data_25691
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 25691
_Entry.PDB_ID 2N52
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 25691
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 GLY N N 2 109.255 109.255 106.744 2.511 25691
2 1 1 . 1 1 3 3 GLY N N 3 108.760 108.760 107.316 1.444 25691
3 1 1 . 1 1 4 4 GLN N N 4 119.481 119.481 119.238 0.243 25691
4 1 1 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.610 -0.214 25691
5 1 1 . 1 1 5 5 VAL N N 5 121.615 121.615 122.704 -1.089 25691
6 1 1 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.096 0.029 25691
7 1 1 . 1 1 6 6 ASP N N 6 125.372 125.372 123.915 1.457 25691
8 1 1 . 1 1 7 7 CYS N N 7 123.728 123.728 122.861 0.867 25691
9 1 1 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.252 0.774 25691
10 1 1 . 1 1 8 8 GLY N N 8 111.717 111.717 111.629 0.088 25691
11 1 1 . 1 1 9 9 GLU N N 9 119.502 119.502 119.861 -0.359 25691
12 1 1 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.129 -0.088 25691
13 1 1 . 1 1 10 10 PHE N N 10 116.513 116.513 118.285 -1.772 25691
14 1 1 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.264 0.518 25691
15 1 1 . 1 1 11 11 GLN N N 11 118.042 118.042 115.334 2.708 25691
16 1 1 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.093 -0.130 25691
17 1 1 . 1 1 12 12 ASP N N 12 120.313 120.313 113.316 6.997 25691
18 1 1 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.530 -0.027 25691
19 1 1 . 1 1 13 13 THR N N 13 118.013 118.013 113.866 4.147 25691
20 1 1 . 1 1 13 13 THR HA H 13 4.090 4.090 3.460 0.630 25691
21 1 1 . 1 1 14 14 LYS N N 14 119.942 119.942 121.244 -1.302 25691
22 1 1 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.454 -0.293 25691
23 1 1 . 1 1 15 15 VAL N N 15 120.212 120.212 121.758 -1.546 25691
24 1 1 . 1 1 15 15 VAL HA H 15 3.888 3.888 4.069 -0.181 25691
25 1 1 . 1 1 16 16 TYR N N 16 126.887 126.887 121.903 4.984 25691
26 1 1 . 1 1 16 16 TYR HA H 16 4.683 4.683 5.183 -0.500 25691
27 1 1 . 1 1 17 17 CYS N N 17 120.474 120.474 120.203 0.271 25691
28 1 1 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.726 0.222 25691
29 1 1 . 1 1 18 18 THR N N 18 113.766 113.766 110.842 2.924 25691
30 1 1 . 1 1 18 18 THR HA H 18 4.656 4.656 4.524 0.132 25691
31 1 1 . 1 1 19 19 ARG N N 19 116.621 116.621 121.246 -4.625 25691
32 1 1 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.379 -0.065 25691
33 1 1 . 1 1 20 20 GLU N N 20 121.887 121.887 119.532 2.355 25691
34 1 1 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.588 -0.477 25691
35 1 1 . 1 1 21 21 SER N N 21 118.596 118.596 116.364 2.232 25691
36 1 1 . 1 1 21 21 SER HA H 21 3.858 3.858 4.560 -0.702 25691
37 1 1 . 1 1 22 22 ASN N N 22 122.807 122.807 124.208 -1.401 25691
38 1 1 . 1 1 22 22 ASN HA H 22 5.019 5.019 5.195 -0.176 25691
39 1 1 . 1 1 24 24 HIS N N 24 121.461 121.461 119.480 1.981 25691
40 1 1 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.247 -1.118 25691
41 1 1 . 1 1 25 25 CYS N N 25 122.306 122.306 125.836 -3.530 25691
42 1 1 . 1 1 25 25 CYS HA H 25 5.096 5.096 5.201 -0.105 25691
43 1 1 . 1 1 26 26 GLY N N 26 116.561 116.561 114.824 1.737 25691
44 1 1 . 1 1 27 27 SER N N 27 116.705 116.705 116.861 -0.156 25691
45 1 1 . 1 1 27 27 SER HA H 27 3.999 3.999 4.246 -0.247 25691
46 1 1 . 1 1 28 28 ASP N N 28 121.184 121.184 119.065 2.119 25691
47 1 1 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.590 -0.113 25691
48 1 1 . 1 1 29 29 GLY N N 29 109.717 109.717 107.065 2.652 25691
49 1 1 . 1 1 30 30 GLN N N 30 119.919 119.919 120.846 -0.927 25691
50 1 1 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.288 0.006 25691
51 1 1 . 1 1 31 31 THR N N 31 120.852 120.852 116.210 4.642 25691
52 1 1 . 1 1 31 31 THR HA H 31 4.612 4.612 5.039 -0.427 25691
53 1 1 . 1 1 32 32 TYR N N 32 129.107 129.107 125.120 3.987 25691
54 1 1 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.724 -0.239 25691
55 1 1 . 1 1 33 33 GLY N N 33 109.097 109.097 110.612 -1.515 25691
56 1 1 . 1 1 34 34 ASN N N 34 109.942 109.942 113.601 -3.659 25691
57 1 1 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.052 0.012 25691
58 1 1 . 1 1 35 35 LYS N N 35 119.128 119.128 119.585 -0.457 25691
59 1 1 . 1 1 35 35 LYS HA H 35 3.029 3.029 3.973 -0.944 25691
60 1 1 . 1 1 36 36 CYS N N 36 119.799 119.799 117.687 2.112 25691
61 1 1 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.151 -1.582 25691
62 1 1 . 1 1 37 37 ALA N N 37 122.356 122.356 121.887 0.469 25691
63 1 1 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.130 -0.251 25691
64 1 1 . 1 1 38 38 PHE N N 38 119.315 119.315 117.666 1.649 25691
65 1 1 . 1 1 38 38 PHE HA H 38 3.588 3.588 3.675 -0.087 25691
66 1 1 . 1 1 39 39 CYS N N 39 117.511 117.511 119.252 -1.741 25691
67 1 1 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.680 0.306 25691
68 1 1 . 1 1 40 40 LYS N N 40 119.465 119.465 119.531 -0.066 25691
69 1 1 . 1 1 40 40 LYS HA H 40 3.854 3.854 3.964 -0.110 25691
70 1 1 . 1 1 41 41 ALA N N 41 123.083 123.083 120.822 2.261 25691
71 1 1 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.077 -0.025 25691
72 1 1 . 1 1 42 42 ILE N N 42 120.832 120.832 119.077 1.755 25691
73 1 1 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.411 -0.201 25691
74 1 1 . 1 1 43 43 VAL N N 43 121.341 121.341 119.250 2.091 25691
75 1 1 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.499 0.191 25691
76 1 1 . 1 1 44 44 LYS N N 44 122.202 122.202 119.570 2.632 25691
77 1 1 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.073 0.001 25691
78 1 1 . 1 1 45 45 SER N N 45 111.517 111.517 112.711 -1.194 25691
79 1 1 . 1 1 45 45 SER HA H 45 4.475 4.475 4.658 -0.183 25691
80 1 1 . 1 1 46 46 GLY N N 46 112.139 112.139 109.446 2.693 25691
81 1 1 . 1 1 47 47 GLY N N 47 105.513 105.513 106.982 -1.469 25691
82 1 1 . 1 1 48 48 LYS N N 48 118.918 118.918 120.401 -1.483 25691
83 1 1 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.233 -0.086 25691
84 1 1 . 1 1 49 49 ILE N N 49 118.074 118.074 121.127 -3.053 25691
85 1 1 . 1 1 49 49 ILE HA H 49 3.963 3.963 3.949 0.014 25691
86 1 1 . 1 1 50 50 SER N N 50 118.567 118.567 118.269 0.298 25691
87 1 1 . 1 1 50 50 SER HA H 50 4.677 4.677 4.824 -0.147 25691
88 1 1 . 1 1 51 51 LEU N N 51 121.924 121.924 122.000 -0.076 25691
89 1 1 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.485 -0.149 25691
90 1 1 . 1 1 52 52 LYS N N 52 131.859 131.859 124.660 7.199 25691
91 1 1 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.334 -0.019 25691
92 1 1 . 1 1 53 53 HIS N N 53 107.367 107.367 117.484 -10.117 25691
93 1 1 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.904 -0.024 25691
94 1 1 . 1 1 55 55 GLY N N 55 114.104 114.104 113.257 0.847 25691
95 1 1 . 1 1 56 56 LYS N N 56 113.793 113.793 118.175 -4.382 25691
96 1 1 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.329 -0.351 25691
97 1 2 . 1 1 2 2 GLY N N 2 109.255 109.255 113.153 -3.898 25691
98 1 2 . 1 1 3 3 GLY N N 3 108.760 108.760 113.169 -4.409 25691
99 1 2 . 1 1 4 4 GLN N N 4 119.481 119.481 122.528 -3.047 25691
100 1 2 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.344 0.052 25691
101 1 2 . 1 1 5 5 VAL N N 5 121.615 121.615 120.879 0.736 25691
102 1 2 . 1 1 5 5 VAL HA H 5 4.125 4.125 3.983 0.142 25691
103 1 2 . 1 1 6 6 ASP N N 6 125.372 125.372 127.761 -2.389 25691
104 1 2 . 1 1 7 7 CYS N N 7 123.728 123.728 118.811 4.917 25691
105 1 2 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.254 0.772 25691
106 1 2 . 1 1 8 8 GLY N N 8 111.717 111.717 109.734 1.983 25691
107 1 2 . 1 1 9 9 GLU N N 9 119.502 119.502 119.831 -0.329 25691
108 1 2 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.199 -0.158 25691
109 1 2 . 1 1 10 10 PHE N N 10 116.513 116.513 114.062 2.451 25691
110 1 2 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.078 0.704 25691
111 1 2 . 1 1 11 11 GLN N N 11 118.042 118.042 114.827 3.215 25691
112 1 2 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.373 -0.410 25691
113 1 2 . 1 1 12 12 ASP N N 12 120.313 120.313 120.582 -0.269 25691
114 1 2 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.631 -0.128 25691
115 1 2 . 1 1 13 13 THR N N 13 118.013 118.013 113.637 4.376 25691
116 1 2 . 1 1 13 13 THR HA H 13 4.090 4.090 4.296 -0.206 25691
117 1 2 . 1 1 14 14 LYS N N 14 119.942 119.942 121.958 -2.016 25691
118 1 2 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.105 0.056 25691
119 1 2 . 1 1 15 15 VAL N N 15 120.212 120.212 121.148 -0.936 25691
120 1 2 . 1 1 15 15 VAL HA H 15 3.888 3.888 3.808 0.080 25691
121 1 2 . 1 1 16 16 TYR N N 16 126.887 126.887 125.354 1.533 25691
122 1 2 . 1 1 16 16 TYR HA H 16 4.683 4.683 4.402 0.281 25691
123 1 2 . 1 1 17 17 CYS N N 17 120.474 120.474 114.790 5.684 25691
124 1 2 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.793 0.155 25691
125 1 2 . 1 1 18 18 THR N N 18 113.766 113.766 112.240 1.526 25691
126 1 2 . 1 1 18 18 THR HA H 18 4.656 4.656 4.647 0.009 25691
127 1 2 . 1 1 19 19 ARG N N 19 116.621 116.621 118.197 -1.576 25691
128 1 2 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.270 0.044 25691
129 1 2 . 1 1 20 20 GLU N N 20 121.887 121.887 121.321 0.566 25691
130 1 2 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.415 -0.304 25691
131 1 2 . 1 1 21 21 SER N N 21 118.596 118.596 116.886 1.710 25691
132 1 2 . 1 1 21 21 SER HA H 21 3.858 3.858 4.519 -0.661 25691
133 1 2 . 1 1 22 22 ASN N N 22 122.807 122.807 121.790 1.017 25691
134 1 2 . 1 1 22 22 ASN HA H 22 5.019 5.019 4.918 0.101 25691
135 1 2 . 1 1 24 24 HIS N N 24 121.461 121.461 119.839 1.622 25691
136 1 2 . 1 1 24 24 HIS HA H 24 4.129 4.129 4.981 -0.852 25691
137 1 2 . 1 1 25 25 CYS N N 25 122.306 122.306 124.562 -2.256 25691
138 1 2 . 1 1 25 25 CYS HA H 25 5.096 5.096 4.863 0.233 25691
139 1 2 . 1 1 26 26 GLY N N 26 116.561 116.561 115.801 0.760 25691
140 1 2 . 1 1 27 27 SER N N 27 116.705 116.705 118.310 -1.605 25691
141 1 2 . 1 1 27 27 SER HA H 27 3.999 3.999 4.220 -0.221 25691
142 1 2 . 1 1 28 28 ASP N N 28 121.184 121.184 119.405 1.779 25691
143 1 2 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.587 -0.110 25691
144 1 2 . 1 1 29 29 GLY N N 29 109.717 109.717 107.777 1.940 25691
145 1 2 . 1 1 30 30 GLN N N 30 119.919 119.919 121.493 -1.574 25691
146 1 2 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.203 0.091 25691
147 1 2 . 1 1 31 31 THR N N 31 120.852 120.852 119.578 1.274 25691
148 1 2 . 1 1 31 31 THR HA H 31 4.612 4.612 5.220 -0.608 25691
149 1 2 . 1 1 32 32 TYR N N 32 129.107 129.107 126.030 3.077 25691
150 1 2 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.782 -0.297 25691
151 1 2 . 1 1 33 33 GLY N N 33 109.097 109.097 109.753 -0.656 25691
152 1 2 . 1 1 34 34 ASN N N 34 109.942 109.942 113.096 -3.154 25691
153 1 2 . 1 1 34 34 ASN HA H 34 5.064 5.064 4.874 0.190 25691
154 1 2 . 1 1 35 35 LYS N N 35 119.128 119.128 119.964 -0.836 25691
155 1 2 . 1 1 35 35 LYS HA H 35 3.029 3.029 4.019 -0.990 25691
156 1 2 . 1 1 36 36 CYS N N 36 119.799 119.799 118.346 1.453 25691
157 1 2 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.256 -1.687 25691
158 1 2 . 1 1 37 37 ALA N N 37 122.356 122.356 122.599 -0.243 25691
159 1 2 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.064 -0.185 25691
160 1 2 . 1 1 38 38 PHE N N 38 119.315 119.315 118.761 0.554 25691
161 1 2 . 1 1 38 38 PHE HA H 38 3.588 3.588 3.744 -0.156 25691
162 1 2 . 1 1 39 39 CYS N N 39 117.511 117.511 118.640 -1.129 25691
163 1 2 . 1 1 39 39 CYS HA H 39 3.986 3.986 4.037 -0.051 25691
164 1 2 . 1 1 40 40 LYS N N 40 119.465 119.465 118.784 0.681 25691
165 1 2 . 1 1 40 40 LYS HA H 40 3.854 3.854 4.093 -0.239 25691
166 1 2 . 1 1 41 41 ALA N N 41 123.083 123.083 120.248 2.835 25691
167 1 2 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.141 -0.089 25691
168 1 2 . 1 1 42 42 ILE N N 42 120.832 120.832 120.182 0.650 25691
169 1 2 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.302 -0.092 25691
170 1 2 . 1 1 43 43 VAL N N 43 121.341 121.341 118.483 2.858 25691
171 1 2 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.593 0.097 25691
172 1 2 . 1 1 44 44 LYS N N 44 122.202 122.202 116.146 6.056 25691
173 1 2 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.096 -0.022 25691
174 1 2 . 1 1 45 45 SER N N 45 111.517 111.517 112.623 -1.106 25691
