VAL H H 40 7.811 7.811 8.269 -0.458 25881
4544 1 18 . 1 1 41 41 HIS N N 41 125.669 125.669 125.722 -0.053 25881
4545 1 18 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.777 0.101 25881
4546 1 18 . 1 1 41 41 HIS C C 41 174.640 174.640 173.747 0.893 25881
4547 1 18 . 1 1 41 41 HIS CA C 41 52.900 52.900 54.817 -1.917 25881
4548 1 18 . 1 1 41 41 HIS CB C 41 30.067 30.067 32.836 -2.769 25881
4549 1 18 . 1 1 41 41 HIS H H 41 8.512 8.512 8.809 -0.297 25881
4550 1 18 . 1 1 42 42 LYS N N 42 123.564 123.564 119.980 3.584 25881
4551 1 18 . 1 1 42 42 LYS C C 42 176.739 176.739 175.872 0.867 25881
4552 1 18 . 1 1 42 42 LYS CA C 42 56.320 56.320 55.813 0.507 25881
4553 1 18 . 1 1 42 42 LYS CB C 42 33.229 33.229 34.628 -1.399 25881
4554 1 18 . 1 1 42 42 LYS H H 42 8.668 8.668 8.068 0.600 25881
4555 1 18 . 1 1 43 43 GLU N N 43 122.633 122.633 117.921 4.712 25881
4556 1 18 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.001 0.109 25881
4557 1 18 . 1 1 43 43 GLU C C 43 176.569 176.569 177.411 -0.842 25881
4558 1 18 . 1 1 43 43 GLU CA C 43 57.097 57.097 58.740 -1.643 25881
4559 1 18 . 1 1 43 43 GLU CB C 43 29.948 29.948 28.357 1.591 25881
4560 1 18 . 1 1 43 43 GLU H H 43 8.590 8.590 8.947 -0.357 25881
4561 1 18 . 1 1 44 44 SER N N 44 115.147 115.147 117.949 -2.802 25881
4562 1 18 . 1 1 44 44 SER HA H 44 4.268 4.268 4.539 -0.271 25881
4563 1 18 . 1 1 44 44 SER C C 44 174.336 174.336 174.054 0.282 25881
4564 1 18 . 1 1 44 44 SER CA C 44 58.348 58.348 58.485 -0.137 25881
4565 1 18 . 1 1 44 44 SER CB C 44 63.724 63.724 61.899 1.825 25881
4566 1 18 . 1 1 44 44 SER H H 44 8.105 8.105 8.266 -0.161 25881
4567 1 18 . 1 1 45 45 GLU N N 45 122.849 122.849 121.563 1.286 25881
4568 1 18 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.321 -0.158 25881
4569 1 18 . 1 1 45 45 GLU C C 45 175.304 175.304 176.658 -1.354 25881
4570 1 18 . 1 1 45 45 GLU CA C 45 56.412 56.412 57.877 -1.465 25881
4571 1 18 . 1 1 45 45 GLU CB C 45 30.130 30.130 30.449 -0.319 25881
4572 1 18 . 1 1 45 45 GLU H H 45 8.183 8.183 8.112 0.071 25881
4573 1 19 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.515 -0.222 25881
4574 1 19 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 63.450 -0.448 25881
4575 1 19 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 31.974 0.244 25881
4576 1 19 . 1 1 1 1 MET HA H 1 3.967 3.967 4.134 -0.167 25881
4577 1 19 . 1 1 1 1 MET CA C 1 57.335 57.335 55.368 1.967 25881
4578 1 19 . 1 1 1 1 MET CB C 1 34.180 34.180 32.443 1.737 25881
4579 1 19 . 1 1 2 2 VAL C C 2 175.654 175.654 177.046 -1.392 25881
4580 1 19 . 1 1 2 2 VAL CA C 2 55.183 55.183 65.306 -10.123 25881
4581 1 19 . 1 1 2 2 VAL CB C 2 33.173 33.173 31.783 1.390 25881
4582 1 19 . 1 1 3 3 SER N N 3 121.996 121.996 116.584 5.412 25881
4583 1 19 . 1 1 3 3 SER HA H 3 4.323 4.323 4.614 -0.291 25881
4584 1 19 . 1 1 3 3 SER C C 3 176.021 176.021 174.430 1.591 25881
4585 1 19 . 1 1 3 3 SER CA C 3 62.208 62.208 58.237 3.971 25881
4586 1 19 . 1 1 3 3 SER H H 3 8.103 8.103 8.332 -0.229 25881
4587 1 19 . 1 1 4 4 SER N N 4 119.715 119.715 118.573 1.142 25881
4588 1 19 . 1 1 4 4 SER HA H 4 4.317 4.317 4.354 -0.037 25881
4589 1 19 . 1 1 4 4 SER C C 4 174.010 174.010 174.131 -0.121 25881
4590 1 19 . 1 1 4 4 SER CA C 4 58.177 58.177 60.064 -1.887 25881
4591 1 19 . 1 1 4 4 SER CB C 4 63.763 63.763 63.692 0.071 25881
4592 1 19 . 1 1 4 4 SER H H 4 8.298 8.298 8.036 0.262 25881
4593 1 19 . 1 1 5 5 ALA N N 5 126.016 126.016 123.337 2.679 25881
4594 1 19 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.498 -0.329 25881
4595 1 19 . 1 1 5 5 ALA C C 5 177.297 177.297 175.971 1.326 25881
4596 1 19 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.364 1.020 25881
4597 1 19 . 1 1 5 5 ALA CB C 5 19.106 19.106 20.737 -1.631 25881
4598 1 19 . 1 1 5 5 ALA H H 5 8.119 8.119 7.645 0.474 25881
4599 1 19 . 1 1 6 6 VAL N N 6 119.174 119.174 120.660 -1.486 25881
4600 1 19 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.183 -0.235 25881
4601 1 19 . 1 1 6 6 VAL C C 6 175.743 175.743 175.483 0.260 25881
4602 1 19 . 1 1 6 6 VAL CA C 6 61.668 61.668 61.215 0.453 25881
4603 1 19 . 1 1 6 6 VAL CB C 6 32.841 32.841 33.721 -0.880 25881
4604 1 19 . 1 1 6 6 VAL H H 6 7.861 7.861 8.375 -0.514 25881
4605 1 19 . 1 1 7 7 LYS N N 7 123.999 123.999 125.729 -1.730 25881
4606 1 19 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.604 -0.437 25881
4607 1 19 . 1 1 7 7 LYS C C 7 175.665 175.665 176.146 -0.481 25881
4608 1 19 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.099 1.191 25881
4609 1 19 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.614 -0.073 25881
4610 1 19 . 1 1 7 7 LYS H H 7 8.054 8.054 8.087 -0.033 25881
4611 1 19 . 1 1 8 8 CYS N N 8 121.428 121.428 122.190 -0.762 25881
4612 1 19 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.383 -0.740 25881
4613 1 19 . 1 1 8 8 CYS C C 8 177.383 177.383 175.905 1.478 25881
4614 1 19 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.787 -0.021 25881
4615 1 19 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.654 4.255 25881
4616 1 19 . 1 1 8 8 CYS H H 8 8.539 8.539 8.840 -0.301 25881
4617 1 19 . 1 1 9 9 GLY N N 9 118.862 118.862 116.342 2.520 25881
4618 1 19 . 1 1 9 9 GLY C C 9 172.770 172.770 174.336 -1.566 25881
4619 1 19 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.533 0.611 25881
4620 1 19 . 1 1 9 9 GLY H H 9 9.365 9.365 8.850 0.515 25881
4621 1 19 . 1 1 10 10 ILE N N 10 122.885 122.885 118.351 4.534 25881
4622 1 19 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.204 -0.222 25881
4623 1 19 . 1 1 10 10 ILE C C 10 175.980 175.980 175.275 0.705 25881
4624 1 19 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.483 0.573 25881
4625 1 19 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.980 -2.036 25881
4626 1 19 . 1 1 10 10 ILE H H 10 8.972 8.972 7.241 1.731 25881
4627 1 19 . 1 1 11 11 CYS N N 11 118.245 118.245 114.110 4.135 25881
4628 1 19 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.779 -0.130 25881
4629 1 19 . 1 1 11 11 CYS C C 11 176.780 176.780 175.215 1.565 25881
4630 1 19 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.590 1.504 25881
4631 1 19 . 1 1 11 11 CYS CB C 11 31.972 31.972 29.249 2.723 25881
4632 1 19 . 1 1 11 11 CYS H H 11 8.466 8.466 7.710 0.756 25881
4633 1 19 . 1 1 12 12 ARG N N 12 116.067 116.067 120.263 -4.196 25881
4634 1 19 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.140 0.076 25881
4635 1 19 . 1 1 12 12 ARG C C 12 175.637 175.637 176.369 -0.732 25881
4636 1 19 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.880 1.080 25881
4637 1 19 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.897 0.207 25881
4638 1 19 . 1 1 12 12 ARG H H 12 7.255 7.255 8.350 -1.095 25881
4639 1 19 . 1 1 13 13 GLY N N 13 109.951 109.951 107.090 2.861 25881
4640 1 19 . 1 1 13 13 GLY C C 13 173.169 173.169 173.744 -0.575 25881
4641 1 19 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.838 -1.534 25881
4642 1 19 . 1 1 13 13 GLY H H 13 8.795 8.795 8.124 0.671 25881
4643 1 19 . 1 1 14 14 VAL N N 14 113.644 113.644 116.361 -2.717 25881
4644 1 19 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.734 -0.690 25881
4645 1 19 . 1 1 14 14 VAL C C 14 174.970 174.970 174.327 0.643 25881
4646 1 19 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.869 2.362 25881
4647 1 19 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.326 0.512 25881
4648 1 19 . 1 1 14 14 VAL H H 14 7.266 7.266 7.746 -0.480 25881
4649 1 19 . 1 1 15 15 ASP N N 15 119.913 119.913 118.610 1.303 25881
4650 1 19 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.685 -0.454 25881
4651 1 19 . 1 1 15 15 ASP C C 15 176.279 176.279 176.565 -0.286 25881
4652 1 19 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.587 0.436 25881