175 1 2 . 1 1 45 45 SER HA H 45 4.475 4.475 4.313 0.162 25691
176 1 2 . 1 1 46 46 GLY N N 46 112.139 112.139 106.354 5.785 25691
177 1 2 . 1 1 47 47 GLY N N 47 105.513 105.513 108.666 -3.153 25691
178 1 2 . 1 1 48 48 LYS N N 48 118.918 118.918 119.170 -0.252 25691
179 1 2 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.026 0.121 25691
180 1 2 . 1 1 49 49 ILE N N 49 118.074 118.074 117.887 0.187 25691
181 1 2 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.108 -0.145 25691
182 1 2 . 1 1 50 50 SER N N 50 118.567 118.567 120.998 -2.431 25691
183 1 2 . 1 1 50 50 SER HA H 50 4.677 4.677 5.010 -0.333 25691
184 1 2 . 1 1 51 51 LEU N N 51 121.924 121.924 122.354 -0.430 25691
185 1 2 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.698 -0.362 25691
186 1 2 . 1 1 52 52 LYS N N 52 131.859 131.859 126.062 5.797 25691
187 1 2 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.379 -0.064 25691
188 1 2 . 1 1 53 53 HIS N N 53 107.367 107.367 117.316 -9.949 25691
189 1 2 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.865 0.015 25691
190 1 2 . 1 1 55 55 GLY N N 55 114.104 114.104 111.422 2.682 25691
191 1 2 . 1 1 56 56 LYS N N 56 113.793 113.793 119.145 -5.352 25691
192 1 2 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.152 -0.174 25691
193 1 3 . 1 1 2 2 GLY N N 2 109.255 109.255 106.357 2.898 25691
194 1 3 . 1 1 3 3 GLY N N 3 108.760 108.760 112.650 -3.890 25691
195 1 3 . 1 1 4 4 GLN N N 4 119.481 119.481 121.876 -2.395 25691
196 1 3 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.380 0.016 25691
197 1 3 . 1 1 5 5 VAL N N 5 121.615 121.615 119.190 2.425 25691
198 1 3 . 1 1 5 5 VAL HA H 5 4.125 4.125 3.988 0.137 25691
199 1 3 . 1 1 6 6 ASP N N 6 125.372 125.372 118.103 7.269 25691
200 1 3 . 1 1 7 7 CYS N N 7 123.728 123.728 125.208 -1.480 25691
201 1 3 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.496 0.530 25691
202 1 3 . 1 1 8 8 GLY N N 8 111.717 111.717 110.687 1.030 25691
203 1 3 . 1 1 9 9 GLU N N 9 119.502 119.502 120.731 -1.229 25691
204 1 3 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.405 -0.364 25691
205 1 3 . 1 1 10 10 PHE N N 10 116.513 116.513 118.856 -2.343 25691
206 1 3 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.209 0.573 25691
207 1 3 . 1 1 11 11 GLN N N 11 118.042 118.042 123.118 -5.076 25691
208 1 3 . 1 1 11 11 GLN HA H 11 3.963 3.963 3.915 0.048 25691
209 1 3 . 1 1 12 12 ASP N N 12 120.313 120.313 112.286 8.027 25691
210 1 3 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.404 0.099 25691
211 1 3 . 1 1 13 13 THR N N 13 118.013 118.013 111.541 6.472 25691
212 1 3 . 1 1 13 13 THR HA H 13 4.090 4.090 4.206 -0.116 25691
213 1 3 . 1 1 14 14 LYS N N 14 119.942 119.942 118.624 1.318 25691
214 1 3 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.457 -0.296 25691
215 1 3 . 1 1 15 15 VAL N N 15 120.212 120.212 122.767 -2.555 25691
216 1 3 . 1 1 15 15 VAL HA H 15 3.888 3.888 4.162 -0.274 25691
217 1 3 . 1 1 16 16 TYR N N 16 126.887 126.887 122.558 4.329 25691
218 1 3 . 1 1 16 16 TYR HA H 16 4.683 4.683 5.319 -0.636 25691
219 1 3 . 1 1 17 17 CYS N N 17 120.474 120.474 116.493 3.981 25691
220 1 3 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.883 0.065 25691
221 1 3 . 1 1 18 18 THR N N 18 113.766 113.766 112.526 1.240 25691
222 1 3 . 1 1 18 18 THR HA H 18 4.656 4.656 4.708 -0.052 25691
223 1 3 . 1 1 19 19 ARG N N 19 116.621 116.621 120.145 -3.524 25691
224 1 3 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.416 -0.102 25691
225 1 3 . 1 1 20 20 GLU N N 20 121.887 121.887 121.321 0.566 25691
226 1 3 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.204 -0.093 25691
227 1 3 . 1 1 21 21 SER N N 21 118.596 118.596 119.500 -0.904 25691
228 1 3 . 1 1 21 21 SER HA H 21 3.858 3.858 4.424 -0.566 25691
229 1 3 . 1 1 22 22 ASN N N 22 122.807 122.807 124.675 -1.868 25691
230 1 3 . 1 1 22 22 ASN HA H 22 5.019 5.019 5.098 -0.079 25691
231 1 3 . 1 1 24 24 HIS N N 24 121.461 121.461 122.711 -1.250 25691
232 1 3 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.173 -1.044 25691
233 1 3 . 1 1 25 25 CYS N N 25 122.306 122.306 125.439 -3.133 25691
234 1 3 . 1 1 25 25 CYS HA H 25 5.096 5.096 5.039 0.057 25691
235 1 3 . 1 1 26 26 GLY N N 26 116.561 116.561 114.915 1.646 25691
236 1 3 . 1 1 27 27 SER N N 27 116.705 116.705 117.155 -0.450 25691
237 1 3 . 1 1 27 27 SER HA H 27 3.999 3.999 4.019 -0.020 25691
238 1 3 . 1 1 28 28 ASP N N 28 121.184 121.184 119.796 1.388 25691
239 1 3 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.437 0.040 25691
240 1 3 . 1 1 29 29 GLY N N 29 109.717 109.717 107.659 2.058 25691
241 1 3 . 1 1 30 30 GLN N N 30 119.919 119.919 121.441 -1.522 25691
242 1 3 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.092 0.202 25691
243 1 3 . 1 1 31 31 THR N N 31 120.852 120.852 119.722 1.130 25691
244 1 3 . 1 1 31 31 THR HA H 31 4.612 4.612 5.219 -0.607 25691
245 1 3 . 1 1 32 32 TYR N N 32 129.107 129.107 126.317 2.790 25691
246 1 3 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.733 -0.248 25691
247 1 3 . 1 1 33 33 GLY N N 33 109.097 109.097 109.576 -0.479 25691
248 1 3 . 1 1 34 34 ASN N N 34 109.942 109.942 114.808 -4.866 25691
249 1 3 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.021 0.043 25691
250 1 3 . 1 1 35 35 LYS N N 35 119.128 119.128 119.697 -0.569 25691
251 1 3 . 1 1 35 35 LYS HA H 35 3.029 3.029 4.147 -1.118 25691
252 1 3 . 1 1 36 36 CYS N N 36 119.799 119.799 117.842 1.957 25691
253 1 3 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.080 -1.511 25691
254 1 3 . 1 1 37 37 ALA N N 37 122.356 122.356 122.567 -0.211 25691
255 1 3 . 1 1 37 37 ALA HA H 37 3.879 3.879 3.933 -0.054 25691
256 1 3 . 1 1 38 38 PHE N N 38 119.315 119.315 117.624 1.691 25691
257 1 3 . 1 1 38 38 PHE HA H 38 3.588 3.588 3.996 -0.408 25691
258 1 3 . 1 1 39 39 CYS N N 39 117.511 117.511 120.307 -2.796 25691
259 1 3 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.734 0.252 25691
260 1 3 . 1 1 40 40 LYS N N 40 119.465 119.465 119.188 0.277 25691
261 1 3 . 1 1 40 40 LYS HA H 40 3.854 3.854 4.057 -0.203 25691
262 1 3 . 1 1 41 41 ALA N N 41 123.083 123.083 120.997 2.086 25691
263 1 3 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.205 -0.153 25691
264 1 3 . 1 1 42 42 ILE N N 42 120.832 120.832 119.997 0.835 25691
265 1 3 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.439 -0.229 25691
266 1 3 . 1 1 43 43 VAL N N 43 121.341 121.341 118.853 2.488 25691
267 1 3 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.981 -0.291 25691
268 1 3 . 1 1 44 44 LYS N N 44 122.202 122.202 120.060 2.142 25691
269 1 3 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.176 -0.102 25691
270 1 3 . 1 1 45 45 SER N N 45 111.517 111.517 111.982 -0.465 25691
271 1 3 . 1 1 45 45 SER HA H 45 4.475 4.475 4.700 -0.225 25691
272 1 3 . 1 1 46 46 GLY N N 46 112.139 112.139 107.777 4.362 25691
273 1 3 . 1 1 47 47 GLY N N 47 105.513 105.513 107.550 -2.037 25691
274 1 3 . 1 1 48 48 LYS N N 48 118.918 118.918 119.205 -0.287 25691
275 1 3 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.171 -0.024 25691
276 1 3 . 1 1 49 49 ILE N N 49 118.074 118.074 120.598 -2.524 25691
277 1 3 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.029 -0.066 25691
278 1 3 . 1 1 50 50 SER N N 50 118.567 118.567 119.220 -0.653 25691
279 1 3 . 1 1 50 50 SER HA H 50 4.677 4.677 4.857 -0.180 25691
280 1 3 . 1 1 51 51 LEU N N 51 121.924 121.924 121.483 0.441 25691
281 1 3 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.374 -0.038 25691
282 1 3 . 1 1 52 52 LYS N N 52 131.859 131.859 125.655 6.204 25691
283 1 3 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.163 0.152 25691
284 1 3 . 1 1 53 53 HIS N N 53 107.367 107.367 116.376 -9.009 25691
285 1 3 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.918 -0.038 25691
286 1 3 . 1 1 55 55 GLY N N 55 114.104 114.104 113.014 1.090 25691
287 1 3 . 1 1 56 56 LYS N N 56 113.793 113.793 119.173 -5.380 25691
288 1 3 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.257 -0.279 25691
289 1 4 . 1 1 2 2 GLY N N 2 109.255 109.255 109.281 -0.026 25691
290 1 4 . 1 1 3 3 GLY N N 3 108.760 108.760 107.459 1.301 25691
291 1 4 . 1 1 4 4 GLN N N 4 119.481 119.481 122.534 -3.053 25691
292 1 4 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.359 0.037 25691
293 1 4 . 1 1 5 5 VAL N N 5 121.615 121.615 120.541 1.074 25691
294 1 4 . 1 1 5 5 VAL HA H 5 4.125 4.125 3.988 0.137 25691
295 1 4 . 1 1 6 6 ASP N N 6 125.372 125.372 118.460 6.912 25691
296 1 4 . 1 1 7 7 CYS N N 7 123.728 123.728 122.751 0.977 25691
297 1 4 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.572 0.454 25691
298 1 4 . 1 1 8 8 GLY N N 8 111.717 111.717 111.498 0.219 25691
299 1 4 . 1 1 9 9 GLU N N 9 119.502 119.502 119.582 -0.080 25691
300 1 4 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.199 -0.158 25691
301 1 4 . 1 1 10 10 PHE N N 10 116.513 116.513 116.061 0.452 25691
302 1 4 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.234 0.548 25691
303 1 4 . 1 1 11 11 GLN N N 11 118.042 118.042 116.754 1.288 25691
304 1 4 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.097 -0.134 25691
305 1 4 . 1 1 12 12 ASP N N 12 120.313 120.313 114.685 5.628 25691
306 1 4 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.564 -0.061 25691
307 1 4 . 1 1 13 13 THR N N 13 118.013 118.013 117.553 0.460 25691
308 1 4 . 1 1 13 13 THR HA H 13 4.090 4.090 3.588 0.502 25691
309 1 4 . 1 1 14 14 LYS N N 14 119.942 119.942 120.318 -0.376 25691
310 1 4 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.507 -0.346 25691
311 1 4 . 1 1 15 15 VAL N N 15 120.212 120.212 122.433 -2.221 25691
312 1 4 . 1 1 15 15 VAL HA H 15 3.888 3.888 4.003 -0.115 25691
313 1 4 . 1 1 16 16 TYR N N 16 126.887 126.887 121.525 5.362 25691
314 1 4 . 1 1 16 16 TYR HA H 16 4.683 4.683 5.410 -0.727 25691
315 1 4 . 1 1 17 17 CYS N N 17 120.474 120.474 117.972 2.502 25691
316 1 4 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.783 0.165 25691
317 1 4 . 1 1 18 18 THR N N 18 113.766 113.766 111.685 2.081 25691
318 1 4 . 1 1 18 18 THR HA H 18 4.656 4.656 4.773 -0.117 25691
319 1 4 . 1 1 19 19 ARG N N 19 116.621 116.621 118.924 -2.303 25691
320 1 4 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.441 -0.127 25691
321 1 4 . 1 1 20 20 GLU N N 20 121.887 121.887 120.303 1.584 25691
322 1 4 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.497 -0.386 25691
323 1 4 . 1 1 21 21 SER N N 21 118.596 118.596 118.406 0.190 25691
324 1 4 . 1 1 21 21 SER HA H 21 3.858 3.858 4.482 -0.624 25691
325 1 4 . 1 1 22 22 ASN N N 22 122.807 122.807 125.441 -2.634 25691
326 1 4 . 1 1 22 22 ASN HA H 22 5.019 5.019 5.189 -0.170 25691
327 1 4 . 1 1 24 24 HIS N N 24 121.461 121.461 121.061 0.400 25691
328 1 4 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.192 -1.063 25691
329 1 4 . 1 1 25 25 CYS N N 25 122.306 122.306 123.120 -0.814 25691
330 1 4 . 1 1 25 25 CYS HA H 25 5.096 5.096 4.736 0.360 25691
331 1 4 . 1 1 26 26 GLY N N 26 116.561 116.561 116.267 0.294 25691
332 1 4 . 1 1 27 27 SER N N 27 116.705 116.705 119.375 -2.670 25691
333 1 4 . 1 1 27 27 SER HA H 27 3.999 3.999 4.129 -0.130 25691
334 1 4 . 1 1 28 28 ASP N N 28 121.184 121.184 121.460 -0.276 25691
335 1 4 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.515 -0.038 25691
336 1 4 . 1 1 29 29 GLY N N 29 109.717 109.717 107.944 1.773 25691
337 1 4 . 1 1 30 30 GLN N N 30 119.919 119.919 120.523 -0.604 25691
338 1 4 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.239 0.055 25691
339 1 4 . 1 1 31 31 THR N N 31 120.852 120.852 119.749 1.103 25691
340 1 4 . 1 1 31 31 THR HA H 31 4.612 4.612 4.842 -0.230 25691
341 1 4 . 1 1 32 32 TYR N N 32 129.107 129.107 125.104 4.003 25691
342 1 4 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.445 0.040 25691
343 1 4 . 1 1 33 33 GLY N N 33 109.097 109.097 108.328 0.769 25691
344 1 4 . 1 1 34 34 ASN N N 34 109.942 109.942 111.693 -1.751 25691
345 1 4 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.462 -0.398 25691
346 1 4 . 1 1 35 35 LYS N N 35 119.128 119.128 119.715 -0.587 25691
347 1 4 . 1 1 35 35 LYS HA H 35 3.029 3.029 4.380 -1.351 25691
348 1 4 . 1 1 36 36 CYS N N 36 119.799 119.799 118.463 1.336 25691