4653 1 19 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.941 -0.994 25881
4654 1 19 . 1 1 15 15 ASP H H 15 8.223 8.223 8.355 -0.132 25881
4655 1 19 . 1 1 16 16 GLY N N 16 109.534 109.534 107.293 2.241 25881
4656 1 19 . 1 1 16 16 GLY C C 16 173.120 173.120 175.066 -1.946 25881
4657 1 19 . 1 1 16 16 GLY CA C 16 46.096 46.096 43.971 2.125 25881
4658 1 19 . 1 1 16 16 GLY H H 16 8.617 8.617 8.808 -0.191 25881
4659 1 19 . 1 1 17 17 LYS N N 17 121.534 121.534 122.784 -1.250 25881
4660 1 19 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.033 -0.388 25881
4661 1 19 . 1 1 17 17 LYS C C 17 175.029 175.029 177.309 -2.280 25881
4662 1 19 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.803 -1.292 25881
4663 1 19 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.565 0.579 25881
4664 1 19 . 1 1 17 17 LYS H H 17 7.318 7.318 7.716 -0.398 25881
4665 1 19 . 1 1 18 18 TYR N N 18 119.391 119.391 120.161 -0.770 25881
4666 1 19 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.618 -0.166 25881
4667 1 19 . 1 1 18 18 TYR C C 18 174.241 174.241 175.194 -0.953 25881
4668 1 19 . 1 1 18 18 TYR CA C 18 55.548 55.548 56.382 -0.834 25881
4669 1 19 . 1 1 18 18 TYR CB C 18 38.496 38.496 39.649 -1.153 25881
4670 1 19 . 1 1 18 18 TYR H H 18 7.661 7.661 8.061 -0.400 25881
4671 1 19 . 1 1 19 19 LYS N N 19 120.140 120.140 121.938 -1.798 25881
4672 1 19 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.537 0.404 25881
4673 1 19 . 1 1 19 19 LYS C C 19 176.321 176.321 174.611 1.710 25881
4674 1 19 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.217 0.347 25881
4675 1 19 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.793 0.225 25881
4676 1 19 . 1 1 19 19 LYS H H 19 8.395 8.395 8.211 0.184 25881
4677 1 19 . 1 1 20 20 CYS N N 20 131.127 131.127 124.986 6.141 25881
4678 1 19 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.005 -0.074 25881
4679 1 19 . 1 1 20 20 CYS C C 20 176.321 176.321 174.092 2.229 25881
4680 1 19 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.670 1.622 25881
4681 1 19 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.750 4.116 25881
4682 1 19 . 1 1 20 20 CYS H H 20 9.391 9.391 8.609 0.782 25881
4683 1 19 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.365 0.035 25881
4684 1 19 . 1 1 21 21 PRO C C 21 176.764 176.764 176.843 -0.079 25881
4685 1 19 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.608 -0.173 25881
4686 1 19 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.640 0.685 25881
4687 1 19 . 1 1 22 22 LYS N N 22 120.217 120.217 119.058 1.159 25881
4688 1 19 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.301 -0.103 25881
4689 1 19 . 1 1 22 22 LYS C C 22 176.798 176.798 177.852 -1.054 25881
4690 1 19 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.449 0.178 25881
4691 1 19 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.146 1.116 25881
4692 1 19 . 1 1 22 22 LYS H H 22 8.550 8.550 8.573 -0.023 25881
4693 1 19 . 1 1 23 23 CYS N N 23 115.450 115.450 114.287 1.163 25881
4694 1 19 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.942 0.045 25881
4695 1 19 . 1 1 23 23 CYS C C 23 176.434 176.434 176.288 0.146 25881
4696 1 19 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.648 -0.493 25881
4697 1 19 . 1 1 23 23 CYS CB C 23 32.482 32.482 30.209 2.273 25881
4698 1 19 . 1 1 23 23 CYS H H 23 7.886 7.886 8.417 -0.531 25881
4699 1 19 . 1 1 24 24 GLY N N 24 112.961 112.961 110.587 2.374 25881
4700 1 19 . 1 1 24 24 GLY C C 24 173.369 173.369 173.748 -0.379 25881
4701 1 19 . 1 1 24 24 GLY CA C 24 46.152 46.152 44.968 1.184 25881
4702 1 19 . 1 1 24 24 GLY H H 24 7.958 7.958 8.172 -0.214 25881
4703 1 19 . 1 1 25 25 VAL N N 25 123.968 123.968 119.780 4.188 25881
4704 1 19 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.171 -0.192 25881
4705 1 19 . 1 1 25 25 VAL C C 25 173.934 173.934 174.460 -0.526 25881
4706 1 19 . 1 1 25 25 VAL CA C 25 63.136 63.136 60.862 2.274 25881
4707 1 19 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.752 -1.793 25881
4708 1 19 . 1 1 25 25 VAL H H 25 8.348 8.348 7.386 0.962 25881
4709 1 19 . 1 1 26 26 ARG N N 26 125.641 125.641 124.083 1.558 25881
4710 1 19 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.663 0.597 25881
4711 1 19 . 1 1 26 26 ARG C C 26 177.008 177.008 175.486 1.522 25881
4712 1 19 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.724 -0.396 25881
4713 1 19 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.741 -2.418 25881
4714 1 19 . 1 1 26 26 ARG H H 26 8.379 8.379 8.280 0.099 25881
4715 1 19 . 1 1 27 27 TYR N N 27 117.706 117.706 118.257 -0.551 25881
4716 1 19 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.059 1.634 25881
4717 1 19 . 1 1 27 27 TYR C C 27 175.404 175.404 176.131 -0.727 25881
4718 1 19 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.247 1.229 25881
4719 1 19 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.728 2.175 25881
4720 1 19 . 1 1 27 27 TYR H H 27 8.631 8.631 8.418 0.213 25881
4721 1 19 . 1 1 28 28 CYS N N 28 118.515 118.515 116.109 2.406 25881
4722 1 19 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.919 -0.014 25881
4723 1 19 . 1 1 28 28 CYS C C 28 176.186 176.186 175.100 1.086 25881
4724 1 19 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.042 0.572 25881
4725 1 19 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.601 7.226 25881
4726 1 19 . 1 1 28 28 CYS H H 28 8.817 8.817 8.441 0.376 25881
4727 1 19 . 1 1 29 29 SER N N 29 114.067 114.067 111.936 2.131 25881
4728 1 19 . 1 1 29 29 SER HA H 29 4.877 4.877 3.661 1.216 25881
4729 1 19 . 1 1 29 29 SER C C 29 178.077 178.077 173.305 4.772 25881
4730 1 19 . 1 1 29 29 SER CA C 29 57.260 57.260 57.052 0.208 25881
4731 1 19 . 1 1 29 29 SER CB C 29 65.051 65.051 64.233 0.818 25881
4732 1 19 . 1 1 29 29 SER H H 29 7.400 7.400 7.244 0.156 25881
4733 1 19 . 1 1 30 30 LEU HA H 30 4.039 4.039 4.372 -0.333 25881
4734 1 19 . 1 1 30 30 LEU C C 30 178.077 178.077 177.191 0.886 25881
4735 1 19 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.161 0.290 25881
4736 1 19 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.680 -0.451 25881
4737 1 19 . 1 1 30 30 LEU H H 30 6.951 6.951 8.485 -1.534 25881
4738 1 19 . 1 1 31 31 LYS N N 31 118.534 118.534 118.781 -0.247 25881
4739 1 19 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.026 -0.236 25881
4740 1 19 . 1 1 31 31 LYS C C 31 179.162 179.162 177.189 1.973 25881
4741 1 19 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.796 1.071 25881
4742 1 19 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.412 0.495 25881
4743 1 19 . 1 1 31 31 LYS H H 31 8.030 8.030 8.316 -0.286 25881
4744 1 19 . 1 1 32 32 CYS N N 32 118.700 118.700 115.813 2.887 25881
4745 1 19 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.527 -0.542 25881
4746 1 19 . 1 1 32 32 CYS C C 32 176.766 176.766 176.992 -0.226 25881
4747 1 19 . 1 1 32 32 CYS CA C 32 65.679 65.679 60.101 5.578 25881
4748 1 19 . 1 1 32 32 CYS CB C 32 29.549 29.549 26.732 2.817 25881
4749 1 19 . 1 1 32 32 CYS H H 32 7.424 7.424 7.819 -0.395 25881
4750 1 19 . 1 1 33 33 TYR N N 33 118.151 118.151 123.100 -4.949 25881
4751 1 19 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.194 -0.084 25881
4752 1 19 . 1 1 33 33 TYR C C 33 178.549 178.549 175.921 2.628 25881
4753 1 19 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.361 2.826 25881
4754 1 19 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.847 0.999 25881
4755 1 19 . 1 1 33 33 TYR H H 33 7.918 7.918 7.526 0.392 25881
4756 1 19 . 1 1 34 34 LYS N N 34 114.631 114.631 117.565 -2.934 25881
4757 1 19 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.251 -0.329 25881
4758 1 19 . 1 1 34 34 LYS C C 34 174.991 174.991 175.480 -0.489 25881
4759 1 19 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.964 -0.013 25881
4760 1 19 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.022 1.123 25881
4761 1 19 . 1 1 34 34 LYS H H 34 7.939 7.939 7.673 0.266 25881
4762 1 19 . 1 1 35 35 ASP N N 35 121.194 121.194 120.154 1.040 25881
4763 1 19 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.700 -0.406 25881
4764 1 19 . 1 1 35 35 ASP C C 35 175.480 175.480 175.088 0.392 25881
4765 1 19 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.204 1.135 25881
4766 1 19 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.701 -3.340 25881
4767 1 19 . 1 1 35 35 ASP H H 35 7.115 7.115 7.955 -0.840 25881
4768 1 19 . 1 1 36 36 ALA N N 36 130.311 130.311 125.270 5.041 25881
4769 1 19 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.927 -1.040 25881
4770 1 19 . 1 1 36 36 ALA C C 36 177.717 177.717 176.880 0.837 25881
4771 1 19 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.301 2.224 25881
4772 1 19 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.449 -0.738 25881
4773 1 19 . 1 1 36 36 ALA H H 36 8.073 8.073 8.518 -0.445 25881
4774 1 19 . 1 1 37 37 ALA N N 37 117.133 117.133 121.356 -4.223 25881
4775 1 19 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.439 -0.353 25881
4776 1 19 . 1 1 37 37 ALA C C 37 178.989 178.989 178.492 0.497 25881
4777 1 19 . 1 1 37 37 ALA CA C 37 53.211 53.211 54.221 -1.010 25881
4778 1 19 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.050 -0.904 25881
4779 1 19 . 1 1 37 37 ALA H H 37 7.839 7.839 8.714 -0.875 25881
4780 1 19 . 1 1 38 38 LYS N N 38 114.127 114.127 115.660 -1.533 25881
4781 1 19 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.525 -0.230 25881
4782 1 19 . 1 1 38 38 LYS C C 38 175.690 175.690 176.784 -1.094 25881
4783 1 19 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.715 -0.512 25881
4784 1 19 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.953 1.194 25881
4785 1 19 . 1 1 38 38 LYS H H 38 7.292 7.292 9.204 -1.912 25881
4786 1 19 . 1 1 39 39 HIS N N 39 122.110 122.110 122.778 -0.668 25881
4787 1 19 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.530 0.233 25881
4788 1 19 . 1 1 39 39 HIS C C 39 171.783 171.783 173.548 -1.765 25881
4789 1 19 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.572 -2.937 25881
4790 1 19 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.809 -2.180 25881
4791 1 19 . 1 1 39 39 HIS H H 39 8.393 8.393 8.448 -0.055 25881
4792 1 19 . 1 1 40 40 VAL N N 40 123.393 123.393 127.823 -4.430 25881
4793 1 19 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.130 -0.383 25881
4794 1 19 . 1 1 40 40 VAL C C 40 175.292 175.292 175.726 -0.434 25881
4795 1 19 . 1 1 40 40 VAL CA C 40 61.164 61.164 62.367 -1.203 25881
4796 1 19 . 1 1 40 40 VAL CB C 40 34.132 34.132 32.605 1.528 25881
4797 1 19 . 1 1 40 40 VAL H H 40 7.811 7.811 8.140 -0.329 25881
4798 1 19 . 1 1 41 41 HIS N N 41 125.669 125.669 128.538 -2.869 25881
4799 1 19 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.564 0.314 25881
4800 1 19 . 1 1 41 41 HIS C C 41 174.640 174.640 173.799 0.841 25881
4801 1 19 . 1 1 41 41 HIS CA C 41 52.900 52.900 55.097 -2.197 25881
4802 1 19 . 1 1 41 41 HIS CB C 41 30.067 30.067 29.776 0.291 25881
4803 1 19 . 1 1 41 41 HIS H H 41 8.512 8.512 8.741 -0.229 25881
4804 1 19 . 1 1 42 42 LYS N N 42 123.564 123.564 118.084 5.480 25881
4805 1 19 . 1 1 42 42 LYS C C 42 176.739 176.739 175.532 1.207 25881
4806 1 19 . 1 1 42 42 LYS CA C 42 56.320 56.320 56.845 -0.525 25881
4807 1 19 . 1 1 42 42 LYS CB C 42 33.229 33.229 32.227 1.002 25881
4808 1 19 . 1 1 42 42 LYS H H 42 8.668 8.668 8.343 0.325 25881
4809 1 19 . 1 1 43 43 GLU N N 43 122.633 122.633 122.009 0.624 25881
4810 1 19 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.432 -0.322 25881
4811 1 19 . 1 1 43 43 GLU C C 43 176.569 176.569 177.790 -1.221 25881
4812 1 19 . 1 1 43 43 GLU CA C 43 57.097 57.097 56.041 1.056 25881
4813 1 19 . 1 1 43 43 GLU CB C 43 29.948 29.948 30.528 -0.580 25881
4814 1 19 . 1 1 43 43 GLU H H 43 8.590 8.590 8.423 0.167 25881
4815 1 19 . 1 1 44 44 SER N N 44 115.147 115.147 114.300 0.847 25881
4816 1 19 . 1 1 44 44 SER HA H 44 4.268 4.268 4.219 0.049 25881
4817 1 19 . 1 1 44 44 SER C C 44 174.336 174.336 175.257 -0.921 25881
4818 1 19 . 1 1 44 44 SER CA C 44 58.348 58.348 60.710 -2.362 25881
4819 1 19 . 1 1 44 44 SER CB C 44 63.724 63.724 63.353 0.371 25881
4820 1 19 . 1 1 44 44 SER H H 44 8.105 8.105 8.481 -0.376 25881
4821 1 19 . 1 1 45 45 GLU N N 45 122.849 122.849 119.931 2.918 25881
4822 1 19 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.413 -0.250 25881
4823 1 19 . 1 1 45 45 GLU C C 45 175.304 175.304 175.416 -0.112 25881
4824 1 19 . 1 1 45 45 GLU CA C 45 56.412 56.412 56.188 0.224 25881
4825 1 19 . 1 1 45 45 GLU CB C 45 30.130 30.130 30.407 -0.277 25881
4826 1 19 . 1 1 45 45 GLU H H 45 8.183 8.183 7.927 0.256 25881
4827 1 20 . 1 1 -1 -1 PRO HA H -1 4.293 4.293 4.524 -0.231 25881
4828 1 20 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 62.711 0.291 25881
4829 1 20 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 32.545 -0.327 25881
4830 1 20 . 1 1 1 1 MET HA H 1 3.967 3.967 4.686 -0.719 25881
4831 1 20 . 1 1 1 1 MET CA C 1 57.335 57.335 54.407 2.928 25881
4832 1 20 . 1 1 1 1 MET CB C 1 34.180 34.180 35.332 -1.152 25881
4833 1 20 . 1 1 2 2 VAL C C 2 175.654 175.654 175.193 0.461 25881
4834 1 20 . 1 1 2 2 VAL CA C 2 55.183 55.183 61.422 -6.239 25881
4835 1 20 . 1 1 2 2 VAL CB C 2 33.173 33.173 30.278 2.895 25881
4836 1 20 . 1 1 3 3 SER N N 3 121.996 121.996 123.341 -1.345 25881
4837 1 20 . 1 1 3 3 SER HA H 3 4.323 4.323 4.310 0.013 25881
4838 1 20 . 1 1 3 3 SER C C 3 176.021 176.021 173.785 2.236 25881
4839 1 20 . 1 1 3 3 SER CA C 3 62.208 62.208 59.614 2.594 25881
4840 1 20 . 1 1 3 3 SER H H 3 8.103 8.103 8.015 0.088 25881
4841 1 20 . 1 1 4 4 SER N N 4 119.715 119.715 117.290 2.425 25881
4842 1 20 . 1 1 4 4 SER HA H 4 4.317 4.317 4.287 0.030 25881
4843 1 20 . 1 1 4 4 SER C C 4 174.010 174.010 173.370 0.640 25881
4844 1 20 . 1 1 4 4 SER CA C 4 58.177 58.177 58.369 -0.192 25881
4845 1 20 . 1 1 4 4 SER CB C 4 63.763 63.763 62.863 0.900 25881
4846 1 20 . 1 1 4 4 SER H H 4 8.298 8.298 8.326 -0.028 25881
4847 1 20 . 1 1 5 5 ALA N N 5 126.016 126.016 125.278 0.738 25881
4848 1 20 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.280 -0.111 25881
4849 1 20 . 1 1 5 5 ALA C C 5 177.297 177.297 176.498 0.799 25881
4850 1 20 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.838 0.546 25881
4851 1 20 . 1 1 5 5 ALA CB C 5 19.106 19.106 19.895 -0.789 25881
4852 1 20 . 1 1 5 5 ALA H H 5 8.119 8.119 8.045 0.074 25881
4853 1 20 . 1 1 6 6 VAL N N 6 119.174 119.174 120.122 -0.948 25881
4854 1 20 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.314 -0.366 25881
4855 1 20 . 1 1 6 6 VAL C C 6 175.743 175.743 174.519 1.224 25881
4856 1 20 . 1 1 6 6 VAL CA C 6 61.668 61.668 61.341 0.327 25881
4857 1 20 . 1 1 6 6 VAL CB C 6 32.841 32.841 35.220 -2.379 25881
4858 1 20 . 1 1 6 6 VAL H H 6 7.861 7.861 8.102 -0.241 25881
4859 1 20 . 1 1 7 7 LYS N N 7 123.999 123.999 124.895 -0.896 25881
4860 1 20 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.665 -0.498 25881
4861 1 20 . 1 1 7 7 LYS C C 7 175.665 175.665 175.348 0.317 25881
4862 1 20 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.075 1.215 25881
4863 1 20 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.645 -0.104 25881
4864 1 20 . 1 1 7 7 LYS H H 7 8.054 8.054 8.267 -0.213 25881
4865 1 20 . 1 1 8 8 CYS N N 8 121.428 121.428 122.358 -0.930 25881
4866 1 20 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.396 -0.753 25881
4867 1 20 . 1 1 8 8 CYS C C 8 177.383 177.383 176.581 0.802 25881