349 1 4 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.190 -1.621 25691
350 1 4 . 1 1 37 37 ALA N N 37 122.356 122.356 121.991 0.365 25691
351 1 4 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.148 -0.269 25691
352 1 4 . 1 1 38 38 PHE N N 38 119.315 119.315 109.515 9.800 25691
353 1 4 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.600 -1.012 25691
354 1 4 . 1 1 39 39 CYS N N 39 117.511 117.511 122.809 -5.298 25691
355 1 4 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.816 0.170 25691
356 1 4 . 1 1 40 40 LYS N N 40 119.465 119.465 119.832 -0.367 25691
357 1 4 . 1 1 40 40 LYS HA H 40 3.854 3.854 4.119 -0.265 25691
358 1 4 . 1 1 41 41 ALA N N 41 123.083 123.083 121.335 1.748 25691
359 1 4 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.200 -0.148 25691
360 1 4 . 1 1 42 42 ILE N N 42 120.832 120.832 120.590 0.242 25691
361 1 4 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.490 -0.280 25691
362 1 4 . 1 1 43 43 VAL N N 43 121.341 121.341 118.768 2.573 25691
363 1 4 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.466 0.224 25691
364 1 4 . 1 1 44 44 LYS N N 44 122.202 122.202 117.796 4.406 25691
365 1 4 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.214 -0.140 25691
366 1 4 . 1 1 45 45 SER N N 45 111.517 111.517 112.832 -1.315 25691
367 1 4 . 1 1 45 45 SER HA H 45 4.475 4.475 4.443 0.032 25691
368 1 4 . 1 1 46 46 GLY N N 46 112.139 112.139 107.187 4.952 25691
369 1 4 . 1 1 47 47 GLY N N 47 105.513 105.513 107.986 -2.473 25691
370 1 4 . 1 1 48 48 LYS N N 48 118.918 118.918 120.266 -1.348 25691
371 1 4 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.036 0.111 25691
372 1 4 . 1 1 49 49 ILE N N 49 118.074 118.074 119.137 -1.063 25691
373 1 4 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.252 -0.289 25691
374 1 4 . 1 1 50 50 SER N N 50 118.567 118.567 122.065 -3.498 25691
375 1 4 . 1 1 50 50 SER HA H 50 4.677 4.677 4.806 -0.129 25691
376 1 4 . 1 1 51 51 LEU N N 51 121.924 121.924 122.433 -0.509 25691
377 1 4 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.851 -0.515 25691
378 1 4 . 1 1 52 52 LYS N N 52 131.859 131.859 125.829 6.030 25691
379 1 4 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.393 -0.078 25691
380 1 4 . 1 1 53 53 HIS N N 53 107.367 107.367 116.257 -8.890 25691
381 1 4 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.949 -0.069 25691
382 1 4 . 1 1 55 55 GLY N N 55 114.104 114.104 111.854 2.250 25691
383 1 4 . 1 1 56 56 LYS N N 56 113.793 113.793 119.800 -6.007 25691
384 1 4 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.084 -0.106 25691
385 1 5 . 1 1 2 2 GLY N N 2 109.255 109.255 108.594 0.661 25691
386 1 5 . 1 1 3 3 GLY N N 3 108.760 108.760 109.613 -0.853 25691
387 1 5 . 1 1 4 4 GLN N N 4 119.481 119.481 117.947 1.534 25691
388 1 5 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.746 -0.350 25691
389 1 5 . 1 1 5 5 VAL N N 5 121.615 121.615 121.574 0.041 25691
390 1 5 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.048 0.077 25691
391 1 5 . 1 1 6 6 ASP N N 6 125.372 125.372 126.374 -1.002 25691
392 1 5 . 1 1 7 7 CYS N N 7 123.728 123.728 122.511 1.217 25691
393 1 5 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.350 0.676 25691
394 1 5 . 1 1 8 8 GLY N N 8 111.717 111.717 111.099 0.618 25691
395 1 5 . 1 1 9 9 GLU N N 9 119.502 119.502 119.133 0.369 25691
396 1 5 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.132 -0.091 25691
397 1 5 . 1 1 10 10 PHE N N 10 116.513 116.513 115.575 0.938 25691
398 1 5 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.177 0.605 25691
399 1 5 . 1 1 11 11 GLN N N 11 118.042 118.042 115.730 2.312 25691
400 1 5 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.005 -0.042 25691
401 1 5 . 1 1 12 12 ASP N N 12 120.313 120.313 113.450 6.863 25691
402 1 5 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.513 -0.010 25691
403 1 5 . 1 1 13 13 THR N N 13 118.013 118.013 110.874 7.139 25691
404 1 5 . 1 1 13 13 THR HA H 13 4.090 4.090 3.885 0.205 25691
405 1 5 . 1 1 14 14 LYS N N 14 119.942 119.942 120.371 -0.429 25691
406 1 5 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.664 -0.503 25691
407 1 5 . 1 1 15 15 VAL N N 15 120.212 120.212 121.636 -1.424 25691
408 1 5 . 1 1 15 15 VAL HA H 15 3.888 3.888 3.929 -0.041 25691
409 1 5 . 1 1 16 16 TYR N N 16 126.887 126.887 120.818 6.069 25691
410 1 5 . 1 1 16 16 TYR HA H 16 4.683 4.683 4.917 -0.234 25691
411 1 5 . 1 1 17 17 CYS N N 17 120.474 120.474 121.116 -0.642 25691
412 1 5 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.894 0.054 25691
413 1 5 . 1 1 18 18 THR N N 18 113.766 113.766 112.482 1.284 25691
414 1 5 . 1 1 18 18 THR HA H 18 4.656 4.656 4.459 0.197 25691
415 1 5 . 1 1 19 19 ARG N N 19 116.621 116.621 116.432 0.189 25691
416 1 5 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.552 -0.238 25691
417 1 5 . 1 1 20 20 GLU N N 20 121.887 121.887 121.986 -0.099 25691
418 1 5 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.557 -0.446 25691
419 1 5 . 1 1 21 21 SER N N 21 118.596 118.596 113.574 5.022 25691
420 1 5 . 1 1 21 21 SER HA H 21 3.858 3.858 4.466 -0.608 25691
421 1 5 . 1 1 22 22 ASN N N 22 122.807 122.807 121.357 1.450 25691
422 1 5 . 1 1 22 22 ASN HA H 22 5.019 5.019 4.661 0.358 25691
423 1 5 . 1 1 24 24 HIS N N 24 121.461 121.461 119.275 2.186 25691
424 1 5 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.286 -1.157 25691
425 1 5 . 1 1 25 25 CYS N N 25 122.306 122.306 124.986 -2.680 25691
426 1 5 . 1 1 25 25 CYS HA H 25 5.096 5.096 5.081 0.015 25691
427 1 5 . 1 1 26 26 GLY N N 26 116.561 116.561 114.278 2.283 25691
428 1 5 . 1 1 27 27 SER N N 27 116.705 116.705 116.059 0.646 25691
429 1 5 . 1 1 27 27 SER HA H 27 3.999 3.999 4.274 -0.275 25691
430 1 5 . 1 1 28 28 ASP N N 28 121.184 121.184 119.233 1.951 25691
431 1 5 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.610 -0.133 25691
432 1 5 . 1 1 29 29 GLY N N 29 109.717 109.717 107.106 2.611 25691
433 1 5 . 1 1 30 30 GLN N N 30 119.919 119.919 119.723 0.196 25691
434 1 5 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.196 0.098 25691
435 1 5 . 1 1 31 31 THR N N 31 120.852 120.852 117.543 3.309 25691
436 1 5 . 1 1 31 31 THR HA H 31 4.612 4.612 5.198 -0.586 25691
437 1 5 . 1 1 32 32 TYR N N 32 129.107 129.107 125.334 3.773 25691
438 1 5 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.734 -0.249 25691
439 1 5 . 1 1 33 33 GLY N N 33 109.097 109.097 108.741 0.356 25691
440 1 5 . 1 1 34 34 ASN N N 34 109.942 109.942 111.089 -1.147 25691
441 1 5 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.236 -0.172 25691
442 1 5 . 1 1 35 35 LYS N N 35 119.128 119.128 120.237 -1.109 25691
443 1 5 . 1 1 35 35 LYS HA H 35 3.029 3.029 4.428 -1.399 25691
444 1 5 . 1 1 36 36 CYS N N 36 119.799 119.799 116.070 3.729 25691
445 1 5 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.185 -1.616 25691
446 1 5 . 1 1 37 37 ALA N N 37 122.356 122.356 122.145 0.211 25691
447 1 5 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.177 -0.298 25691
448 1 5 . 1 1 38 38 PHE N N 38 119.315 119.315 118.016 1.299 25691
449 1 5 . 1 1 38 38 PHE HA H 38 3.588 3.588 3.890 -0.302 25691
450 1 5 . 1 1 39 39 CYS N N 39 117.511 117.511 119.811 -2.300 25691
451 1 5 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.825 0.161 25691
452 1 5 . 1 1 40 40 LYS N N 40 119.465 119.465 119.480 -0.015 25691
453 1 5 . 1 1 40 40 LYS HA H 40 3.854 3.854 4.168 -0.314 25691
454 1 5 . 1 1 41 41 ALA N N 41 123.083 123.083 118.375 4.708 25691
455 1 5 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.245 -0.193 25691
456 1 5 . 1 1 42 42 ILE N N 42 120.832 120.832 119.462 1.370 25691
457 1 5 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.403 -0.193 25691
458 1 5 . 1 1 43 43 VAL N N 43 121.341 121.341 119.419 1.922 25691
459 1 5 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.445 0.245 25691
460 1 5 . 1 1 44 44 LYS N N 44 122.202 122.202 118.460 3.742 25691
461 1 5 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.053 0.021 25691
462 1 5 . 1 1 45 45 SER N N 45 111.517 111.517 111.522 -0.005 25691
463 1 5 . 1 1 45 45 SER HA H 45 4.475 4.475 4.668 -0.193 25691
464 1 5 . 1 1 46 46 GLY N N 46 112.139 112.139 108.243 3.896 25691
465 1 5 . 1 1 47 47 GLY N N 47 105.513 105.513 107.160 -1.647 25691
466 1 5 . 1 1 48 48 LYS N N 48 118.918 118.918 119.520 -0.602 25691
467 1 5 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.207 -0.060 25691
468 1 5 . 1 1 49 49 ILE N N 49 118.074 118.074 120.744 -2.670 25691
469 1 5 . 1 1 49 49 ILE HA H 49 3.963 3.963 3.970 -0.007 25691
470 1 5 . 1 1 50 50 SER N N 50 118.567 118.567 118.130 0.437 25691
471 1 5 . 1 1 50 50 SER HA H 50 4.677 4.677 4.724 -0.047 25691
472 1 5 . 1 1 51 51 LEU N N 51 121.924 121.924 121.913 0.011 25691
473 1 5 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.452 -0.116 25691
474 1 5 . 1 1 52 52 LYS N N 52 131.859 131.859 124.675 7.184 25691
475 1 5 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.402 -0.087 25691
476 1 5 . 1 1 53 53 HIS N N 53 107.367 107.367 118.125 -10.758 25691
477 1 5 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.966 -0.086 25691
478 1 5 . 1 1 55 55 GLY N N 55 114.104 114.104 113.471 0.633 25691
479 1 5 . 1 1 56 56 LYS N N 56 113.793 113.793 118.011 -4.218 25691
480 1 5 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.272 -0.294 25691
481 1 6 . 1 1 2 2 GLY N N 2 109.255 109.255 109.980 -0.725 25691
482 1 6 . 1 1 3 3 GLY N N 3 108.760 108.760 110.728 -1.968 25691
483 1 6 . 1 1 4 4 GLN N N 4 119.481 119.481 126.889 -7.408 25691
484 1 6 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.125 0.271 25691
485 1 6 . 1 1 5 5 VAL N N 5 121.615 121.615 117.508 4.107 25691
486 1 6 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.299 -0.174 25691
487 1 6 . 1 1 6 6 ASP N N 6 125.372 125.372 120.329 5.043 25691
488 1 6 . 1 1 7 7 CYS N N 7 123.728 123.728 119.059 4.669 25691
489 1 6 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.186 0.840 25691
490 1 6 . 1 1 8 8 GLY N N 8 111.717 111.717 111.689 0.028 25691
491 1 6 . 1 1 9 9 GLU N N 9 119.502 119.502 119.247 0.255 25691
492 1 6 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.074 -0.033 25691
493 1 6 . 1 1 10 10 PHE N N 10 116.513 116.513 114.110 2.403 25691
494 1 6 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.213 0.569 25691
495 1 6 . 1 1 11 11 GLN N N 11 118.042 118.042 121.583 -3.541 25691
496 1 6 . 1 1 11 11 GLN HA H 11 3.963 3.963 3.961 0.002 25691
497 1 6 . 1 1 12 12 ASP N N 12 120.313 120.313 116.466 3.847 25691
498 1 6 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.901 -0.398 25691
499 1 6 . 1 1 13 13 THR N N 13 118.013 118.013 115.865 2.148 25691
500 1 6 . 1 1 13 13 THR HA H 13 4.090 4.090 4.049 0.041 25691
501 1 6 . 1 1 14 14 LYS N N 14 119.942 119.942 119.066 0.876 25691
502 1 6 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.428 -0.267 25691
503 1 6 . 1 1 15 15 VAL N N 15 120.212 120.212 124.215 -4.003 25691
504 1 6 . 1 1 15 15 VAL HA H 15 3.888 3.888 4.003 -0.115 25691
505 1 6 . 1 1 16 16 TYR N N 16 126.887 126.887 123.036 3.851 25691
506 1 6 . 1 1 16 16 TYR HA H 16 4.683 4.683 5.086 -0.403 25691
507 1 6 . 1 1 17 17 CYS N N 17 120.474 120.474 120.143 0.331 25691
508 1 6 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.838 0.110 25691
509 1 6 . 1 1 18 18 THR N N 18 113.766 113.766 112.799 0.967 25691
510 1 6 . 1 1 18 18 THR HA H 18 4.656 4.656 4.429 0.227 25691
511 1 6 . 1 1 19 19 ARG N N 19 116.621 116.621 121.073 -4.452 25691
512 1 6 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.419 -0.105 25691
513 1 6 . 1 1 20 20 GLU N N 20 121.887 121.887 120.596 1.291 25691
514 1 6 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.511 -0.400 25691
515 1 6 . 1 1 21 21 SER N N 21 118.596 118.596 115.952 2.644 25691
516 1 6 . 1 1 21 21 SER HA H 21 3.858 3.858 4.545 -0.687 25691
517 1 6 . 1 1 22 22 ASN N N 22 122.807 122.807 123.953 -1.146 25691
518 1 6 . 1 1 22 22 ASN HA H 22 5.019 5.019 5.052 -0.033 25691
519 1 6 . 1 1 24 24 HIS N N 24 121.461 121.461 119.557 1.904 25691
520 1 6 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.312 -1.183 25691
521 1 6 . 1 1 25 25 CYS N N 25 122.306 122.306 124.764 -2.458 25691
522 1 6 . 1 1 25 25 CYS HA H 25 5.096 5.096 5.047 0.049 25691