4868 1 20 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.639 0.127 25881
4869 1 20 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.549 4.360 25881
4870 1 20 . 1 1 8 8 CYS H H 8 8.539 8.539 8.809 -0.270 25881
4871 1 20 . 1 1 9 9 GLY N N 9 118.862 118.862 117.096 1.766 25881
4872 1 20 . 1 1 9 9 GLY C C 9 172.770 172.770 173.990 -1.220 25881
4873 1 20 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.789 0.355 25881
4874 1 20 . 1 1 9 9 GLY H H 9 9.365 9.365 8.857 0.508 25881
4875 1 20 . 1 1 10 10 ILE N N 10 122.885 122.885 116.859 6.026 25881
4876 1 20 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.237 -0.256 25881
4877 1 20 . 1 1 10 10 ILE C C 10 175.980 175.980 175.721 0.259 25881
4878 1 20 . 1 1 10 10 ILE CA C 10 63.056 63.056 61.592 1.464 25881
4879 1 20 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.755 -1.811 25881
4880 1 20 . 1 1 10 10 ILE H H 10 8.972 8.972 7.278 1.694 25881
4881 1 20 . 1 1 11 11 CYS N N 11 118.245 118.245 114.845 3.400 25881
4882 1 20 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.815 -0.166 25881
4883 1 20 . 1 1 11 11 CYS C C 11 176.780 176.780 175.091 1.689 25881
4884 1 20 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.716 1.378 25881
4885 1 20 . 1 1 11 11 CYS CB C 11 31.972 31.972 29.698 2.274 25881
4886 1 20 . 1 1 11 11 CYS H H 11 8.466 8.466 7.629 0.837 25881
4887 1 20 . 1 1 12 12 ARG N N 12 116.067 116.067 119.547 -3.480 25881
4888 1 20 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.079 0.137 25881
4889 1 20 . 1 1 12 12 ARG C C 12 175.637 175.637 176.514 -0.877 25881
4890 1 20 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.982 0.978 25881
4891 1 20 . 1 1 12 12 ARG CB C 12 27.104 27.104 27.061 0.042 25881
4892 1 20 . 1 1 12 12 ARG H H 12 7.255 7.255 8.592 -1.337 25881
4893 1 20 . 1 1 13 13 GLY N N 13 109.951 109.951 105.316 4.635 25881
4894 1 20 . 1 1 13 13 GLY C C 13 173.169 173.169 173.597 -0.428 25881
4895 1 20 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.730 -1.425 25881
4896 1 20 . 1 1 13 13 GLY H H 13 8.795 8.795 7.901 0.894 25881
4897 1 20 . 1 1 14 14 VAL N N 14 113.644 113.644 116.222 -2.578 25881
4898 1 20 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.653 -0.609 25881
4899 1 20 . 1 1 14 14 VAL C C 14 174.970 174.970 174.530 0.440 25881
4900 1 20 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.810 2.421 25881
4901 1 20 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.596 0.242 25881
4902 1 20 . 1 1 14 14 VAL H H 14 7.266 7.266 7.722 -0.456 25881
4903 1 20 . 1 1 15 15 ASP N N 15 119.913 119.913 119.145 0.768 25881
4904 1 20 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.725 -0.494 25881
4905 1 20 . 1 1 15 15 ASP C C 15 176.279 176.279 177.241 -0.962 25881
4906 1 20 . 1 1 15 15 ASP CA C 15 55.023 55.023 54.662 0.361 25881
4907 1 20 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.657 -0.710 25881
4908 1 20 . 1 1 15 15 ASP H H 15 8.223 8.223 8.355 -0.132 25881
4909 1 20 . 1 1 16 16 GLY N N 16 109.534 109.534 107.933 1.601 25881
4910 1 20 . 1 1 16 16 GLY C C 16 173.120 173.120 174.893 -1.773 25881
4911 1 20 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.209 1.887 25881
4912 1 20 . 1 1 16 16 GLY H H 16 8.617 8.617 8.688 -0.071 25881
4913 1 20 . 1 1 17 17 LYS N N 17 121.534 121.534 123.072 -1.538 25881
4914 1 20 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.020 -0.375 25881
4915 1 20 . 1 1 17 17 LYS C C 17 175.029 175.029 177.354 -2.325 25881
4916 1 20 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.722 -1.211 25881
4917 1 20 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.632 0.513 25881
4918 1 20 . 1 1 17 17 LYS H H 17 7.318 7.318 7.817 -0.499 25881
4919 1 20 . 1 1 18 18 TYR N N 18 119.391 119.391 120.354 -0.963 25881
4920 1 20 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.595 -0.143 25881
4921 1 20 . 1 1 18 18 TYR C C 18 174.241 174.241 174.987 -0.746 25881
4922 1 20 . 1 1 18 18 TYR CA C 18 55.548 55.548 57.473 -1.925 25881
4923 1 20 . 1 1 18 18 TYR CB C 18 38.496 38.496 39.830 -1.334 25881
4924 1 20 . 1 1 18 18 TYR H H 18 7.661 7.661 8.114 -0.453 25881
4925 1 20 . 1 1 19 19 LYS N N 19 120.140 120.140 122.430 -2.290 25881
4926 1 20 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.563 0.378 25881
4927 1 20 . 1 1 19 19 LYS C C 19 176.321 176.321 174.551 1.770 25881
4928 1 20 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.030 0.534 25881
4929 1 20 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.805 0.213 25881
4930 1 20 . 1 1 19 19 LYS H H 19 8.395 8.395 8.189 0.206 25881
4931 1 20 . 1 1 20 20 CYS N N 20 131.127 131.127 124.745 6.382 25881
4932 1 20 . 1 1 20 20 CYS HA H 20 4.931 4.931 4.995 -0.064 25881
4933 1 20 . 1 1 20 20 CYS C C 20 176.321 176.321 174.063 2.258 25881
4934 1 20 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.594 1.698 25881
4935 1 20 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.737 4.129 25881
4936 1 20 . 1 1 20 20 CYS H H 20 9.391 9.391 8.531 0.860 25881
4937 1 20 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.374 0.026 25881
4938 1 20 . 1 1 21 21 PRO C C 21 176.764 176.764 176.782 -0.018 25881
4939 1 20 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.511 -0.076 25881
4940 1 20 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.595 0.731 25881
4941 1 20 . 1 1 22 22 LYS N N 22 120.217 120.217 119.164 1.053 25881
4942 1 20 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.323 -0.125 25881
4943 1 20 . 1 1 22 22 LYS C C 22 176.798 176.798 177.867 -1.069 25881
4944 1 20 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.482 0.145 25881
4945 1 20 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.359 0.903 25881
4946 1 20 . 1 1 22 22 LYS H H 22 8.550 8.550 8.407 0.143 25881
4947 1 20 . 1 1 23 23 CYS N N 23 115.450 115.450 114.153 1.297 25881
4948 1 20 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.962 0.025 25881
4949 1 20 . 1 1 23 23 CYS C C 23 176.434 176.434 176.409 0.025 25881
4950 1 20 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.670 -0.515 25881
4951 1 20 . 1 1 23 23 CYS CB C 23 32.482 32.482 30.295 2.187 25881
4952 1 20 . 1 1 23 23 CYS H H 23 7.886 7.886 8.344 -0.458 25881
4953 1 20 . 1 1 24 24 GLY N N 24 112.961 112.961 109.970 2.991 25881
4954 1 20 . 1 1 24 24 GLY C C 24 173.369 173.369 174.080 -0.711 25881
4955 1 20 . 1 1 24 24 GLY CA C 24 46.152 46.152 44.899 1.253 25881
4956 1 20 . 1 1 24 24 GLY H H 24 7.958 7.958 8.430 -0.472 25881
4957 1 20 . 1 1 25 25 VAL N N 25 123.968 123.968 120.961 3.007 25881
4958 1 20 . 1 1 25 25 VAL HA H 25 3.979 3.979 3.934 0.045 25881
4959 1 20 . 1 1 25 25 VAL C C 25 173.934 173.934 174.261 -0.327 25881
4960 1 20 . 1 1 25 25 VAL CA C 25 63.136 63.136 61.789 1.347 25881
4961 1 20 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.147 -1.188 25881
4962 1 20 . 1 1 25 25 VAL H H 25 8.348 8.348 7.214 1.134 25881
4963 1 20 . 1 1 26 26 ARG N N 26 125.641 125.641 125.310 0.331 25881
4964 1 20 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.687 0.573 25881
4965 1 20 . 1 1 26 26 ARG C C 26 177.008 177.008 175.322 1.686 25881
4966 1 20 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.599 -0.271 25881
4967 1 20 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.307 -1.984 25881
4968 1 20 . 1 1 26 26 ARG H H 26 8.379 8.379 8.374 0.005 25881
4969 1 20 . 1 1 27 27 TYR N N 27 117.706 117.706 118.517 -0.811 25881
4970 1 20 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.056 1.637 25881
4971 1 20 . 1 1 27 27 TYR C C 27 175.404 175.404 176.150 -0.746 25881
4972 1 20 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.237 1.239 25881
4973 1 20 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.825 2.078 25881