523 1 6 . 1 1 26 26 GLY N N 26 116.561 116.561 114.954 1.607 25691
524 1 6 . 1 1 27 27 SER N N 27 116.705 116.705 117.590 -0.885 25691
525 1 6 . 1 1 27 27 SER HA H 27 3.999 3.999 4.147 -0.148 25691
526 1 6 . 1 1 28 28 ASP N N 28 121.184 121.184 117.270 3.914 25691
527 1 6 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.533 -0.056 25691
528 1 6 . 1 1 29 29 GLY N N 29 109.717 109.717 108.495 1.222 25691
529 1 6 . 1 1 30 30 GLN N N 30 119.919 119.919 120.910 -0.991 25691
530 1 6 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.318 -0.024 25691
531 1 6 . 1 1 31 31 THR N N 31 120.852 120.852 119.198 1.654 25691
532 1 6 . 1 1 31 31 THR HA H 31 4.612 4.612 5.450 -0.838 25691
533 1 6 . 1 1 32 32 TYR N N 32 129.107 129.107 124.941 4.166 25691
534 1 6 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.723 -0.238 25691
535 1 6 . 1 1 33 33 GLY N N 33 109.097 109.097 109.203 -0.106 25691
536 1 6 . 1 1 34 34 ASN N N 34 109.942 109.942 112.217 -2.275 25691
537 1 6 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.029 0.035 25691
538 1 6 . 1 1 35 35 LYS N N 35 119.128 119.128 119.879 -0.751 25691
539 1 6 . 1 1 35 35 LYS HA H 35 3.029 3.029 4.450 -1.421 25691
540 1 6 . 1 1 36 36 CYS N N 36 119.799 119.799 116.649 3.150 25691
541 1 6 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.236 -1.667 25691
542 1 6 . 1 1 37 37 ALA N N 37 122.356 122.356 121.859 0.497 25691
543 1 6 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.109 -0.230 25691
544 1 6 . 1 1 38 38 PHE N N 38 119.315 119.315 118.169 1.146 25691
545 1 6 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.349 -0.761 25691
546 1 6 . 1 1 39 39 CYS N N 39 117.511 117.511 119.253 -1.742 25691
547 1 6 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.898 0.088 25691
548 1 6 . 1 1 40 40 LYS N N 40 119.465 119.465 119.784 -0.319 25691
549 1 6 . 1 1 40 40 LYS HA H 40 3.854 3.854 4.182 -0.328 25691
550 1 6 . 1 1 41 41 ALA N N 41 123.083 123.083 121.936 1.147 25691
551 1 6 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.136 -0.084 25691
552 1 6 . 1 1 42 42 ILE N N 42 120.832 120.832 119.696 1.136 25691
553 1 6 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.446 -0.236 25691
554 1 6 . 1 1 43 43 VAL N N 43 121.341 121.341 120.274 1.067 25691
555 1 6 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.721 -0.031 25691
556 1 6 . 1 1 44 44 LYS N N 44 122.202 122.202 119.869 2.333 25691
557 1 6 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.056 0.018 25691
558 1 6 . 1 1 45 45 SER N N 45 111.517 111.517 113.189 -1.672 25691
559 1 6 . 1 1 45 45 SER HA H 45 4.475 4.475 4.484 -0.009 25691
560 1 6 . 1 1 46 46 GLY N N 46 112.139 112.139 106.538 5.601 25691
561 1 6 . 1 1 47 47 GLY N N 47 105.513 105.513 108.457 -2.944 25691
562 1 6 . 1 1 48 48 LYS N N 48 118.918 118.918 119.251 -0.333 25691
563 1 6 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.121 0.026 25691
564 1 6 . 1 1 49 49 ILE N N 49 118.074 118.074 120.459 -2.385 25691
565 1 6 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.024 -0.061 25691
566 1 6 . 1 1 50 50 SER N N 50 118.567 118.567 118.582 -0.015 25691
567 1 6 . 1 1 50 50 SER HA H 50 4.677 4.677 4.755 -0.078 25691
568 1 6 . 1 1 51 51 LEU N N 51 121.924 121.924 122.092 -0.168 25691
569 1 6 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.458 -0.122 25691
570 1 6 . 1 1 52 52 LYS N N 52 131.859 131.859 124.590 7.269 25691
571 1 6 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.291 0.024 25691
572 1 6 . 1 1 53 53 HIS N N 53 107.367 107.367 117.253 -9.886 25691
573 1 6 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.961 -0.081 25691
574 1 6 . 1 1 55 55 GLY N N 55 114.104 114.104 113.129 0.975 25691
575 1 6 . 1 1 56 56 LYS N N 56 113.793 113.793 117.764 -3.971 25691
576 1 6 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.308 -0.330 25691
577 1 7 . 1 1 2 2 GLY N N 2 109.255 109.255 108.665 0.590 25691
578 1 7 . 1 1 3 3 GLY N N 3 108.760 108.760 108.714 0.046 25691
579 1 7 . 1 1 4 4 GLN N N 4 119.481 119.481 120.306 -0.825 25691
580 1 7 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.378 0.018 25691
581 1 7 . 1 1 5 5 VAL N N 5 121.615 121.615 127.097 -5.482 25691
582 1 7 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.209 -0.084 25691
583 1 7 . 1 1 6 6 ASP N N 6 125.372 125.372 120.823 4.549 25691
584 1 7 . 1 1 7 7 CYS N N 7 123.728 123.728 119.399 4.329 25691
585 1 7 . 1 1 7 7 CYS HA H 7 5.026 5.026 3.727 1.299 25691
586 1 7 . 1 1 8 8 GLY N N 8 111.717 111.717 111.184 0.533 25691
587 1 7 . 1 1 9 9 GLU N N 9 119.502 119.502 122.354 -2.852 25691
588 1 7 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.287 -0.246 25691
589 1 7 . 1 1 10 10 PHE N N 10 116.513 116.513 117.550 -1.037 25691
590 1 7 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.190 0.592 25691
591 1 7 . 1 1 11 11 GLN N N 11 118.042 118.042 114.028 4.014 25691
592 1 7 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.173 -0.210 25691
593 1 7 . 1 1 12 12 ASP N N 12 120.313 120.313 118.559 1.754 25691
594 1 7 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.604 -0.101 25691
595 1 7 . 1 1 13 13 THR N N 13 118.013 118.013 108.788 9.225 25691
596 1 7 . 1 1 13 13 THR HA H 13 4.090 4.090 4.373 -0.283 25691
597 1 7 . 1 1 14 14 LYS N N 14 119.942 119.942 121.735 -1.793 25691
598 1 7 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.104 0.057 25691
599 1 7 . 1 1 15 15 VAL N N 15 120.212 120.212 121.203 -0.991 25691
600 1 7 . 1 1 15 15 VAL HA H 15 3.888 3.888 2.994 0.894 25691
601 1 7 . 1 1 16 16 TYR N N 16 126.887 126.887 126.259 0.628 25691
602 1 7 . 1 1 16 16 TYR HA H 16 4.683 4.683 4.496 0.187 25691
603 1 7 . 1 1 17 17 CYS N N 17 120.474 120.474 118.906 1.568 25691
604 1 7 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.861 0.087 25691
605 1 7 . 1 1 18 18 THR N N 18 113.766 113.766 112.926 0.840 25691
606 1 7 . 1 1 18 18 THR HA H 18 4.656 4.656 4.251 0.405 25691
607 1 7 . 1 1 19 19 ARG N N 19 116.621 116.621 117.719 -1.098 25691
608 1 7 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.384 -0.070 25691
609 1 7 . 1 1 20 20 GLU N N 20 121.887 121.887 121.558 0.329 25691
610 1 7 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.291 -0.180 25691
611 1 7 . 1 1 21 21 SER N N 21 118.596 118.596 116.372 2.224 25691
612 1 7 . 1 1 21 21 SER HA H 21 3.858 3.858 4.440 -0.582 25691
613 1 7 . 1 1 22 22 ASN N N 22 122.807 122.807 121.751 1.056 25691
614 1 7 . 1 1 22 22 ASN HA H 22 5.019 5.019 5.005 0.014 25691
615 1 7 . 1 1 24 24 HIS N N 24 121.461 121.461 119.881 1.580 25691
616 1 7 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.028 -0.899 25691
617 1 7 . 1 1 25 25 CYS N N 25 122.306 122.306 125.932 -3.626 25691
618 1 7 . 1 1 25 25 CYS HA H 25 5.096 5.096 5.219 -0.123 25691
619 1 7 . 1 1 26 26 GLY N N 26 116.561 116.561 114.504 2.057 25691
620 1 7 . 1 1 27 27 SER N N 27 116.705 116.705 115.830 0.875 25691
621 1 7 . 1 1 27 27 SER HA H 27 3.999 3.999 4.389 -0.390 25691
622 1 7 . 1 1 28 28 ASP N N 28 121.184 121.184 120.437 0.747 25691
623 1 7 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.591 -0.114 25691
624 1 7 . 1 1 29 29 GLY N N 29 109.717 109.717 108.222 1.495 25691
625 1 7 . 1 1 30 30 GLN N N 30 119.919 119.919 121.023 -1.104 25691
626 1 7 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.350 -0.056 25691
627 1 7 . 1 1 31 31 THR N N 31 120.852 120.852 117.201 3.651 25691
628 1 7 . 1 1 31 31 THR HA H 31 4.612 4.612 4.673 -0.061 25691
629 1 7 . 1 1 32 32 TYR N N 32 129.107 129.107 127.189 1.918 25691
630 1 7 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.730 -0.245 25691
631 1 7 . 1 1 33 33 GLY N N 33 109.097 109.097 110.062 -0.965 25691
632 1 7 . 1 1 34 34 ASN N N 34 109.942 109.942 113.323 -3.381 25691
633 1 7 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.126 -0.062 25691
634 1 7 . 1 1 35 35 LYS N N 35 119.128 119.128 120.345 -1.217 25691
635 1 7 . 1 1 35 35 LYS HA H 35 3.029 3.029 3.908 -0.879 25691
636 1 7 . 1 1 36 36 CYS N N 36 119.799 119.799 116.976 2.823 25691
637 1 7 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.166 -1.597 25691
638 1 7 . 1 1 37 37 ALA N N 37 122.356 122.356 124.196 -1.840 25691
639 1 7 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.010 -0.131 25691
640 1 7 . 1 1 38 38 PHE N N 38 119.315 119.315 116.651 2.664 25691
641 1 7 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.342 -0.754 25691
642 1 7 . 1 1 39 39 CYS N N 39 117.511 117.511 119.425 -1.914 25691
643 1 7 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.788 0.198 25691
644 1 7 . 1 1 40 40 LYS N N 40 119.465 119.465 120.749 -1.284 25691
645 1 7 . 1 1 40 40 LYS HA H 40 3.854 3.854 3.927 -0.073 25691
646 1 7 . 1 1 41 41 ALA N N 41 123.083 123.083 121.198 1.885 25691
647 1 7 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.137 -0.085 25691
648 1 7 . 1 1 42 42 ILE N N 42 120.832 120.832 120.176 0.656 25691
649 1 7 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.619 -0.409 25691
650 1 7 . 1 1 43 43 VAL N N 43 121.341 121.341 120.287 1.054 25691
651 1 7 . 1 1 43 43 VAL HA H 43 3.690 3.690 4.057 -0.367 25691
652 1 7 . 1 1 44 44 LYS N N 44 122.202 122.202 118.613 3.589 25691
653 1 7 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.222 -0.148 25691
654 1 7 . 1 1 45 45 SER N N 45 111.517 111.517 112.709 -1.192 25691
655 1 7 . 1 1 45 45 SER HA H 45 4.475 4.475 4.464 0.011 25691
656 1 7 . 1 1 46 46 GLY N N 46 112.139 112.139 106.693 5.446 25691
657 1 7 . 1 1 47 47 GLY N N 47 105.513 105.513 108.167 -2.654 25691
658 1 7 . 1 1 48 48 LYS N N 48 118.918 118.918 119.575 -0.657 25691
659 1 7 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.136 0.011 25691
660 1 7 . 1 1 49 49 ILE N N 49 118.074 118.074 120.490 -2.416 25691
661 1 7 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.038 -0.075 25691
662 1 7 . 1 1 50 50 SER N N 50 118.567 118.567 118.627 -0.060 25691
663 1 7 . 1 1 50 50 SER HA H 50 4.677 4.677 4.898 -0.221 25691
664 1 7 . 1 1 51 51 LEU N N 51 121.924 121.924 122.206 -0.282 25691
665 1 7 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.397 -0.061 25691
666 1 7 . 1 1 52 52 LYS N N 52 131.859 131.859 124.948 6.911 25691
667 1 7 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.301 0.014 25691
668 1 7 . 1 1 53 53 HIS N N 53 107.367 107.367 117.933 -10.566 25691
669 1 7 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.871 0.009 25691
670 1 7 . 1 1 55 55 GLY N N 55 114.104 114.104 112.884 1.220 25691
671 1 7 . 1 1 56 56 LYS N N 56 113.793 113.793 119.177 -5.384 25691
672 1 7 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.319 -0.341 25691
673 1 8 . 1 1 2 2 GLY N N 2 109.255 109.255 111.070 -1.815 25691
674 1 8 . 1 1 3 3 GLY N N 3 108.760 108.760 112.726 -3.966 25691
675 1 8 . 1 1 4 4 GLN N N 4 119.481 119.481 124.795 -5.314 25691
676 1 8 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.172 0.224 25691
677 1 8 . 1 1 5 5 VAL N N 5 121.615 121.615 121.162 0.453 25691
678 1 8 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.575 -0.450 25691
679 1 8 . 1 1 6 6 ASP N N 6 125.372 125.372 123.623 1.749 25691
680 1 8 . 1 1 7 7 CYS N N 7 123.728 123.728 121.817 1.911 25691
681 1 8 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.720 0.306 25691
682 1 8 . 1 1 8 8 GLY N N 8 111.717 111.717 109.413 2.304 25691
683 1 8 . 1 1 9 9 GLU N N 9 119.502 119.502 119.463 0.039 25691
684 1 8 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.109 -0.068 25691
685 1 8 . 1 1 10 10 PHE N N 10 116.513 116.513 115.216 1.297 25691
686 1 8 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.223 0.559 25691
687 1 8 . 1 1 11 11 GLN N N 11 118.042 118.042 115.673 2.369 25691
688 1 8 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.087 -0.124 25691
689 1 8 . 1 1 12 12 ASP N N 12 120.313 120.313 115.277 5.036 25691
690 1 8 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.549 -0.046 25691
691 1 8 . 1 1 13 13 THR N N 13 118.013 118.013 117.221 0.792 25691
692 1 8 . 1 1 13 13 THR HA H 13 4.090 4.090 3.620 0.470 25691
693 1 8 . 1 1 14 14 LYS N N 14 119.942 119.942 119.452 0.490 25691
694 1 8 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.412 -0.251 25691
695 1 8 . 1 1 15 15 VAL N N 15 120.212 120.212 121.662 -1.450 25691
696 1 8 . 1 1 15 15 VAL HA H 15 3.888 3.888 3.943 -0.055 25691
697 1 8 . 1 1 16 16 TYR N N 16 126.887 126.887 120.484 6.403 25691
698 1 8 . 1 1 16 16 TYR HA H 16 4.683 4.683 5.240 -0.557 25691
699 1 8 . 1 1 17 17 CYS N N 17 120.474 120.474 118.876 1.598 25691
700 1 8 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.881 0.067 25691
701 1 8 . 1 1 18 18 THR N N 18 113.766 113.766 112.546 1.220 25691
702 1 8 . 1 1 18 18 THR HA H 18 4.656 4.656 5.031 -0.375 25691
703 1 8 . 1 1 19 19 ARG N N 19 116.621 116.621 119.692 -3.071 25691
704 1 8 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.408 -0.094 25691
705 1 8 . 1 1 20 20 GLU N N 20 121.887 121.887 122.719 -0.832 25691
706 1 8 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.338 -0.227 25691
707 1 8 . 1 1 21 21 SER N N 21 118.596 118.596 118.376 0.220 25691
708 1 8 . 1 1 21 21 SER HA H 21 3.858 3.858 4.379 -0.521 25691
709 1 8 . 1 1 22 22 ASN N N 22 122.807 122.807 124.021 -1.214 25691
710 1 8 . 1 1 22 22 ASN HA H 22 5.019 5.019 4.938 0.081 25691
711 1 8 . 1 1 24 24 HIS N N 24 121.461 121.461 122.624 -1.163 25691
712 1 8 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.418 -1.289 25691
713 1 8 . 1 1 25 25 CYS N N 25 122.306 122.306 125.148 -2.842 25691
714 1 8 . 1 1 25 25 CYS HA H 25 5.096 5.096 5.363 -0.267 25691
715 1 8 . 1 1 26 26 GLY N N 26 116.561 116.561 115.454 1.107 25691
716 1 8 . 1 1 27 27 SER N N 27 116.705 116.705 116.954 -0.249 25691
717 1 8 . 1 1 27 27 SER HA H 27 3.999 3.999 4.150 -0.151 25691
718 1 8 . 1 1 28 28 ASP N N 28 121.184 121.184 118.949 2.235 25691
719 1 8 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.612 -0.135 25691
720 1 8 . 1 1 29 29 GLY N N 29 109.717 109.717 107.493 2.224 25691
721 1 8 . 1 1 30 30 GLN N N 30 119.919 119.919 119.966 -0.047 25691
722 1 8 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.342 -0.048 25691
723 1 8 . 1 1 31 31 THR N N 31 120.852 120.852 117.068 3.784 25691
724 1 8 . 1 1 31 31 THR HA H 31 4.612 4.612 5.474 -0.862 25691
725 1 8 . 1 1 32 32 TYR N N 32 129.107 129.107 125.331 3.776 25691
726 1 8 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.594 -0.109 25691
727 1 8 . 1 1 33 33 GLY N N 33 109.097 109.097 109.356 -0.259 25691
728 1 8 . 1 1 34 34 ASN N N 34 109.942 109.942 113.028 -3.086 25691
729 1 8 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.100 -0.036 25691
730 1 8 . 1 1 35 35 LYS N N 35 119.128 119.128 119.381 -0.253 25691
731 1 8 . 1 1 35 35 LYS HA H 35 3.029 3.029 4.352 -1.323 25691
732 1 8 . 1 1 36 36 CYS N N 36 119.799 119.799 118.461 1.338 25691
733 1 8 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.253 -1.684 25691
734 1 8 . 1 1 37 37 ALA N N 37 122.356 122.356 122.835 -0.479 25691
735 1 8 . 1 1 37 37 ALA HA H 37 3.879 3.879 3.946 -0.067 25691
736 1 8 . 1 1 38 38 PHE N N 38 119.315 119.315 116.111 3.204 25691
737 1 8 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.189 -0.601 25691
738 1 8 . 1 1 39 39 CYS N N 39 117.511 117.511 120.860 -3.349 25691
739 1 8 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.977 0.009 25691
740 1 8 . 1 1 40 40 LYS N N 40 119.465 119.465 120.088 -0.623 25691
741 1 8 . 1 1 40 40 LYS HA H 40 3.854 3.854 4.325 -0.471 25691
742 1 8 . 1 1 41 41 ALA N N 41 123.083 123.083 121.459 1.624 25691
743 1 8 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.265 -0.213 25691
744 1 8 . 1 1 42 42 ILE N N 42 120.832 120.832 120.544 0.288 25691
745 1 8 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.593 -0.383 25691
746 1 8 . 1 1 43 43 VAL N N 43 121.341 121.341 119.256 2.085 25691
747 1 8 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.564 0.126 25691
748 1 8 . 1 1 44 44 LYS N N 44 122.202 122.202 117.757 4.445 25691
749 1 8 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.215 -0.141 25691
750 1 8 . 1 1 45 45 SER N N 45 111.517 111.517 112.573 -1.056 25691
751 1 8 . 1 1 45 45 SER HA H 45 4.475 4.475 4.405 0.070 25691
752 1 8 . 1 1 46 46 GLY N N 46 112.139 112.139 106.532 5.607 25691
753 1 8 . 1 1 47 47 GLY N N 47 105.513 105.513 109.207 -3.694 25691
754 1 8 . 1 1 48 48 LYS N N 48 118.918 118.918 119.871 -0.953 25691
755 1 8 . 1 1 48 48 LYS HA H 48 4.147 4.147 3.932 0.215 25691
756 1 8 . 1 1 49 49 ILE N N 49 118.074 118.074 119.471 -1.397 25691
757 1 8 . 1 1 49 49 ILE HA H 49 3.963 3.963 3.843 0.120 25691
758 1 8 . 1 1 50 50 SER N N 50 118.567 118.567 119.840 -1.273 25691
759 1 8 . 1 1 50 50 SER HA H 50 4.677 4.677 4.506 0.171 25691
760 1 8 . 1 1 51 51 LEU N N 51 121.924 121.924 121.490 0.434 25691
761 1 8 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.394 -0.058 25691
762 1 8 . 1 1 52 52 LYS N N 52 131.859 131.859 126.219 5.640 25691
763 1 8 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.273 0.042 25691
764 1 8 . 1 1 53 53 HIS N N 53 107.367 107.367 117.117 -9.750 25691
765 1 8 . 1 1 53 53 HIS HA H 53 4.880 4.880 5.011 -0.131 25691
766 1 8 . 1 1 55 55 GLY N N 55 114.104 114.104 113.195 0.909 25691
767 1 8 . 1 1 56 56 LYS N N 56 113.793 113.793 118.053 -4.260 25691
768 1 8 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.321 -0.343 25691
769 1 9 . 1 1 2 2 GLY N N 2 109.255 109.255 113.777 -4.522 25691
770 1 9 . 1 1 3 3 GLY N N 3 108.760 108.760 110.557 -1.797 25691
771 1 9 . 1 1 4 4 GLN N N 4 119.481 119.481 122.077 -2.596 25691
772 1 9 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.220 0.176 25691
773 1 9 . 1 1 5 5 VAL N N 5 121.615 121.615 122.145 -0.530 25691
774 1 9 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.133 -0.008 25691
775 1 9 . 1 1 6 6 ASP N N 6 125.372 125.372 125.507 -0.135 25691
776 1 9 . 1 1 7 7 CYS N N 7 123.728 123.728 122.613 1.115 25691
777 1 9 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.278 0.748 25691
778 1 9 . 1 1 8 8 GLY N N 8 111.717 111.717 108.255 3.462 25691
779 1 9 . 1 1 9 9 GLU N N 9 119.502 119.502 122.878 -3.376 25691
780 1 9 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.285 -0.244 25691
781 1 9 . 1 1 10 10 PHE N N 10 116.513 116.513 114.985 1.528 25691
782 1 9 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.187 0.595 25691
783 1 9 . 1 1 11 11 GLN N N 11 118.042 118.042 115.678 2.364 25691
784 1 9 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.558 -0.595 25691
785 1 9 . 1 1 12 12 ASP N N 12 120.313 120.313 120.886 -0.573 25691
786 1 9 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.713 -0.210 25691
787 1 9 . 1 1 13 13 THR N N 13 118.013 118.013 118.926 -0.913 25691
788 1 9 . 1 1 13 13 THR HA H 13 4.090 4.090 3.826 0.264 25691
789 1 9 . 1 1 14 14 LYS N N 14 119.942 119.942 118.294 1.648 25691
790 1 9 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.479 -0.318 25691
791 1 9 . 1 1 15 15 VAL N N 15 120.212 120.212 120.634 -0.422 25691
792 1 9 . 1 1 15 15 VAL HA H 15 3.888 3.888 4.229 -0.341 25691
793 1 9 . 1 1 16 16 TYR N N 16 126.887 126.887 123.495 3.392 25691
794 1 9 . 1 1 16 16 TYR HA H 16 4.683 4.683 5.095 -0.412 25691
795 1 9 . 1 1 17 17 CYS N N 17 120.474 120.474 118.813 1.661 25691
796 1 9 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.307 0.641 25691
797 1 9 . 1 1 18 18 THR N N 18 113.766 113.766 116.510 -2.744 25691
798 1 9 . 1 1 18 18 THR HA H 18 4.656 4.656 4.708 -0.052 25691
799 1 9 . 1 1 19 19 ARG N N 19 116.621 116.621 120.319 -3.698 25691
800 1 9 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.187 0.127 25691
801 1 9 . 1 1 20 20 GLU N N 20 121.887 121.887 122.265 -0.378 25691
802 1 9 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.380 -0.269 25691
803 1 9 . 1 1 21 21 SER N N 21 118.596 118.596 118.467 0.129 25691
804 1 9 . 1 1 21 21 SER HA H 21 3.858 3.858 4.474 -0.616 25691
805 1 9 . 1 1 22 22 ASN N N 22 122.807 122.807 122.171 0.636 25691
806 1 9 . 1 1 22 22 ASN HA H 22 5.019 5.019 5.003 0.017 25691
807 1 9 . 1 1 24 24 HIS N N 24 121.461 121.461 121.960 -0.499 25691
808 1 9 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.269 -1.140 25691
809 1 9 . 1 1 25 25 CYS N N 25 122.306 122.306 125.580 -3.274 25691
810 1 9 . 1 1 25 25 CYS HA H 25 5.096 5.096 5.204 -0.108 25691
811 1 9 . 1 1 26 26 GLY N N 26 116.561 116.561 113.991 2.570 25691
812 1 9 . 1 1 27 27 SER N N 27 116.705 116.705 115.465 1.240 25691
813 1 9 . 1 1 27 27 SER HA H 27 3.999 3.999 4.341 -0.342 25691
814 1 9 . 1 1 28 28 ASP N N 28 121.184 121.184 119.975 1.209 25691
815 1 9 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.620 -0.143 25691
816 1 9 . 1 1 29 29 GLY N N 29 109.717 109.717 108.124 1.593 25691
817 1 9 . 1 1 30 30 GLN N N 30 119.919 119.919 120.558 -0.639 25691
818 1 9 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.403 -0.109 25691
819 1 9 . 1 1 31 31 THR N N 31 120.852 120.852 117.178 3.674 25691
820 1 9 . 1 1 31 31 THR HA H 31 4.612 4.612 4.960 -0.348 25691
821 1 9 . 1 1 32 32 TYR N N 32 129.107 129.107 126.375 2.732 25691
822 1 9 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.735 -0.250 25691
823 1 9 . 1 1 33 33 GLY N N 33 109.097 109.097 109.656 -0.559 25691
824 1 9 . 1 1 34 34 ASN N N 34 109.942 109.942 113.638 -3.696 25691
825 1 9 . 1 1 34 34 ASN HA H 34 5.064 5.064 4.866 0.198 25691
826 1 9 . 1 1 35 35 LYS N N 35 119.128 119.128 120.138 -1.010 25691
827 1 9 . 1 1 35 35 LYS HA H 35 3.029 3.029 3.994 -0.965 25691
828 1 9 . 1 1 36 36 CYS N N 36 119.799 119.799 118.142 1.657 25691
829 1 9 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.085 -1.516 25691
830 1 9 . 1 1 37 37 ALA N N 37 122.356 122.356 123.953 -1.597 25691
831 1 9 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.150 -0.271 25691
832 1 9 . 1 1 38 38 PHE N N 38 119.315 119.315 117.532 1.783 25691
833 1 9 . 1 1 38 38 PHE HA H 38 3.588 3.588 3.779 -0.191 25691
834 1 9 . 1 1 39 39 CYS N N 39 117.511 117.511 120.914 -3.403 25691
835 1 9 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.706 0.280 25691
836 1 9 . 1 1 40 40 LYS N N 40 119.465 119.465 119.845 -0.380 25691
837 1 9 . 1 1 40 40 LYS HA H 40 3.854 3.854 3.822 0.032 25691
838 1 9 . 1 1 41 41 ALA N N 41 123.083 123.083 121.490 1.593 25691
839 1 9 . 1 1 41 41 ALA HA H 41 4.052 4.052 3.954 0.098 25691
840 1 9 . 1 1 42 42 ILE N N 42 120.832 120.832 119.148 1.684 25691
841 1 9 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.380 -0.170 25691
842 1 9 . 1 1 43 43 VAL N N 43 121.341 121.341 120.798 0.543 25691
843 1 9 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.586 0.104 25691
844 1 9 . 1 1 44 44 LYS N N 44 122.202 122.202 117.179 5.023 25691
845 1 9 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.066 0.008 25691
846 1 9 . 1 1 45 45 SER N N 45 111.517 111.517 111.845 -0.328 25691
847 1 9 . 1 1 45 45 SER HA H 45 4.475 4.475 4.558 -0.083 25691
848 1 9 . 1 1 46 46 GLY N N 46 112.139 112.139 107.602 4.537 25691
849 1 9 . 1 1 47 47 GLY N N 47 105.513 105.513 107.155 -1.642 25691
850 1 9 . 1 1 48 48 LYS N N 48 118.918 118.918 119.869 -0.951 25691
851 1 9 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.201 -0.054 25691
852 1 9 . 1 1 49 49 ILE N N 49 118.074 118.074 120.110 -2.036 25691
853 1 9 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.004 -0.041 25691
854 1 9 . 1 1 50 50 SER N N 50 118.567 118.567 117.760 0.807 25691
855 1 9 . 1 1 50 50 SER HA H 50 4.677 4.677 4.816 -0.139 25691
856 1 9 . 1 1 51 51 LEU N N 51 121.924 121.924 122.354 -0.430 25691
857 1 9 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.415 -0.079 25691
858 1 9 . 1 1 52 52 LYS N N 52 131.859 131.859 126.686 5.173 25691
859 1 9 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.185 0.130 25691
860 1 9 . 1 1 53 53 HIS N N 53 107.367 107.367 116.485 -9.118 25691
861 1 9 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.903 -0.023 25691
862 1 9 . 1 1 55 55 GLY N N 55 114.104 114.104 113.206 0.898 25691
863 1 9 . 1 1 56 56 LYS N N 56 113.793 113.793 118.990 -5.197 25691
864 1 9 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.161 -0.183 25691
865 1 10 . 1 1 2 2 GLY N N 2 109.255 109.255 112.608 -3.353 25691
866 1 10 . 1 1 3 3 GLY N N 3 108.760 108.760 109.034 -0.274 25691
867 1 10 . 1 1 4 4 GLN N N 4 119.481 119.481 120.369 -0.888 25691
868 1 10 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.401 -0.005 25691
869 1 10 . 1 1 5 5 VAL N N 5 121.615 121.615 121.223 0.392 25691
870 1 10 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.200 -0.075 25691