4974 1 20 . 1 1 27 27 TYR H H 27 8.631 8.631 8.308 0.323 25881
4975 1 20 . 1 1 28 28 CYS N N 28 118.515 118.515 115.976 2.539 25881
4976 1 20 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.973 -0.068 25881
4977 1 20 . 1 1 28 28 CYS C C 28 176.186 176.186 175.150 1.036 25881
4978 1 20 . 1 1 28 28 CYS CA C 28 58.614 58.614 57.935 0.679 25881
4979 1 20 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.793 7.034 25881
4980 1 20 . 1 1 28 28 CYS H H 28 8.817 8.817 8.390 0.427 25881
4981 1 20 . 1 1 29 29 SER N N 29 114.067 114.067 112.034 2.033 25881
4982 1 20 . 1 1 29 29 SER HA H 29 4.877 4.877 3.905 0.972 25881
4983 1 20 . 1 1 29 29 SER C C 29 178.077 178.077 173.396 4.681 25881
4984 1 20 . 1 1 29 29 SER CA C 29 57.260 57.260 56.892 0.368 25881
4985 1 20 . 1 1 29 29 SER CB C 29 65.051 65.051 64.392 0.659 25881
4986 1 20 . 1 1 29 29 SER H H 29 7.400 7.400 7.269 0.131 25881
4987 1 20 . 1 1 30 30 LEU HA H 30 4.039 4.039 4.140 -0.101 25881
4988 1 20 . 1 1 30 30 LEU C C 30 178.077 178.077 177.311 0.766 25881
4989 1 20 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.303 0.148 25881
4990 1 20 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.638 -0.409 25881
4991 1 20 . 1 1 30 30 LEU H H 30 6.951 6.951 8.498 -1.548 25881
4992 1 20 . 1 1 31 31 LYS N N 31 118.534 118.534 119.678 -1.144 25881
4993 1 20 . 1 1 31 31 LYS HA H 31 3.790 3.790 3.950 -0.160 25881
4994 1 20 . 1 1 31 31 LYS C C 31 179.162 179.162 177.904 1.258 25881
4995 1 20 . 1 1 31 31 LYS CA C 31 59.867 59.867 59.002 0.865 25881
4996 1 20 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.232 0.675 25881
4997 1 20 . 1 1 31 31 LYS H H 31 8.030 8.030 8.123 -0.093 25881
4998 1 20 . 1 1 32 32 CYS N N 32 118.700 118.700 117.016 1.684 25881
4999 1 20 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.500 -0.515 25881
5000 1 20 . 1 1 32 32 CYS C C 32 176.766 176.766 177.158 -0.392 25881
5001 1 20 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.829 5.850 25881
5002 1 20 . 1 1 32 32 CYS CB C 32 29.549 29.549 26.750 2.799 25881
5003 1 20 . 1 1 32 32 CYS H H 32 7.424 7.424 7.975 -0.551 25881
5004 1 20 . 1 1 33 33 TYR N N 33 118.151 118.151 123.502 -5.351 25881
5005 1 20 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.336 -0.226 25881
5006 1 20 . 1 1 33 33 TYR C C 33 178.549 178.549 176.111 2.438 25881
5007 1 20 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.824 2.364 25881
5008 1 20 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.722 1.124 25881
5009 1 20 . 1 1 33 33 TYR H H 33 7.918 7.918 7.718 0.200 25881
5010 1 20 . 1 1 34 34 LYS N N 34 114.631 114.631 117.733 -3.102 25881
5011 1 20 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.345 -0.423 25881
5012 1 20 . 1 1 34 34 LYS C C 34 174.991 174.991 175.303 -0.312 25881
5013 1 20 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.444 0.507 25881
5014 1 20 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.164 0.981 25881
5015 1 20 . 1 1 34 34 LYS H H 34 7.939 7.939 7.799 0.140 25881
5016 1 20 . 1 1 35 35 ASP N N 35 121.194 121.194 120.309 0.885 25881
5017 1 20 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.724 -0.430 25881
5018 1 20 . 1 1 35 35 ASP C C 35 175.480 175.480 174.875 0.605 25881
5019 1 20 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.397 0.942 25881
5020 1 20 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.069 -2.708 25881
5021 1 20 . 1 1 35 35 ASP H H 35 7.115 7.115 7.730 -0.615 25881
5022 1 20 . 1 1 36 36 ALA N N 36 130.311 130.311 126.872 3.439 25881
5023 1 20 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.909 -1.022 25881
5024 1 20 . 1 1 36 36 ALA C C 36 177.717 177.717 176.631 1.086 25881
5025 1 20 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.638 1.888 25881
5026 1 20 . 1 1 36 36 ALA CB C 36 18.711 18.711 18.897 -0.186 25881
5027 1 20 . 1 1 36 36 ALA H H 36 8.073 8.073 8.617 -0.544 25881
5028 1 20 . 1 1 37 37 ALA N N 37 117.133 117.133 122.654 -5.521 25881
5029 1 20 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.434 -0.348 25881
5030 1 20 . 1 1 37 37 ALA C C 37 178.989 178.989 178.672 0.317 25881
5031 1 20 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.519 -0.308 25881
5032 1 20 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.231 -1.084 25881
5033 1 20 . 1 1 37 37 ALA H H 37 7.839 7.839 8.782 -0.943 25881
5034 1 20 . 1 1 38 38 LYS N N 38 114.127 114.127 116.973 -2.846 25881
5035 1 20 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.500 -0.205 25881
5036 1 20 . 1 1 38 38 LYS C C 38 175.690 175.690 176.869 -1.179 25881
5037 1 20 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.866 -0.663 25881
5038 1 20 . 1 1 38 38 LYS CB C 38 36.148 36.148 33.621 2.527 25881
5039 1 20 . 1 1 38 38 LYS H H 38 7.292 7.292 9.163 -1.871 25881
5040 1 20 . 1 1 39 39 HIS N N 39 122.110 122.110 121.776 0.334 25881
5041 1 20 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.487 0.276 25881
5042 1 20 . 1 1 39 39 HIS C C 39 171.783 171.783 173.730 -1.947 25881
5043 1 20 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.668 -3.033 25881
5044 1 20 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.353 -1.724 25881
5045 1 20 . 1 1 39 39 HIS H H 39 8.393 8.393 7.852 0.541 25881
5046 1 20 . 1 1 40 40 VAL N N 40 123.393 123.393 126.644 -3.251 25881
5047 1 20 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.208 -0.461 25881
5048 1 20 . 1 1 40 40 VAL C C 40 175.292 175.292 175.219 0.073 25881
5049 1 20 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.300 -0.135 25881
5050 1 20 . 1 1 40 40 VAL CB C 40 34.132 34.132 33.184 0.948 25881
5051 1 20 . 1 1 40 40 VAL H H 40 7.811 7.811 8.105 -0.294 25881
5052 1 20 . 1 1 41 41 HIS N N 41 125.669 125.669 127.116 -1.447 25881
5053 1 20 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.752 0.126 25881
5054 1 20 . 1 1 41 41 HIS C C 41 174.640 174.640 174.576 0.064 25881
5055 1 20 . 1 1 41 41 HIS CA C 41 52.900 52.900 55.047 -2.147 25881
5056 1 20 . 1 1 41 41 HIS CB C 41 30.067 30.067 29.854 0.213 25881
5057 1 20 . 1 1 41 41 HIS H H 41 8.512 8.512 8.575 -0.063 25881
5058 1 20 . 1 1 42 42 LYS N N 42 123.564 123.564 126.415 -2.851 25881
5059 1 20 . 1 1 42 42 LYS C C 42 176.739 176.739 176.237 0.502 25881
5060 1 20 . 1 1 42 42 LYS CA C 42 56.320 56.320 56.127 0.194 25881
5061 1 20 . 1 1 42 42 LYS CB C 42 33.229 33.229 33.282 -0.053 25881
5062 1 20 . 1 1 42 42 LYS H H 42 8.668 8.668 8.400 0.268 25881
5063 1 20 . 1 1 43 43 GLU N N 43 122.633 122.633 120.575 2.058 25881
5064 1 20 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.499 -0.389 25881
5065 1 20 . 1 1 43 43 GLU C C 43 176.569 176.569 175.936 0.633 25881
5066 1 20 . 1 1 43 43 GLU CA C 43 57.097 57.097 55.999 1.098 25881
5067 1 20 . 1 1 43 43 GLU CB C 43 29.948 29.948 31.043 -1.095 25881
5068 1 20 . 1 1 43 43 GLU H H 43 8.590 8.590 8.548 0.042 25881
5069 1 20 . 1 1 44 44 SER N N 44 115.147 115.147 117.363 -2.216 25881
5070 1 20 . 1 1 44 44 SER HA H 44 4.268 4.268 4.584 -0.316 25881
5071 1 20 . 1 1 44 44 SER C C 44 174.336 174.336 174.043 0.293 25881
5072 1 20 . 1 1 44 44 SER CA C 44 58.348 58.348 58.843 -0.495 25881
5073 1 20 . 1 1 44 44 SER CB C 44 63.724 63.724 63.039 0.685 25881
5074 1 20 . 1 1 44 44 SER H H 44 8.105 8.105 8.354 -0.249 25881
5075 1 20 . 1 1 45 45 GLU N N 45 122.849 122.849 121.677 1.172 25881
5076 1 20 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.538 -0.375 25881
5077 1 20 . 1 1 45 45 GLU C C 45 175.304 175.304 175.738 -0.434 25881
5078 1 20 . 1 1 45 45 GLU CA C 45 56.412 56.412 56.206 0.206 25881
5079 1 20 . 1 1 45 45 GLU CB C 45 30.130 30.130 28.613 1.517 25881
5080 1 20 . 1 1 45 45 GLU H H 45 8.183 8.183 8.836 -0.653 25881