871 1 10 . 1 1 6 6 ASP N N 6 125.372 125.372 121.509 3.863 25691
872 1 10 . 1 1 7 7 CYS N N 7 123.728 123.728 123.520 0.208 25691
873 1 10 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.066 0.960 25691
874 1 10 . 1 1 8 8 GLY N N 8 111.717 111.717 115.608 -3.891 25691
875 1 10 . 1 1 9 9 GLU N N 9 119.502 119.502 121.437 -1.935 25691
876 1 10 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.358 -0.317 25691
877 1 10 . 1 1 10 10 PHE N N 10 116.513 116.513 119.105 -2.592 25691
878 1 10 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.164 0.618 25691
879 1 10 . 1 1 11 11 GLN N N 11 118.042 118.042 116.099 1.943 25691
880 1 10 . 1 1 11 11 GLN HA H 11 3.963 3.963 3.976 -0.013 25691
881 1 10 . 1 1 12 12 ASP N N 12 120.313 120.313 114.403 5.910 25691
882 1 10 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.499 0.004 25691
883 1 10 . 1 1 13 13 THR N N 13 118.013 118.013 114.394 3.619 25691
884 1 10 . 1 1 13 13 THR HA H 13 4.090 4.090 3.749 0.341 25691
885 1 10 . 1 1 14 14 LYS N N 14 119.942 119.942 121.214 -1.272 25691
886 1 10 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.586 -0.425 25691
887 1 10 . 1 1 15 15 VAL N N 15 120.212 120.212 123.472 -3.260 25691
888 1 10 . 1 1 15 15 VAL HA H 15 3.888 3.888 4.121 -0.233 25691
889 1 10 . 1 1 16 16 TYR N N 16 126.887 126.887 121.651 5.236 25691
890 1 10 . 1 1 16 16 TYR HA H 16 4.683 4.683 5.445 -0.762 25691
891 1 10 . 1 1 17 17 CYS N N 17 120.474 120.474 120.101 0.373 25691
892 1 10 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.686 0.262 25691
893 1 10 . 1 1 18 18 THR N N 18 113.766 113.766 112.077 1.689 25691
894 1 10 . 1 1 18 18 THR HA H 18 4.656 4.656 4.774 -0.118 25691
895 1 10 . 1 1 19 19 ARG N N 19 116.621 116.621 119.334 -2.713 25691
896 1 10 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.413 -0.099 25691
897 1 10 . 1 1 20 20 GLU N N 20 121.887 121.887 120.855 1.032 25691
898 1 10 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.379 -0.268 25691
899 1 10 . 1 1 21 21 SER N N 21 118.596 118.596 117.451 1.145 25691
900 1 10 . 1 1 21 21 SER HA H 21 3.858 3.858 4.439 -0.581 25691
901 1 10 . 1 1 22 22 ASN N N 22 122.807 122.807 124.821 -2.014 25691
902 1 10 . 1 1 22 22 ASN HA H 22 5.019 5.019 4.934 0.085 25691
903 1 10 . 1 1 24 24 HIS N N 24 121.461 121.461 124.787 -3.326 25691
904 1 10 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.200 -1.071 25691
905 1 10 . 1 1 25 25 CYS N N 25 122.306 122.306 124.987 -2.681 25691
906 1 10 . 1 1 25 25 CYS HA H 25 5.096 5.096 4.802 0.294 25691
907 1 10 . 1 1 26 26 GLY N N 26 116.561 116.561 115.340 1.221 25691
908 1 10 . 1 1 27 27 SER N N 27 116.705 116.705 118.220 -1.515 25691
909 1 10 . 1 1 27 27 SER HA H 27 3.999 3.999 4.227 -0.228 25691
910 1 10 . 1 1 28 28 ASP N N 28 121.184 121.184 118.008 3.176 25691
911 1 10 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.776 -0.299 25691
912 1 10 . 1 1 29 29 GLY N N 29 109.717 109.717 107.646 2.071 25691
913 1 10 . 1 1 30 30 GLN N N 30 119.919 119.919 120.821 -0.902 25691
914 1 10 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.166 0.128 25691
915 1 10 . 1 1 31 31 THR N N 31 120.852 120.852 118.898 1.954 25691
916 1 10 . 1 1 31 31 THR HA H 31 4.612 4.612 5.263 -0.651 25691
917 1 10 . 1 1 32 32 TYR N N 32 129.107 129.107 124.885 4.222 25691
918 1 10 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.680 -0.195 25691
919 1 10 . 1 1 33 33 GLY N N 33 109.097 109.097 108.559 0.538 25691
920 1 10 . 1 1 34 34 ASN N N 34 109.942 109.942 113.844 -3.902 25691
921 1 10 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.055 0.009 25691
922 1 10 . 1 1 35 35 LYS N N 35 119.128 119.128 119.297 -0.169 25691
923 1 10 . 1 1 35 35 LYS HA H 35 3.029 3.029 4.118 -1.089 25691
924 1 10 . 1 1 36 36 CYS N N 36 119.799 119.799 117.303 2.496 25691
925 1 10 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.161 -1.592 25691
926 1 10 . 1 1 37 37 ALA N N 37 122.356 122.356 122.147 0.209 25691
927 1 10 . 1 1 37 37 ALA HA H 37 3.879 3.879 3.894 -0.015 25691
928 1 10 . 1 1 38 38 PHE N N 38 119.315 119.315 114.260 5.055 25691
929 1 10 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.345 -0.757 25691
930 1 10 . 1 1 39 39 CYS N N 39 117.511 117.511 121.044 -3.533 25691
931 1 10 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.934 0.052 25691
932 1 10 . 1 1 40 40 LYS N N 40 119.465 119.465 119.618 -0.153 25691
933 1 10 . 1 1 40 40 LYS HA H 40 3.854 3.854 4.043 -0.189 25691
934 1 10 . 1 1 41 41 ALA N N 41 123.083 123.083 121.016 2.067 25691
935 1 10 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.164 -0.112 25691
936 1 10 . 1 1 42 42 ILE N N 42 120.832 120.832 120.161 0.671 25691
937 1 10 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.380 -0.170 25691
938 1 10 . 1 1 43 43 VAL N N 43 121.341 121.341 118.019 3.322 25691
939 1 10 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.582 0.108 25691
940 1 10 . 1 1 44 44 LYS N N 44 122.202 122.202 118.534 3.668 25691
941 1 10 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.250 -0.176 25691
942 1 10 . 1 1 45 45 SER N N 45 111.517 111.517 113.961 -2.444 25691
943 1 10 . 1 1 45 45 SER HA H 45 4.475 4.475 4.484 -0.009 25691
944 1 10 . 1 1 46 46 GLY N N 46 112.139 112.139 107.925 4.214 25691
945 1 10 . 1 1 47 47 GLY N N 47 105.513 105.513 108.025 -2.512 25691
946 1 10 . 1 1 48 48 LYS N N 48 118.918 118.918 119.812 -0.894 25691
947 1 10 . 1 1 48 48 LYS HA H 48 4.147 4.147 3.983 0.164 25691
948 1 10 . 1 1 49 49 ILE N N 49 118.074 118.074 117.982 0.092 25691
949 1 10 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.058 -0.095 25691
950 1 10 . 1 1 50 50 SER N N 50 118.567 118.567 121.514 -2.947 25691
951 1 10 . 1 1 50 50 SER HA H 50 4.677 4.677 4.721 -0.044 25691
952 1 10 . 1 1 51 51 LEU N N 51 121.924 121.924 121.384 0.540 25691
953 1 10 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.465 -0.129 25691
954 1 10 . 1 1 52 52 LYS N N 52 131.859 131.859 126.919 4.940 25691
955 1 10 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.435 -0.120 25691
956 1 10 . 1 1 53 53 HIS N N 53 107.367 107.367 117.481 -10.114 25691
957 1 10 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.920 -0.040 25691
958 1 10 . 1 1 55 55 GLY N N 55 114.104 114.104 113.354 0.750 25691
959 1 10 . 1 1 56 56 LYS N N 56 113.793 113.793 119.442 -5.649 25691
960 1 10 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.139 -0.161 25691
961 1 11 . 1 1 2 2 GLY N N 2 109.255 109.255 109.355 -0.100 25691
962 1 11 . 1 1 3 3 GLY N N 3 108.760 108.760 109.776 -1.016 25691
963 1 11 . 1 1 4 4 GLN N N 4 119.481 119.481 123.238 -3.757 25691
964 1 11 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.323 0.073 25691
965 1 11 . 1 1 5 5 VAL N N 5 121.615 121.615 119.274 2.341 25691
966 1 11 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.185 -0.060 25691
967 1 11 . 1 1 6 6 ASP N N 6 125.372 125.372 124.545 0.827 25691
968 1 11 . 1 1 7 7 CYS N N 7 123.728 123.728 122.169 1.559 25691
969 1 11 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.712 0.314 25691
970 1 11 . 1 1 8 8 GLY N N 8 111.717 111.717 110.230 1.487 25691
971 1 11 . 1 1 9 9 GLU N N 9 119.502 119.502 119.416 0.086 25691
972 1 11 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.215 -0.174 25691
973 1 11 . 1 1 10 10 PHE N N 10 116.513 116.513 118.514 -2.001 25691
974 1 11 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.268 0.514 25691
975 1 11 . 1 1 11 11 GLN N N 11 118.042 118.042 119.428 -1.386 25691
976 1 11 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.000 -0.037 25691
977 1 11 . 1 1 12 12 ASP N N 12 120.313 120.313 115.720 4.593 25691
978 1 11 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.613 -0.110 25691
979 1 11 . 1 1 13 13 THR N N 13 118.013 118.013 115.134 2.879 25691
980 1 11 . 1 1 13 13 THR HA H 13 4.090 4.090 2.987 1.103 25691
981 1 11 . 1 1 14 14 LYS N N 14 119.942 119.942 118.253 1.689 25691
982 1 11 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.438 -0.277 25691
983 1 11 . 1 1 15 15 VAL N N 15 120.212 120.212 124.162 -3.950 25691
984 1 11 . 1 1 15 15 VAL HA H 15 3.888 3.888 4.051 -0.163 25691
985 1 11 . 1 1 16 16 TYR N N 16 126.887 126.887 122.216 4.671 25691
986 1 11 . 1 1 16 16 TYR HA H 16 4.683 4.683 5.121 -0.438 25691
987 1 11 . 1 1 17 17 CYS N N 17 120.474 120.474 119.865 0.609 25691
988 1 11 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.530 0.418 25691
989 1 11 . 1 1 18 18 THR N N 18 113.766 113.766 112.081 1.685 25691
990 1 11 . 1 1 18 18 THR HA H 18 4.656 4.656 4.256 0.400 25691
991 1 11 . 1 1 19 19 ARG N N 19 116.621 116.621 119.761 -3.140 25691
992 1 11 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.472 -0.158 25691
993 1 11 . 1 1 20 20 GLU N N 20 121.887 121.887 120.149 1.738 25691
994 1 11 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.519 -0.408 25691
995 1 11 . 1 1 21 21 SER N N 21 118.596 118.596 116.273 2.323 25691
996 1 11 . 1 1 21 21 SER HA H 21 3.858 3.858 4.495 -0.637 25691
997 1 11 . 1 1 22 22 ASN N N 22 122.807 122.807 124.301 -1.494 25691
998 1 11 . 1 1 22 22 ASN HA H 22 5.019 5.019 4.999 0.020 25691
999 1 11 . 1 1 24 24 HIS N N 24 121.461 121.461 122.289 -0.828 25691
1000 1 11 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.200 -1.071 25691
1001 1 11 . 1 1 25 25 CYS N N 25 122.306 122.306 124.708 -2.402 25691
1002 1 11 . 1 1 25 25 CYS HA H 25 5.096 5.096 5.035 0.061 25691
1003 1 11 . 1 1 26 26 GLY N N 26 116.561 116.561 115.426 1.135 25691
1004 1 11 . 1 1 27 27 SER N N 27 116.705 116.705 116.141 0.564 25691
1005 1 11 . 1 1 27 27 SER HA H 27 3.999 3.999 4.219 -0.220 25691
1006 1 11 . 1 1 28 28 ASP N N 28 121.184 121.184 120.319 0.865 25691
1007 1 11 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.542 -0.065 25691
1008 1 11 . 1 1 29 29 GLY N N 29 109.717 109.717 108.629 1.088 25691
1009 1 11 . 1 1 30 30 GLN N N 30 119.919 119.919 121.482 -1.563 25691
1010 1 11 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.440 -0.146 25691
1011 1 11 . 1 1 31 31 THR N N 31 120.852 120.852 119.032 1.820 25691
1012 1 11 . 1 1 31 31 THR HA H 31 4.612 4.612 5.270 -0.658 25691
1013 1 11 . 1 1 32 32 TYR N N 32 129.107 129.107 123.673 5.434 25691
1014 1 11 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.865 -0.380 25691
1015 1 11 . 1 1 33 33 GLY N N 33 109.097 109.097 109.567 -0.470 25691
1016 1 11 . 1 1 34 34 ASN N N 34 109.942 109.942 112.897 -2.955 25691
1017 1 11 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.109 -0.045 25691
1018 1 11 . 1 1 35 35 LYS N N 35 119.128 119.128 119.066 0.062 25691
1019 1 11 . 1 1 35 35 LYS HA H 35 3.029 3.029 3.334 -0.305 25691
1020 1 11 . 1 1 36 36 CYS N N 36 119.799 119.799 117.962 1.837 25691
1021 1 11 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.086 -1.517 25691
1022 1 11 . 1 1 37 37 ALA N N 37 122.356 122.356 122.737 -0.381 25691
1023 1 11 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.125 -0.246 25691
1024 1 11 . 1 1 38 38 PHE N N 38 119.315 119.315 108.842 10.473 25691
1025 1 11 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.811 -1.223 25691
1026 1 11 . 1 1 39 39 CYS N N 39 117.511 117.511 122.756 -5.245 25691
1027 1 11 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.945 0.041 25691
1028 1 11 . 1 1 40 40 LYS N N 40 119.465 119.465 120.146 -0.681 25691
1029 1 11 . 1 1 40 40 LYS HA H 40 3.854 3.854 4.010 -0.156 25691
1030 1 11 . 1 1 41 41 ALA N N 41 123.083 123.083 120.478 2.605 25691
1031 1 11 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.220 -0.168 25691
1032 1 11 . 1 1 42 42 ILE N N 42 120.832 120.832 120.189 0.643 25691
1033 1 11 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.741 -0.531 25691
1034 1 11 . 1 1 43 43 VAL N N 43 121.341 121.341 119.865 1.476 25691
1035 1 11 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.570 0.120 25691
1036 1 11 . 1 1 44 44 LYS N N 44 122.202 122.202 118.752 3.450 25691
1037 1 11 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.122 -0.048 25691
1038 1 11 . 1 1 45 45 SER N N 45 111.517 111.517 112.596 -1.079 25691
1039 1 11 . 1 1 45 45 SER HA H 45 4.475 4.475 4.310 0.165 25691
1040 1 11 . 1 1 46 46 GLY N N 46 112.139 112.139 104.288 7.851 25691
1041 1 11 . 1 1 47 47 GLY N N 47 105.513 105.513 109.139 -3.626 25691