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 41 2.933 -0.732 2.875 25881
2 1 1 "Average Difference" HA 48 0.520 0.161 0.499 25881
3 1 1 "Average Difference" C 44 1.365 -0.229 1.361 25881
4 1 1 "Average Difference" CA 46 1.853 -0.365 1.837 25881
5 1 1 "Average Difference" CB 41 2.071 -0.514 2.031 25881
6 1 1 "Average Difference" HN 42 0.674 0.126 0.670 25881
7 1 2 "Average Difference" N 41 3.277 -0.464 3.284 25881
8 1 2 "Average Difference" HA 48 0.512 0.157 0.492 25881
9 1 2 "Average Difference" C 44 1.357 -0.266 1.346 25881
10 1 2 "Average Difference" CA 46 2.178 -0.261 2.186 25881
11 1 2 "Average Difference" CB 41 2.017 -0.440 1.993 25881
12 1 2 "Average Difference" HN 42 0.658 0.076 0.661 25881
13 1 3 "Average Difference" N 41 2.776 -0.559 2.753 25881
14 1 3 "Average Difference" HA 48 0.500 0.179 0.471 25881
15 1 3 "Average Difference" C 44 1.346 -0.279 1.332 25881
16 1 3 "Average Difference" CA 46 2.056 -0.337 2.050 25881
17 1 3 "Average Difference" CB 41 2.004 -0.378 1.993 25881
18 1 3 "Average Difference" HN 42 0.662 0.102 0.662 25881
19 1 4 "Average Difference" N 41 3.084 -0.619 3.059 25881
20 1 4 "Average Difference" HA 48 0.488 0.151 0.469 25881
21 1 4 "Average Difference" C 44 1.375 -0.233 1.371 25881
22 1 4 "Average Difference" CA 46 1.874 -0.179 1.886 25881
23 1 4 "Average Difference" CB 41 1.990 -0.397 1.975 25881
24 1 4 "Average Difference" HN 42 0.658 0.091 0.659 25881
25 1 5 "Average Difference" N 41 3.183 -0.621 3.161 25881
26 1 5 "Average Difference" HA 48 0.519 0.171 0.496 25881
27 1 5 "Average Difference" C 44 1.384 -0.286 1.369 25881
28 1 5 "Average Difference" CA 46 1.878 -0.356 1.864 25881
29 1 5 "Average Difference" CB 41 1.937 -0.410 1.917 25881
30 1 5 "Average Difference" HN 42 0.678 0.080 0.681 25881
31 1 6 "Average Difference" N 41 3.079 -0.421 3.088 25881
32 1 6 "Average Difference" HA 48 0.503 0.133 0.490 25881
33 1 6 "Average Difference" C 44 1.357 -0.271 1.346 25881
34 1 6 "Average Difference" CA 46 2.014 -0.250 2.020 25881
35 1 6 "Average Difference" CB 41 2.029 -0.411 2.012 25881
36 1 6 "Average Difference" HN 42 0.652 0.070 0.656 25881
37 1 7 "Average Difference" N 41 3.078 -0.668 3.043 25881
38 1 7 "Average Difference" HA 48 0.519 0.189 0.488 25881
39 1 7 "Average Difference" C 44 1.410 -0.305 1.392 25881
40 1 7 "Average Difference" CA 46 2.031 -0.366 2.020 25881
41 1 7 "Average Difference" CB 41 2.023 -0.516 1.981 25881
42 1 7 "Average Difference" HN 42 0.648 0.039 0.654 25881
43 1 8 "Average Difference" N 41 3.063 -0.570 3.046 25881
44 1 8 "Average Difference" HA 48 0.514 0.185 0.484 25881
45 1 8 "Average Difference" C 44 1.281 -0.266 1.267 25881
46 1 8 "Average Difference" CA 46 1.976 -0.398 1.957 25881
47 1 8 "Average Difference" CB 41 1.881 -0.387 1.864 25881
48 1 8 "Average Difference" HN 42 0.655 0.057 0.661 25881
49 1 9 "Average Difference" N 41 3.080 -0.448 3.085 25881
50 1 9 "Average Difference" HA 48 0.519 0.195 0.486 25881
51 1 9 "Average Difference" C 44 1.290 -0.156 1.295 25881
52 1 9 "Average Difference" CA 46 2.034 -0.311 2.032 25881
53 1 9 "Average Difference" CB 41 1.879 -0.426 1.853 25881
54 1 9 "Average Difference" HN 42 0.633 0.053 0.638 25881
55 1 10 "Average Difference" N 41 3.144 -0.927 3.041 25881
56 1 10 "Average Difference" HA 48 0.508 0.167 0.485 25881
57 1 10 "Average Difference" C 44 1.365 -0.371 1.328 25881
58 1 10 "Average Difference" CA 46 2.039 -0.388 2.024 25881
59 1 10 "Average Difference" CB 41 1.969 -0.401 1.952 25881
60 1 10 "Average Difference" HN 42 0.668 0.082 0.671 25881
61 1 11 "Average Difference" N 41 2.862 -0.577 2.838 25881
62 1 11 "Average Difference" HA 48 0.506 0.174 0.480 25881
63 1 11 "Average Difference" C 44 1.352 -0.226 1.349 25881
64 1 11 "Average Difference" CA 46 1.988 -0.275 1.991 25881
65 1 11 "Average Difference" CB 41 2.114 -0.520 2.075 25881
66 1 11 "Average Difference" HN 42 0.635 0.067 0.640 25881
67 1 12 "Average Difference" N 41 2.806 -0.595 2.776 25881
68 1 12 "Average Difference" HA 48 0.509 0.175 0.483 25881
69 1 12 "Average Difference" C 44 1.297 -0.186 1.299 25881
70 1 12 "Average Difference" CA 46 2.036 -0.242 2.044 25881
71 1 12 "Average Difference" CB 41 1.984 -0.405 1.967 25881
72 1 12 "Average Difference" HN 42 0.649 0.100 0.649 25881
73 1 13 "Average Difference" N 41 3.115 -0.820 3.043 25881
74 1 13 "Average Difference" HA 48 0.506 0.171 0.482 25881
75 1 13 "Average Difference" C 44 1.426 -0.387 1.389 25881
76 1 13 "Average Difference" CA 46 2.044 -0.414 2.023 25881
77 1 13 "Average Difference" CB 41 1.977 -0.450 1.949 25881
78 1 13 "Average Difference" HN 42 0.666 0.067 0.671 25881
79 1 14 "Average Difference" N 41 2.994 -0.707 2.945 25881
80 1 14 "Average Difference" HA 48 0.504 0.152 0.485 25881
81 1 14 "Average Difference" C 44 1.302 -0.153 1.308 25881
82 1 14 "Average Difference" CA 46 1.927 -0.280 1.927 25881
83 1 14 "Average Difference" CB 41 1.878 -0.416 1.854 25881
84 1 14 "Average Difference" HN 42 0.633 0.070 0.637 25881
85 1 15 "Average Difference" N 41 3.068 -0.463 3.071 25881
86 1 15 "Average Difference" HA 48 0.506 0.166 0.483 25881
87 1 15 "Average Difference" C 44 1.392 -0.225 1.390 25881
88 1 15 "Average Difference" CA 46 2.180 -0.218 2.193 25881
89 1 15 "Average Difference" CB 41 1.960 -0.383 1.947 25881
90 1 15 "Average Difference" HN 42 0.649 0.089 0.650 25881
91 1 16 "Average Difference" N 41 2.839 -0.363 2.851 25881
92 1 16 "Average Difference" HA 48 0.522 0.178 0.496 25881
93 1 16 "Average Difference" C 44 1.357 -0.260 1.347 25881
94 1 16 "Average Difference" CA 46 1.996 -0.262 2.001 25881
95 1 16 "Average Difference" CB 41 2.034 -0.591 1.970 25881
96 1 16 "Average Difference" HN 42 0.660 0.106 0.659 25881
97 1 17 "Average Difference" N 41 2.900 -0.493 2.893 25881
98 1 17 "Average Difference" HA 48 0.529 0.158 0.510 25881
99 1 17 "Average Difference" C 44 1.331 -0.214 1.328 25881
100 1 17 "Average Difference" CA 46 2.241 -0.307 2.245 25881
101 1 17 "Average Difference" CB 41 1.996 -0.606 1.926 25881
102 1 17 "Average Difference" HN 42 0.641 0.014 0.649 25881
103 1 18 "Average Difference" N 41 3.027 -0.591 3.005 25881
104 1 18 "Average Difference" HA 48 0.500 0.146 0.484 25881
105 1 18 "Average Difference" C 44 1.327 -0.242 1.319 25881
106 1 18 "Average Difference" CA 46 1.886 -0.311 1.880 25881
107 1 18 "Average Difference" CB 41 2.072 -0.540 2.025 25881
108 1 18 "Average Difference" HN 42 0.646 0.092 0.647 25881
109 1 19 "Average Difference" N 41 2.986 -0.724 2.933 25881
110 1 19 "Average Difference" HA 48 0.514 0.150 0.497 25881
111 1 19 "Average Difference" C 44 1.379 -0.203 1.379 25881
112 1 19 "Average Difference" CA 46 2.232 -0.247 2.243 25881
113 1 19 "Average Difference" CB 41 2.006 -0.506 1.965 25881
114 1 19 "Average Difference" HN 42 0.646 0.077 0.650 25881
115 1 20 "Average Difference" N 41 2.757 -0.172 2.786 25881
116 1 20 "Average Difference" HA 48 0.508 0.163 0.486 25881
117 1 20 "Average Difference" C 44 1.319 -0.293 1.301 25881
118 1 20 "Average Difference" CA 46 1.796 -0.425 1.764 25881
119 1 20 "Average Difference" CB 41 1.996 -0.527 1.949 25881
120 1 20 "Average Difference" HN 42 0.671 0.084 0.673 25881
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 25881
_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 -1 -1 PRO HA H -1 4.293 4.293 4.438 -0.145 25881
2 1 . 1 1 -1 -1 PRO CA C -1 63.002 63.002 63.251 -0.249 25881
3 1 . 1 1 -1 -1 PRO CB C -1 32.218 32.218 31.762 0.456 25881
4 1 . 1 1 1 1 MET HA H 1 3.967 3.967 4.487 -0.520 25881
5 1 . 1 1 1 1 MET CA C 1 57.335 57.335 55.134 2.201 25881
6 1 . 1 1 1 1 MET CB C 1 34.180 34.180 33.732 0.448 25881
7 1 . 1 1 2 2 VAL C C 2 175.654 175.654 175.792 -0.138 25881
8 1 . 1 1 2 2 VAL CA C 2 55.183 55.183 63.073 -7.890 25881
9 1 . 1 1 2 2 VAL CB C 2 33.173 33.173 31.462 1.711 25881
10 1 . 1 1 3 3 SER N N 3 121.996 121.996 116.683 5.313 25881
11 1 . 1 1 3 3 SER HA H 3 4.323 4.323 4.482 -0.159 25881
12 1 . 1 1 3 3 SER C C 3 176.021 176.021 174.320 1.701 25881
13 1 . 1 1 3 3 SER CA C 3 62.208 62.208 58.670 3.538 25881
14 1 . 1 1 3 3 SER H H 3 8.103 8.103 8.084 0.019 25881
15 1 . 1 1 4 4 SER N N 4 119.715 119.715 117.368 2.347 25881
16 1 . 1 1 4 4 SER HA H 4 4.317 4.317 4.376 -0.059 25881
17 1 . 1 1 4 4 SER C C 4 174.010 174.010 173.917 0.093 25881
18 1 . 1 1 4 4 SER CA C 4 58.177 58.177 58.870 -0.693 25881
19 1 . 1 1 4 4 SER CB C 4 63.763 63.763 63.028 0.735 25881
20 1 . 1 1 4 4 SER H H 4 8.298 8.298 8.260 0.038 25881
21 1 . 1 1 5 5 ALA N N 5 126.016 126.016 123.980 2.036 25881
22 1 . 1 1 5 5 ALA HA H 5 4.169 4.169 4.500 -0.331 25881
23 1 . 1 1 5 5 ALA C C 5 177.297 177.297 175.888 1.409 25881
24 1 . 1 1 5 5 ALA CA C 5 52.384 52.384 51.698 0.686 25881
25 1 . 1 1 5 5 ALA CB C 5 19.106 19.106 20.356 -1.250 25881
26 1 . 1 1 5 5 ALA H H 5 8.119 8.119 7.790 0.329 25881
27 1 . 1 1 6 6 VAL N N 6 119.174 119.174 119.834 -0.660 25881
28 1 . 1 1 6 6 VAL HA H 6 3.948 3.948 4.344 -0.395 25881
29 1 . 1 1 6 6 VAL C C 6 175.743 175.743 174.710 1.033 25881
30 1 . 1 1 6 6 VAL CA C 6 61.668 61.668 60.783 0.885 25881
31 1 . 1 1 6 6 VAL CB C 6 32.841 32.841 34.869 -2.028 25881
32 1 . 1 1 6 6 VAL H H 6 7.861 7.861 8.248 -0.387 25881
33 1 . 1 1 7 7 LYS N N 7 123.999 123.999 124.515 -0.516 25881
34 1 . 1 1 7 7 LYS HA H 7 4.167 4.167 4.684 -0.517 25881
35 1 . 1 1 7 7 LYS C C 7 175.665 175.665 175.848 -0.183 25881
36 1 . 1 1 7 7 LYS CA C 7 55.290 55.290 54.060 1.230 25881
37 1 . 1 1 7 7 LYS CB C 7 33.541 33.541 33.505 0.036 25881
38 1 . 1 1 7 7 LYS H H 7 8.054 8.054 8.247 -0.193 25881
39 1 . 1 1 8 8 CYS N N 8 121.428 121.428 122.413 -0.985 25881
40 1 . 1 1 8 8 CYS HA H 8 3.643 3.643 4.416 -0.773 25881
41 1 . 1 1 8 8 CYS C C 8 177.383 177.383 176.390 0.993 25881
42 1 . 1 1 8 8 CYS CA C 8 59.766 59.766 59.729 0.037 25881
43 1 . 1 1 8 8 CYS CB C 8 30.909 30.909 26.668 4.241 25881
44 1 . 1 1 8 8 CYS H H 8 8.539 8.539 8.828 -0.289 25881
45 1 . 1 1 9 9 GLY N N 9 118.862 118.862 116.608 2.254 25881
46 1 . 1 1 9 9 GLY C C 9 172.770 172.770 174.622 -1.852 25881
47 1 . 1 1 9 9 GLY CA C 9 46.144 46.144 45.851 0.293 25881
48 1 . 1 1 9 9 GLY H H 9 9.365 9.365 8.960 0.405 25881
49 1 . 1 1 10 10 ILE N N 10 122.885 122.885 118.406 4.479 25881
50 1 . 1 1 10 10 ILE HA H 10 3.982 3.982 4.229 -0.247 25881
51 1 . 1 1 10 10 ILE C C 10 175.980 175.980 175.529 0.451 25881
52 1 . 1 1 10 10 ILE CA C 10 63.056 63.056 62.490 0.566 25881
53 1 . 1 1 10 10 ILE CB C 10 37.944 37.944 39.362 -1.418 25881
54 1 . 1 1 10 10 ILE H H 10 8.972 8.972 7.341 1.631 25881
55 1 . 1 1 11 11 CYS N N 11 118.245 118.245 113.803 4.442 25881
56 1 . 1 1 11 11 CYS HA H 11 4.649 4.649 4.822 -0.173 25881
57 1 . 1 1 11 11 CYS C C 11 176.780 176.780 175.138 1.642 25881
58 1 . 1 1 11 11 CYS CA C 11 59.094 59.094 57.740 1.354 25881
59 1 . 1 1 11 11 CYS CB C 11 31.972 31.972 29.921 2.051 25881
60 1 . 1 1 11 11 CYS H H 11 8.466 8.466 7.651 0.815 25881
61 1 . 1 1 12 12 ARG N N 12 116.067 116.067 119.968 -3.901 25881
62 1 . 1 1 12 12 ARG HA H 12 4.216 4.216 4.123 0.093 25881
63 1 . 1 1 12 12 ARG C C 12 175.637 175.637 176.472 -0.835 25881
64 1 . 1 1 12 12 ARG CA C 12 57.960 57.960 56.813 1.147 25881
65 1 . 1 1 12 12 ARG CB C 12 27.104 27.104 26.885 0.219 25881
66 1 . 1 1 12 12 ARG H H 12 7.255 7.255 8.488 -1.233 25881
67 1 . 1 1 13 13 GLY N N 13 109.951 109.951 106.660 3.291 25881
68 1 . 1 1 13 13 GLY C C 13 173.169 173.169 173.823 -0.654 25881
69 1 . 1 1 13 13 GLY CA C 13 44.304 44.304 45.876 -1.572 25881
70 1 . 1 1 13 13 GLY H H 13 8.795 8.795 7.991 0.804 25881
71 1 . 1 1 14 14 VAL N N 14 113.644 113.644 115.944 -2.300 25881
72 1 . 1 1 14 14 VAL HA H 14 4.044 4.044 4.708 -0.664 25881
73 1 . 1 1 14 14 VAL C C 14 174.970 174.970 174.391 0.579 25881
74 1 . 1 1 14 14 VAL CA C 14 61.231 61.231 58.996 2.235 25881
75 1 . 1 1 14 14 VAL CB C 14 33.838 33.838 33.650 0.188 25881
76 1 . 1 1 14 14 VAL H H 14 7.266 7.266 7.782 -0.516 25881
77 1 . 1 1 15 15 ASP N N 15 119.913 119.913 119.364 0.549 25881
78 1 . 1 1 15 15 ASP HA H 15 4.231 4.231 4.705 -0.474 25881
79 1 . 1 1 15 15 ASP C C 15 176.279 176.279 176.888 -0.609 25881
80 1 . 1 1 15 15 ASP CA C 15 55.023 55.023 55.013 0.010 25881
81 1 . 1 1 15 15 ASP CB C 15 39.947 39.947 40.886 -0.939 25881
82 1 . 1 1 15 15 ASP H H 15 8.223 8.223 8.397 -0.174 25881
83 1 . 1 1 16 16 GLY N N 16 109.534 109.534 107.965 1.569 25881
84 1 . 1 1 16 16 GLY C C 16 173.120 173.120 174.841 -1.721 25881
85 1 . 1 1 16 16 GLY CA C 16 46.096 46.096 44.216 1.880 25881
86 1 . 1 1 16 16 GLY H H 16 8.617 8.617 8.764 -0.147 25881
87 1 . 1 1 17 17 LYS N N 17 121.534 121.534 123.263 -1.729 25881
88 1 . 1 1 17 17 LYS HA H 17 3.645 3.645 4.040 -0.395 25881
89 1 . 1 1 17 17 LYS C C 17 175.029 175.029 177.135 -2.106 25881
90 1 . 1 1 17 17 LYS CA C 17 57.511 57.511 58.413 -0.902 25881
91 1 . 1 1 17 17 LYS CB C 17 33.144 33.144 32.643 0.501 25881
92 1 . 1 1 17 17 LYS H H 17 7.318 7.318 7.774 -0.456 25881
93 1 . 1 1 18 18 TYR N N 18 119.391 119.391 120.122 -0.731 25881
94 1 . 1 1 18 18 TYR HA H 18 4.452 4.452 4.626 -0.174 25881
95 1 . 1 1 18 18 TYR C C 18 174.241 174.241 174.824 -0.583 25881
96 1 . 1 1 18 18 TYR CA C 18 55.548 55.548 57.478 -1.930 25881
97 1 . 1 1 18 18 TYR CB C 18 38.496 38.496 40.415 -1.919 25881
98 1 . 1 1 18 18 TYR H H 18 7.661 7.661 8.083 -0.422 25881
99 1 . 1 1 19 19 LYS N N 19 120.140 120.140 121.996 -1.856 25881
100 1 . 1 1 19 19 LYS HA H 19 4.941 4.941 4.540 0.401 25881
101 1 . 1 1 19 19 LYS C C 19 176.321 176.321 174.469 1.852 25881
102 1 . 1 1 19 19 LYS CA C 19 54.564 54.564 54.152 0.412 25881
103 1 . 1 1 19 19 LYS CB C 19 36.018 36.018 35.895 0.123 25881
104 1 . 1 1 19 19 LYS H H 19 8.395 8.395 8.254 0.141 25881
105 1 . 1 1 20 20 CYS N N 20 131.127 131.127 124.738 6.389 25881
106 1 . 1 1 20 20 CYS HA H 20 4.931 4.931 5.017 -0.086 25881
107 1 . 1 1 20 20 CYS C C 20 176.321 176.321 174.083 2.238 25881
108 1 . 1 1 20 20 CYS CA C 20 57.292 57.292 55.617 1.675 25881
109 1 . 1 1 20 20 CYS CB C 20 30.866 30.866 26.821 4.045 25881
110 1 . 1 1 20 20 CYS H H 20 9.391 9.391 8.583 0.808 25881
111 1 . 1 1 21 21 PRO HA H 21 4.400 4.400 4.372 0.028 25881
112 1 . 1 1 21 21 PRO C C 21 176.764 176.764 176.767 -0.003 25881
113 1 . 1 1 21 21 PRO CA C 21 64.435 64.435 64.561 -0.126 25881
114 1 . 1 1 21 21 PRO CB C 21 32.325 32.325 31.593 0.732 25881
115 1 . 1 1 22 22 LYS N N 22 120.217 120.217 118.643 1.574 25881
116 1 . 1 1 22 22 LYS HA H 22 4.198 4.198 4.346 -0.148 25881
117 1 . 1 1 22 22 LYS C C 22 176.798 176.798 177.791 -0.993 25881
118 1 . 1 1 22 22 LYS CA C 22 57.627 57.627 57.600 0.027 25881
119 1 . 1 1 22 22 LYS CB C 22 33.262 33.262 32.449 0.813 25881
120 1 . 1 1 22 22 LYS H H 22 8.550 8.550 8.386 0.164 25881
121 1 . 1 1 23 23 CYS N N 23 115.450 115.450 113.923 1.527 25881
122 1 . 1 1 23 23 CYS HA H 23 4.987 4.987 4.919 0.068 25881
123 1 . 1 1 23 23 CYS C C 23 176.434 176.434 176.279 0.155 25881
124 1 . 1 1 23 23 CYS CA C 23 58.155 58.155 58.414 -0.259 25881
125 1 . 1 1 23 23 CYS CB C 23 32.482 32.482 30.131 2.351 25881
126 1 . 1 1 23 23 CYS H H 23 7.886 7.886 8.224 -0.338 25881
127 1 . 1 1 24 24 GLY N N 24 112.961 112.961 110.520 2.441 25881
128 1 . 1 1 24 24 GLY C C 24 173.369 173.369 173.813 -0.444 25881
129 1 . 1 1 24 24 GLY CA C 24 46.152 46.152 44.985 1.167 25881
130 1 . 1 1 24 24 GLY H H 24 7.958 7.958 8.334 -0.376 25881
131 1 . 1 1 25 25 VAL N N 25 123.968 123.968 119.824 4.144 25881
132 1 . 1 1 25 25 VAL HA H 25 3.979 3.979 4.060 -0.081 25881
133 1 . 1 1 25 25 VAL C C 25 173.934 173.934 174.377 -0.443 25881