1042 1 11 . 1 1 48 48 LYS N N 48 118.918 118.918 118.829 0.089 25691
1043 1 11 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.100 0.047 25691
1044 1 11 . 1 1 49 49 ILE N N 49 118.074 118.074 119.649 -1.575 25691
1045 1 11 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.015 -0.052 25691
1046 1 11 . 1 1 50 50 SER N N 50 118.567 118.567 121.786 -3.219 25691
1047 1 11 . 1 1 50 50 SER HA H 50 4.677 4.677 4.766 -0.089 25691
1048 1 11 . 1 1 51 51 LEU N N 51 121.924 121.924 122.128 -0.204 25691
1049 1 11 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.463 -0.127 25691
1050 1 11 . 1 1 52 52 LYS N N 52 131.859 131.859 126.505 5.354 25691
1051 1 11 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.439 -0.124 25691
1052 1 11 . 1 1 53 53 HIS N N 53 107.367 107.367 117.653 -10.286 25691
1053 1 11 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.971 -0.091 25691
1054 1 11 . 1 1 55 55 GLY N N 55 114.104 114.104 113.596 0.508 25691
1055 1 11 . 1 1 56 56 LYS N N 56 113.793 113.793 118.450 -4.657 25691
1056 1 11 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.305 -0.327 25691
1057 1 12 . 1 1 2 2 GLY N N 2 109.255 109.255 108.166 1.089 25691
1058 1 12 . 1 1 3 3 GLY N N 3 108.760 108.760 105.936 2.824 25691
1059 1 12 . 1 1 4 4 GLN N N 4 119.481 119.481 123.523 -4.042 25691
1060 1 12 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.254 0.142 25691
1061 1 12 . 1 1 5 5 VAL N N 5 121.615 121.615 126.481 -4.866 25691
1062 1 12 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.180 -0.055 25691
1063 1 12 . 1 1 6 6 ASP N N 6 125.372 125.372 126.704 -1.332 25691
1064 1 12 . 1 1 7 7 CYS N N 7 123.728 123.728 125.925 -2.197 25691
1065 1 12 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.659 0.367 25691
1066 1 12 . 1 1 8 8 GLY N N 8 111.717 111.717 109.677 2.040 25691
1067 1 12 . 1 1 9 9 GLU N N 9 119.502 119.502 120.734 -1.232 25691
1068 1 12 . 1 1 9 9 GLU HA H 9 4.041 4.041 3.906 0.135 25691
1069 1 12 . 1 1 10 10 PHE N N 10 116.513 116.513 116.026 0.487 25691
1070 1 12 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.722 0.060 25691
1071 1 12 . 1 1 11 11 GLN N N 11 118.042 118.042 118.573 -0.531 25691
1072 1 12 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.153 -0.190 25691
1073 1 12 . 1 1 12 12 ASP N N 12 120.313 120.313 112.716 7.597 25691
1074 1 12 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.682 -0.179 25691
1075 1 12 . 1 1 13 13 THR N N 13 118.013 118.013 113.002 5.011 25691
1076 1 12 . 1 1 13 13 THR HA H 13 4.090 4.090 4.425 -0.335 25691
1077 1 12 . 1 1 14 14 LYS N N 14 119.942 119.942 121.626 -1.684 25691
1078 1 12 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.531 -0.370 25691
1079 1 12 . 1 1 15 15 VAL N N 15 120.212 120.212 123.308 -3.096 25691
1080 1 12 . 1 1 15 15 VAL HA H 15 3.888 3.888 4.014 -0.126 25691
1081 1 12 . 1 1 16 16 TYR N N 16 126.887 126.887 122.158 4.729 25691
1082 1 12 . 1 1 16 16 TYR HA H 16 4.683 4.683 4.755 -0.072 25691
1083 1 12 . 1 1 17 17 CYS N N 17 120.474 120.474 115.430 5.044 25691
1084 1 12 . 1 1 17 17 CYS HA H 17 4.948 4.948 5.033 -0.085 25691
1085 1 12 . 1 1 18 18 THR N N 18 113.766 113.766 112.255 1.511 25691
1086 1 12 . 1 1 18 18 THR HA H 18 4.656 4.656 4.733 -0.077 25691
1087 1 12 . 1 1 19 19 ARG N N 19 116.621 116.621 122.697 -6.076 25691
1088 1 12 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.702 -0.388 25691
1089 1 12 . 1 1 20 20 GLU N N 20 121.887 121.887 122.378 -0.491 25691
1090 1 12 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.459 -0.348 25691
1091 1 12 . 1 1 21 21 SER N N 21 118.596 118.596 115.971 2.625 25691
1092 1 12 . 1 1 21 21 SER HA H 21 3.858 3.858 4.376 -0.518 25691
1093 1 12 . 1 1 22 22 ASN N N 22 122.807 122.807 121.894 0.913 25691
1094 1 12 . 1 1 22 22 ASN HA H 22 5.019 5.019 5.182 -0.163 25691
1095 1 12 . 1 1 24 24 HIS N N 24 121.461 121.461 119.347 2.114 25691
1096 1 12 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.102 -0.973 25691
1097 1 12 . 1 1 25 25 CYS N N 25 122.306 122.306 125.719 -3.413 25691
1098 1 12 . 1 1 25 25 CYS HA H 25 5.096 5.096 5.246 -0.150 25691
1099 1 12 . 1 1 26 26 GLY N N 26 116.561 116.561 115.355 1.206 25691
1100 1 12 . 1 1 27 27 SER N N 27 116.705 116.705 116.362 0.343 25691
1101 1 12 . 1 1 27 27 SER HA H 27 3.999 3.999 4.243 -0.244 25691
1102 1 12 . 1 1 28 28 ASP N N 28 121.184 121.184 120.616 0.568 25691
1103 1 12 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.574 -0.097 25691
1104 1 12 . 1 1 29 29 GLY N N 29 109.717 109.717 108.327 1.390 25691
1105 1 12 . 1 1 30 30 GLN N N 30 119.919 119.919 121.608 -1.689 25691
1106 1 12 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.162 0.132 25691
1107 1 12 . 1 1 31 31 THR N N 31 120.852 120.852 118.996 1.856 25691
1108 1 12 . 1 1 31 31 THR HA H 31 4.612 4.612 5.229 -0.617 25691
1109 1 12 . 1 1 32 32 TYR N N 32 129.107 129.107 126.319 2.788 25691
1110 1 12 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.683 -0.198 25691
1111 1 12 . 1 1 33 33 GLY N N 33 109.097 109.097 109.566 -0.469 25691
1112 1 12 . 1 1 34 34 ASN N N 34 109.942 109.942 112.810 -2.868 25691
1113 1 12 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.513 -0.449 25691
1114 1 12 . 1 1 35 35 LYS N N 35 119.128 119.128 120.085 -0.957 25691
1115 1 12 . 1 1 35 35 LYS HA H 35 3.029 3.029 3.601 -0.572 25691
1116 1 12 . 1 1 36 36 CYS N N 36 119.799 119.799 117.717 2.082 25691
1117 1 12 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.408 -1.839 25691
1118 1 12 . 1 1 37 37 ALA N N 37 122.356 122.356 122.785 -0.429 25691
1119 1 12 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.120 -0.241 25691
1120 1 12 . 1 1 38 38 PHE N N 38 119.315 119.315 115.009 4.306 25691
1121 1 12 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.280 -0.692 25691
1122 1 12 . 1 1 39 39 CYS N N 39 117.511 117.511 121.887 -4.376 25691
1123 1 12 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.860 0.126 25691
1124 1 12 . 1 1 40 40 LYS N N 40 119.465 119.465 120.136 -0.671 25691
1125 1 12 . 1 1 40 40 LYS HA H 40 3.854 3.854 3.994 -0.140 25691
1126 1 12 . 1 1 41 41 ALA N N 41 123.083 123.083 120.878 2.205 25691
1127 1 12 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.048 0.004 25691
1128 1 12 . 1 1 42 42 ILE N N 42 120.832 120.832 119.648 1.184 25691
1129 1 12 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.357 -0.147 25691
1130 1 12 . 1 1 43 43 VAL N N 43 121.341 121.341 118.168 3.173 25691
1131 1 12 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.780 -0.090 25691
1132 1 12 . 1 1 44 44 LYS N N 44 122.202 122.202 120.031 2.171 25691
1133 1 12 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.168 -0.094 25691
1134 1 12 . 1 1 45 45 SER N N 45 111.517 111.517 113.006 -1.489 25691
1135 1 12 . 1 1 45 45 SER HA H 45 4.475 4.475 4.613 -0.138 25691
1136 1 12 . 1 1 46 46 GLY N N 46 112.139 112.139 108.023 4.116 25691
1137 1 12 . 1 1 47 47 GLY N N 47 105.513 105.513 106.899 -1.386 25691
1138 1 12 . 1 1 48 48 LYS N N 48 118.918 118.918 119.344 -0.426 25691
1139 1 12 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.153 -0.006 25691
1140 1 12 . 1 1 49 49 ILE N N 49 118.074 118.074 119.855 -1.781 25691
1141 1 12 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.124 -0.161 25691
1142 1 12 . 1 1 50 50 SER N N 50 118.567 118.567 120.507 -1.940 25691
1143 1 12 . 1 1 50 50 SER HA H 50 4.677 4.677 4.838 -0.161 25691
1144 1 12 . 1 1 51 51 LEU N N 51 121.924 121.924 122.599 -0.675 25691
1145 1 12 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.512 -0.176 25691
1146 1 12 . 1 1 52 52 LYS N N 52 131.859 131.859 128.174 3.685 25691
1147 1 12 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.342 -0.027 25691
1148 1 12 . 1 1 53 53 HIS N N 53 107.367 107.367 112.582 -5.215 25691
1149 1 12 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.785 0.095 25691
1150 1 12 . 1 1 55 55 GLY N N 55 114.104 114.104 109.211 4.893 25691
1151 1 12 . 1 1 56 56 LYS N N 56 113.793 113.793 119.086 -5.293 25691
1152 1 12 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.135 -0.157 25691
1153 1 13 . 1 1 2 2 GLY N N 2 109.255 109.255 108.345 0.910 25691
1154 1 13 . 1 1 3 3 GLY N N 3 108.760 108.760 107.186 1.574 25691
1155 1 13 . 1 1 4 4 GLN N N 4 119.481 119.481 118.924 0.557 25691
1156 1 13 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.186 0.210 25691
1157 1 13 . 1 1 5 5 VAL N N 5 121.615 121.615 120.777 0.838 25691
1158 1 13 . 1 1 5 5 VAL HA H 5 4.125 4.125 3.659 0.466 25691
1159 1 13 . 1 1 6 6 ASP N N 6 125.372 125.372 125.797 -0.425 25691
1160 1 13 . 1 1 7 7 CYS N N 7 123.728 123.728 121.992 1.736 25691
1161 1 13 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.299 0.727 25691
1162 1 13 . 1 1 8 8 GLY N N 8 111.717 111.717 110.329 1.388 25691
1163 1 13 . 1 1 9 9 GLU N N 9 119.502 119.502 123.524 -4.022 25691
1164 1 13 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.335 -0.294 25691
1165 1 13 . 1 1 10 10 PHE N N 10 116.513 116.513 121.142 -4.629 25691
1166 1 13 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.703 0.079 25691
1167 1 13 . 1 1 11 11 GLN N N 11 118.042 118.042 118.792 -0.750 25691
1168 1 13 . 1 1 11 11 GLN HA H 11 3.963 3.963 3.882 0.081 25691
1169 1 13 . 1 1 12 12 ASP N N 12 120.313 120.313 117.331 2.982 25691
1170 1 13 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.566 -0.063 25691
1171 1 13 . 1 1 13 13 THR N N 13 118.013 118.013 122.843 -4.830 25691
1172 1 13 . 1 1 13 13 THR HA H 13 4.090 4.090 4.183 -0.093 25691
1173 1 13 . 1 1 14 14 LYS N N 14 119.942 119.942 120.543 -0.601 25691
1174 1 13 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.416 -0.255 25691
1175 1 13 . 1 1 15 15 VAL N N 15 120.212 120.212 122.907 -2.695 25691
1176 1 13 . 1 1 15 15 VAL HA H 15 3.888 3.888 4.065 -0.177 25691
1177 1 13 . 1 1 16 16 TYR N N 16 126.887 126.887 120.952 5.935 25691
1178 1 13 . 1 1 16 16 TYR HA H 16 4.683 4.683 4.920 -0.237 25691
1179 1 13 . 1 1 17 17 CYS N N 17 120.474 120.474 118.697 1.777 25691
1180 1 13 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.920 0.028 25691
1181 1 13 . 1 1 18 18 THR N N 18 113.766 113.766 115.401 -1.635 25691
1182 1 13 . 1 1 18 18 THR HA H 18 4.656 4.656 4.451 0.205 25691
1183 1 13 . 1 1 19 19 ARG N N 19 116.621 116.621 120.072 -3.451 25691
1184 1 13 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.401 -0.087 25691
1185 1 13 . 1 1 20 20 GLU N N 20 121.887 121.887 122.753 -0.866 25691
1186 1 13 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.210 -0.099 25691
1187 1 13 . 1 1 21 21 SER N N 21 118.596 118.596 119.129 -0.533 25691
1188 1 13 . 1 1 21 21 SER HA H 21 3.858 3.858 4.379 -0.521 25691
1189 1 13 . 1 1 22 22 ASN N N 22 122.807 122.807 122.706 0.101 25691
1190 1 13 . 1 1 22 22 ASN HA H 22 5.019 5.019 4.785 0.234 25691
1191 1 13 . 1 1 24 24 HIS N N 24 121.461 121.461 120.678 0.783 25691
1192 1 13 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.046 -0.917 25691
1193 1 13 . 1 1 25 25 CYS N N 25 122.306 122.306 125.865 -3.559 25691
1194 1 13 . 1 1 25 25 CYS HA H 25 5.096 5.096 4.932 0.164 25691
1195 1 13 . 1 1 26 26 GLY N N 26 116.561 116.561 114.816 1.745 25691
1196 1 13 . 1 1 27 27 SER N N 27 116.705 116.705 116.023 0.682 25691
1197 1 13 . 1 1 27 27 SER HA H 27 3.999 3.999 4.401 -0.402 25691
1198 1 13 . 1 1 28 28 ASP N N 28 121.184 121.184 120.065 1.119 25691
1199 1 13 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.582 -0.105 25691
1200 1 13 . 1 1 29 29 GLY N N 29 109.717 109.717 108.348 1.369 25691
1201 1 13 . 1 1 30 30 GLN N N 30 119.919 119.919 120.542 -0.623 25691
1202 1 13 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.385 -0.091 25691
1203 1 13 . 1 1 31 31 THR N N 31 120.852 120.852 117.697 3.155 25691
1204 1 13 . 1 1 31 31 THR HA H 31 4.612 4.612 5.046 -0.434 25691
1205 1 13 . 1 1 32 32 TYR N N 32 129.107 129.107 126.921 2.186 25691
1206 1 13 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.767 -0.282 25691
1207 1 13 . 1 1 33 33 GLY N N 33 109.097 109.097 109.841 -0.744 25691
1208 1 13 . 1 1 34 34 ASN N N 34 109.942 109.942 114.371 -4.429 25691
1209 1 13 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.142 -0.078 25691
1210 1 13 . 1 1 35 35 LYS N N 35 119.128 119.128 119.940 -0.812 25691