134 1 . 1 1 25 25 VAL CA C 25 63.136 63.136 61.076 2.060 25881
135 1 . 1 1 25 25 VAL CB C 25 31.959 31.959 33.372 -1.413 25881
136 1 . 1 1 25 25 VAL H H 25 8.348 8.348 7.279 1.069 25881
137 1 . 1 1 26 26 ARG N N 26 125.641 125.641 124.696 0.945 25881
138 1 . 1 1 26 26 ARG HA H 26 5.260 5.260 4.670 0.590 25881
139 1 . 1 1 26 26 ARG C C 26 177.008 177.008 175.402 1.606 25881
140 1 . 1 1 26 26 ARG CA C 26 53.328 53.328 53.692 -0.364 25881
141 1 . 1 1 26 26 ARG CB C 26 29.323 29.323 31.380 -2.057 25881
142 1 . 1 1 26 26 ARG H H 26 8.379 8.379 8.313 0.066 25881
143 1 . 1 1 27 27 TYR N N 27 117.706 117.706 118.645 -0.939 25881
144 1 . 1 1 27 27 TYR HA H 27 6.693 6.693 5.073 1.620 25881
145 1 . 1 1 27 27 TYR C C 27 175.404 175.404 176.306 -0.902 25881
146 1 . 1 1 27 27 TYR CA C 27 55.476 55.476 54.217 1.259 25881
147 1 . 1 1 27 27 TYR CB C 27 41.903 41.903 39.689 2.214 25881
148 1 . 1 1 27 27 TYR H H 27 8.631 8.631 8.255 0.376 25881
149 1 . 1 1 28 28 CYS N N 28 118.515 118.515 116.390 2.125 25881
150 1 . 1 1 28 28 CYS HA H 28 4.905 4.905 4.977 -0.072 25881
151 1 . 1 1 28 28 CYS C C 28 176.186 176.186 175.060 1.126 25881
152 1 . 1 1 28 28 CYS CA C 28 58.614 58.614 58.361 0.252 25881
153 1 . 1 1 28 28 CYS CB C 28 34.827 34.827 27.896 6.931 25881
154 1 . 1 1 28 28 CYS H H 28 8.817 8.817 8.390 0.427 25881
155 1 . 1 1 29 29 SER N N 29 114.067 114.067 112.416 1.651 25881
156 1 . 1 1 29 29 SER HA H 29 4.877 4.877 4.093 0.784 25881
157 1 . 1 1 29 29 SER C C 29 178.077 178.077 173.529 4.548 25881
158 1 . 1 1 29 29 SER CA C 29 57.260 57.260 57.221 0.039 25881
159 1 . 1 1 29 29 SER CB C 29 65.051 65.051 64.199 0.852 25881
160 1 . 1 1 29 29 SER H H 29 7.400 7.400 7.390 0.010 25881
161 1 . 1 1 30 30 LEU HA H 30 4.039 4.039 4.072 -0.033 25881
162 1 . 1 1 30 30 LEU C C 30 178.077 178.077 177.788 0.289 25881
163 1 . 1 1 30 30 LEU CA C 30 57.451 57.451 57.438 0.013 25881
164 1 . 1 1 30 30 LEU CB C 30 41.229 41.229 41.538 -0.309 25881
165 1 . 1 1 30 30 LEU H H 30 6.951 6.951 8.415 -1.464 25881
166 1 . 1 1 31 31 LYS N N 31 118.534 118.534 118.535 -0.002 25881
167 1 . 1 1 31 31 LYS HA H 31 3.790 3.790 4.018 -0.228 25881
168 1 . 1 1 31 31 LYS C C 31 179.162 179.162 177.320 1.842 25881
169 1 . 1 1 31 31 LYS CA C 31 59.867 59.867 58.779 1.088 25881
170 1 . 1 1 31 31 LYS CB C 31 31.907 31.907 31.544 0.363 25881
171 1 . 1 1 31 31 LYS H H 31 8.030 8.030 8.106 -0.076 25881
172 1 . 1 1 32 32 CYS N N 32 118.700 118.700 116.090 2.610 25881
173 1 . 1 1 32 32 CYS HA H 32 3.985 3.985 4.601 -0.616 25881
174 1 . 1 1 32 32 CYS C C 32 176.766 176.766 176.911 -0.145 25881
175 1 . 1 1 32 32 CYS CA C 32 65.679 65.679 59.627 6.052 25881
176 1 . 1 1 32 32 CYS CB C 32 29.549 29.549 27.414 2.135 25881
177 1 . 1 1 32 32 CYS H H 32 7.424 7.424 7.655 -0.231 25881
178 1 . 1 1 33 33 TYR N N 33 118.151 118.151 123.527 -5.376 25881
179 1 . 1 1 33 33 TYR HA H 33 3.110 3.110 3.301 -0.191 25881
180 1 . 1 1 33 33 TYR C C 33 178.549 178.549 176.085 2.464 25881
181 1 . 1 1 33 33 TYR CA C 33 61.187 61.187 58.666 2.521 25881
182 1 . 1 1 33 33 TYR CB C 33 38.846 38.846 37.780 1.066 25881
183 1 . 1 1 33 33 TYR H H 33 7.918 7.918 7.826 0.092 25881
184 1 . 1 1 34 34 LYS N N 34 114.631 114.631 117.853 -3.222 25881
185 1 . 1 1 34 34 LYS HA H 34 3.922 3.922 4.267 -0.345 25881
186 1 . 1 1 34 34 LYS C C 34 174.991 174.991 175.406 -0.415 25881
187 1 . 1 1 34 34 LYS CA C 34 55.951 55.951 55.694 0.257 25881
188 1 . 1 1 34 34 LYS CB C 34 32.145 32.145 31.083 1.062 25881
189 1 . 1 1 34 34 LYS H H 34 7.939 7.939 7.699 0.240 25881
190 1 . 1 1 35 35 ASP N N 35 121.194 121.194 120.147 1.046 25881
191 1 . 1 1 35 35 ASP HA H 35 4.294 4.294 4.705 -0.410 25881
192 1 . 1 1 35 35 ASP C C 35 175.480 175.480 174.988 0.492 25881
193 1 . 1 1 35 35 ASP CA C 35 54.339 54.339 53.284 1.055 25881
194 1 . 1 1 35 35 ASP CB C 35 40.361 40.361 43.347 -2.987 25881
195 1 . 1 1 35 35 ASP H H 35 7.115 7.115 7.864 -0.749 25881
196 1 . 1 1 36 36 ALA N N 36 130.311 130.311 126.031 4.280 25881
197 1 . 1 1 36 36 ALA HA H 36 3.887 3.887 4.921 -1.034 25881
198 1 . 1 1 36 36 ALA C C 36 177.717 177.717 176.634 1.083 25881
199 1 . 1 1 36 36 ALA CA C 36 53.526 53.526 51.621 1.905 25881
200 1 . 1 1 36 36 ALA CB C 36 18.711 18.711 19.186 -0.475 25881
201 1 . 1 1 36 36 ALA H H 36 8.073 8.073 8.552 -0.479 25881
202 1 . 1 1 37 37 ALA N N 37 117.133 117.133 122.370 -5.237 25881
203 1 . 1 1 37 37 ALA HA H 37 4.086 4.086 4.387 -0.301 25881
204 1 . 1 1 37 37 ALA C C 37 178.989 178.989 178.583 0.407 25881
205 1 . 1 1 37 37 ALA CA C 37 53.211 53.211 53.734 -0.523 25881
206 1 . 1 1 37 37 ALA CB C 37 19.147 19.147 20.113 -0.966 25881
207 1 . 1 1 37 37 ALA H H 37 7.839 7.839 8.681 -0.842 25881
208 1 . 1 1 38 38 LYS N N 38 114.127 114.127 116.241 -2.114 25881
209 1 . 1 1 38 38 LYS HA H 38 4.295 4.295 4.491 -0.196 25881
210 1 . 1 1 38 38 LYS C C 38 175.690 175.690 176.876 -1.186 25881
211 1 . 1 1 38 38 LYS CA C 38 56.203 56.203 56.847 -0.644 25881
212 1 . 1 1 38 38 LYS CB C 38 36.148 36.148 34.424 1.724 25881
213 1 . 1 1 38 38 LYS H H 38 7.292 7.292 9.133 -1.841 25881
214 1 . 1 1 39 39 HIS N N 39 122.110 122.110 122.033 0.077 25881
215 1 . 1 1 39 39 HIS HA H 39 4.763 4.763 4.531 0.232 25881
216 1 . 1 1 39 39 HIS C C 39 171.783 171.783 173.493 -1.710 25881
217 1 . 1 1 39 39 HIS CA C 39 52.635 52.635 55.539 -2.904 25881
218 1 . 1 1 39 39 HIS CB C 39 27.629 27.629 29.724 -2.095 25881
219 1 . 1 1 39 39 HIS H H 39 8.393 8.393 8.335 0.058 25881
220 1 . 1 1 40 40 VAL N N 40 123.393 123.393 126.979 -3.586 25881
221 1 . 1 1 40 40 VAL HA H 40 3.747 3.747 4.194 -0.447 25881
222 1 . 1 1 40 40 VAL C C 40 175.292 175.292 175.387 -0.095 25881
223 1 . 1 1 40 40 VAL CA C 40 61.164 61.164 61.691 -0.527 25881
224 1 . 1 1 40 40 VAL CB C 40 34.132 34.132 33.268 0.864 25881
225 1 . 1 1 40 40 VAL H H 40 7.811 7.811 8.173 -0.362 25881
226 1 . 1 1 41 41 HIS N N 41 125.669 125.669 126.529 -0.860 25881
227 1 . 1 1 41 41 HIS HA H 41 4.878 4.878 4.666 0.212 25881
228 1 . 1 1 41 41 HIS C C 41 174.640 174.640 174.851 -0.211 25881
229 1 . 1 1 41 41 HIS CA C 41 52.900 52.900 55.399 -2.499 25881
230 1 . 1 1 41 41 HIS CB C 41 30.067 30.067 31.044 -0.977 25881
231 1 . 1 1 41 41 HIS H H 41 8.512 8.512 8.600 -0.088 25881
232 1 . 1 1 42 42 LYS N N 42 123.564 123.564 122.168 1.396 25881
233 1 . 1 1 42 42 LYS C C 42 176.739 176.739 176.139 0.600 25881
234 1 . 1 1 42 42 LYS CA C 42 56.320 56.320 56.330 -0.010 25881
235 1 . 1 1 42 42 LYS CB C 42 33.229 33.229 32.916 0.313 25881
236 1 . 1 1 42 42 LYS H H 42 8.668 8.668 8.358 0.310 25881
237 1 . 1 1 43 43 GLU N N 43 122.633 122.633 120.548 2.085 25881
238 1 . 1 1 43 43 GLU HA H 43 4.110 4.110 4.268 -0.158 25881
239 1 . 1 1 43 43 GLU C C 43 176.569 176.569 176.176 0.393 25881
240 1 . 1 1 43 43 GLU CA C 43 57.097 57.097 56.891 0.206 25881
241 1 . 1 1 43 43 GLU CB C 43 29.948 29.948 29.652 0.296 25881
242 1 . 1 1 43 43 GLU H H 43 8.590 8.590 8.494 0.096 25881
243 1 . 1 1 44 44 SER N N 44 115.147 115.147 116.504 -1.357 25881
244 1 . 1 1 44 44 SER HA H 44 4.268 4.268 4.455 -0.188 25881
245 1 . 1 1 44 44 SER C C 44 174.336 174.336 174.355 -0.019 25881
246 1 . 1 1 44 44 SER CA C 44 58.348 58.348 58.609 -0.261 25881
247 1 . 1 1 44 44 SER CB C 44 63.724 63.724 63.298 0.426 25881
248 1 . 1 1 44 44 SER H H 44 8.105 8.105 8.273 -0.168 25881
249 1 . 1 1 45 45 GLU N N 45 122.849 122.849 122.405 0.444 25881
250 1 . 1 1 45 45 GLU HA H 45 4.163 4.163 4.319 -0.156 25881
251 1 . 1 1 45 45 GLU C C 45 175.304 175.304 175.940 -0.636 25881
252 1 . 1 1 45 45 GLU CA C 45 56.412 56.412 56.869 -0.457 25881
253 1 . 1 1 45 45 GLU CB C 45 30.130 30.130 29.288 0.842 25881
254 1 . 1 1 45 45 GLU H H 45 8.183 8.183 8.487 -0.304 25881
stop_
save_