1211 1 13 . 1 1 35 35 LYS HA H 35 3.029 3.029 4.312 -1.283 25691
1212 1 13 . 1 1 36 36 CYS N N 36 119.799 119.799 117.276 2.523 25691
1213 1 13 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.216 -1.647 25691
1214 1 13 . 1 1 37 37 ALA N N 37 122.356 122.356 122.430 -0.074 25691
1215 1 13 . 1 1 37 37 ALA HA H 37 3.879 3.879 3.935 -0.056 25691
1216 1 13 . 1 1 38 38 PHE N N 38 119.315 119.315 117.707 1.608 25691
1217 1 13 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.341 -0.753 25691
1218 1 13 . 1 1 39 39 CYS N N 39 117.511 117.511 120.654 -3.143 25691
1219 1 13 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.883 0.103 25691
1220 1 13 . 1 1 40 40 LYS N N 40 119.465 119.465 120.334 -0.869 25691
1221 1 13 . 1 1 40 40 LYS HA H 40 3.854 3.854 3.918 -0.064 25691
1222 1 13 . 1 1 41 41 ALA N N 41 123.083 123.083 122.042 1.041 25691
1223 1 13 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.075 -0.023 25691
1224 1 13 . 1 1 42 42 ILE N N 42 120.832 120.832 119.041 1.791 25691
1225 1 13 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.523 -0.313 25691
1226 1 13 . 1 1 43 43 VAL N N 43 121.341 121.341 119.151 2.190 25691
1227 1 13 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.839 -0.149 25691
1228 1 13 . 1 1 44 44 LYS N N 44 122.202 122.202 116.821 5.381 25691
1229 1 13 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.299 -0.225 25691
1230 1 13 . 1 1 45 45 SER N N 45 111.517 111.517 113.671 -2.154 25691
1231 1 13 . 1 1 45 45 SER HA H 45 4.475 4.475 4.305 0.170 25691
1232 1 13 . 1 1 46 46 GLY N N 46 112.139 112.139 104.546 7.593 25691
1233 1 13 . 1 1 47 47 GLY N N 47 105.513 105.513 108.453 -2.940 25691
1234 1 13 . 1 1 48 48 LYS N N 48 118.918 118.918 118.640 0.278 25691
1235 1 13 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.066 0.081 25691
1236 1 13 . 1 1 49 49 ILE N N 49 118.074 118.074 118.569 -0.495 25691
1237 1 13 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.047 -0.084 25691
1238 1 13 . 1 1 50 50 SER N N 50 118.567 118.567 119.545 -0.978 25691
1239 1 13 . 1 1 50 50 SER HA H 50 4.677 4.677 4.758 -0.081 25691
1240 1 13 . 1 1 51 51 LEU N N 51 121.924 121.924 120.929 0.995 25691
1241 1 13 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.468 -0.132 25691
1242 1 13 . 1 1 52 52 LYS N N 52 131.859 131.859 124.403 7.456 25691
1243 1 13 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.070 0.245 25691
1244 1 13 . 1 1 53 53 HIS N N 53 107.367 107.367 115.860 -8.493 25691
1245 1 13 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.899 -0.019 25691
1246 1 13 . 1 1 55 55 GLY N N 55 114.104 114.104 112.392 1.712 25691
1247 1 13 . 1 1 56 56 LYS N N 56 113.793 113.793 118.878 -5.085 25691
1248 1 13 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.296 -0.318 25691
1249 1 14 . 1 1 2 2 GLY N N 2 109.255 109.255 110.901 -1.646 25691
1250 1 14 . 1 1 3 3 GLY N N 3 108.760 108.760 113.113 -4.353 25691
1251 1 14 . 1 1 4 4 GLN N N 4 119.481 119.481 122.705 -3.224 25691
1252 1 14 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.624 -0.228 25691
1253 1 14 . 1 1 5 5 VAL N N 5 121.615 121.615 120.871 0.744 25691
1254 1 14 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.638 -0.513 25691
1255 1 14 . 1 1 6 6 ASP N N 6 125.372 125.372 122.555 2.817 25691
1256 1 14 . 1 1 7 7 CYS N N 7 123.728 123.728 123.031 0.697 25691
1257 1 14 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.508 0.518 25691
1258 1 14 . 1 1 8 8 GLY N N 8 111.717 111.717 109.511 2.206 25691
1259 1 14 . 1 1 9 9 GLU N N 9 119.502 119.502 119.916 -0.414 25691
1260 1 14 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.071 -0.030 25691
1261 1 14 . 1 1 10 10 PHE N N 10 116.513 116.513 117.345 -0.832 25691
1262 1 14 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.362 0.420 25691
1263 1 14 . 1 1 11 11 GLN N N 11 118.042 118.042 117.568 0.474 25691
1264 1 14 . 1 1 11 11 GLN HA H 11 3.963 3.963 3.976 -0.013 25691
1265 1 14 . 1 1 12 12 ASP N N 12 120.313 120.313 113.892 6.421 25691
1266 1 14 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.661 -0.158 25691
1267 1 14 . 1 1 13 13 THR N N 13 118.013 118.013 114.970 3.043 25691
1268 1 14 . 1 1 13 13 THR HA H 13 4.090 4.090 3.195 0.895 25691
1269 1 14 . 1 1 14 14 LYS N N 14 119.942 119.942 118.705 1.237 25691
1270 1 14 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.464 -0.303 25691
1271 1 14 . 1 1 15 15 VAL N N 15 120.212 120.212 122.880 -2.668 25691
1272 1 14 . 1 1 15 15 VAL HA H 15 3.888 3.888 4.143 -0.255 25691
1273 1 14 . 1 1 16 16 TYR N N 16 126.887 126.887 120.725 6.162 25691
1274 1 14 . 1 1 16 16 TYR HA H 16 4.683 4.683 5.190 -0.507 25691
1275 1 14 . 1 1 17 17 CYS N N 17 120.474 120.474 120.919 -0.445 25691
1276 1 14 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.849 0.099 25691
1277 1 14 . 1 1 18 18 THR N N 18 113.766 113.766 113.746 0.020 25691
1278 1 14 . 1 1 18 18 THR HA H 18 4.656 4.656 4.680 -0.024 25691
1279 1 14 . 1 1 19 19 ARG N N 19 116.621 116.621 120.003 -3.382 25691
1280 1 14 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.425 -0.111 25691
1281 1 14 . 1 1 20 20 GLU N N 20 121.887 121.887 122.138 -0.251 25691
1282 1 14 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.441 -0.330 25691
1283 1 14 . 1 1 21 21 SER N N 21 118.596 118.596 117.237 1.359 25691
1284 1 14 . 1 1 21 21 SER HA H 21 3.858 3.858 4.441 -0.583 25691
1285 1 14 . 1 1 22 22 ASN N N 22 122.807 122.807 124.607 -1.800 25691
1286 1 14 . 1 1 22 22 ASN HA H 22 5.019 5.019 4.958 0.061 25691
1287 1 14 . 1 1 24 24 HIS N N 24 121.461 121.461 121.807 -0.346 25691
1288 1 14 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.148 -1.019 25691
1289 1 14 . 1 1 25 25 CYS N N 25 122.306 122.306 125.301 -2.995 25691
1290 1 14 . 1 1 25 25 CYS HA H 25 5.096 5.096 4.906 0.190 25691
1291 1 14 . 1 1 26 26 GLY N N 26 116.561 116.561 115.940 0.621 25691
1292 1 14 . 1 1 27 27 SER N N 27 116.705 116.705 117.061 -0.356 25691
1293 1 14 . 1 1 27 27 SER HA H 27 3.999 3.999 4.028 -0.029 25691
1294 1 14 . 1 1 28 28 ASP N N 28 121.184 121.184 120.763 0.421 25691
1295 1 14 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.426 0.051 25691
1296 1 14 . 1 1 29 29 GLY N N 29 109.717 109.717 107.153 2.564 25691
1297 1 14 . 1 1 30 30 GLN N N 30 119.919 119.919 120.608 -0.689 25691
1298 1 14 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.264 0.030 25691
1299 1 14 . 1 1 31 31 THR N N 31 120.852 120.852 120.056 0.796 25691
1300 1 14 . 1 1 31 31 THR HA H 31 4.612 4.612 5.325 -0.713 25691
1301 1 14 . 1 1 32 32 TYR N N 32 129.107 129.107 123.670 5.437 25691
1302 1 14 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.876 -0.391 25691
1303 1 14 . 1 1 33 33 GLY N N 33 109.097 109.097 110.310 -1.213 25691
1304 1 14 . 1 1 34 34 ASN N N 34 109.942 109.942 113.040 -3.098 25691
1305 1 14 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.250 -0.186 25691
1306 1 14 . 1 1 35 35 LYS N N 35 119.128 119.128 119.757 -0.629 25691
1307 1 14 . 1 1 35 35 LYS HA H 35 3.029 3.029 4.663 -1.634 25691
1308 1 14 . 1 1 36 36 CYS N N 36 119.799 119.799 118.176 1.623 25691
1309 1 14 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.270 -1.701 25691
1310 1 14 . 1 1 37 37 ALA N N 37 122.356 122.356 123.121 -0.765 25691
1311 1 14 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.111 -0.232 25691
1312 1 14 . 1 1 38 38 PHE N N 38 119.315 119.315 114.545 4.770 25691
1313 1 14 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.468 -0.880 25691
1314 1 14 . 1 1 39 39 CYS N N 39 117.511 117.511 122.125 -4.614 25691
1315 1 14 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.835 0.151 25691
1316 1 14 . 1 1 40 40 LYS N N 40 119.465 119.465 119.680 -0.215 25691
1317 1 14 . 1 1 40 40 LYS HA H 40 3.854 3.854 4.011 -0.157 25691
1318 1 14 . 1 1 41 41 ALA N N 41 123.083 123.083 120.890 2.193 25691
1319 1 14 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.125 -0.073 25691
1320 1 14 . 1 1 42 42 ILE N N 42 120.832 120.832 119.935 0.897 25691
1321 1 14 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.410 -0.200 25691
1322 1 14 . 1 1 43 43 VAL N N 43 121.341 121.341 119.037 2.304 25691
1323 1 14 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.487 0.203 25691
1324 1 14 . 1 1 44 44 LYS N N 44 122.202 122.202 118.210 3.992 25691
1325 1 14 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.100 -0.026 25691
1326 1 14 . 1 1 45 45 SER N N 45 111.517 111.517 112.369 -0.852 25691
1327 1 14 . 1 1 45 45 SER HA H 45 4.475 4.475 4.429 0.046 25691
1328 1 14 . 1 1 46 46 GLY N N 46 112.139 112.139 106.507 5.632 25691
1329 1 14 . 1 1 47 47 GLY N N 47 105.513 105.513 109.198 -3.685 25691
1330 1 14 . 1 1 48 48 LYS N N 48 118.918 118.918 120.200 -1.282 25691
1331 1 14 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.030 0.117 25691
1332 1 14 . 1 1 49 49 ILE N N 49 118.074 118.074 118.480 -0.406 25691
1333 1 14 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.201 -0.238 25691
1334 1 14 . 1 1 50 50 SER N N 50 118.567 118.567 120.930 -2.363 25691
1335 1 14 . 1 1 50 50 SER HA H 50 4.677 4.677 4.751 -0.074 25691
1336 1 14 . 1 1 51 51 LEU N N 51 121.924 121.924 121.922 0.002 25691
1337 1 14 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.536 -0.200 25691
1338 1 14 . 1 1 52 52 LYS N N 52 131.859 131.859 124.564 7.295 25691
1339 1 14 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.144 0.171 25691
1340 1 14 . 1 1 53 53 HIS N N 53 107.367 107.367 116.447 -9.080 25691
1341 1 14 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.950 -0.070 25691
1342 1 14 . 1 1 55 55 GLY N N 55 114.104 114.104 112.813 1.291 25691
1343 1 14 . 1 1 56 56 LYS N N 56 113.793 113.793 119.667 -5.874 25691
1344 1 14 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.020 -0.042 25691
1345 1 15 . 1 1 2 2 GLY N N 2 109.255 109.255 106.555 2.700 25691
1346 1 15 . 1 1 3 3 GLY N N 3 108.760 108.760 111.349 -2.589 25691
1347 1 15 . 1 1 4 4 GLN N N 4 119.481 119.481 118.969 0.512 25691
1348 1 15 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.570 -0.174 25691
1349 1 15 . 1 1 5 5 VAL N N 5 121.615 121.615 121.073 0.542 25691
1350 1 15 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.271 -0.146 25691
1351 1 15 . 1 1 6 6 ASP N N 6 125.372 125.372 127.926 -2.554 25691
1352 1 15 . 1 1 7 7 CYS N N 7 123.728 123.728 122.400 1.328 25691
1353 1 15 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.702 0.324 25691
1354 1 15 . 1 1 8 8 GLY N N 8 111.717 111.717 110.235 1.482 25691
1355 1 15 . 1 1 9 9 GLU N N 9 119.502 119.502 119.789 -0.287 25691
1356 1 15 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.162 -0.121 25691
1357 1 15 . 1 1 10 10 PHE N N 10 116.513 116.513 118.805 -2.292 25691
1358 1 15 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.221 0.561 25691
1359 1 15 . 1 1 11 11 GLN N N 11 118.042 118.042 121.450 -3.408 25691
1360 1 15 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.151 -0.188 25691
1361 1 15 . 1 1 12 12 ASP N N 12 120.313 120.313 116.288 4.025 25691
1362 1 15 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.347 0.156 25691
1363 1 15 . 1 1 13 13 THR N N 13 118.013 118.013 116.196 1.817 25691
1364 1 15 . 1 1 13 13 THR HA H 13 4.090 4.090 3.582 0.508 25691
1365 1 15 . 1 1 14 14 LYS N N 14 119.942 119.942 119.060 0.882 25691
1366 1 15 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.087 0.074 25691
1367 1 15 . 1 1 15 15 VAL N N 15 120.212 120.212 122.387 -2.175 25691
1368 1 15 . 1 1 15 15 VAL HA H 15 3.888 3.888 3.867 0.021 25691
1369 1 15 . 1 1 16 16 TYR N N 16 126.887 126.887 124.138 2.749 25691
1370 1 15 . 1 1 16 16 TYR HA H 16 4.683 4.683 4.801 -0.118 25691
1371 1 15 . 1 1 17 17 CYS N N 17 120.474 120.474 117.275 3.199 25691
1372 1 15 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.766 0.182 25691
1373 1 15 . 1 1 18 18 THR N N 18 113.766 113.766 112.294 1.472 25691
1374 1 15 . 1 1 18 18 THR HA H 18 4.656 4.656 4.446 0.210 25691
1375 1 15 . 1 1 19 19 ARG N N 19 116.621 116.621 119.404 -2.783 25691
1376 1 15 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.439 -0.125 25691
1377 1 15 . 1 1 20 20 GLU N N 20 121.887 121.887 120.489 1.398 25691
1378 1 15 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.510 -0.399 25691
1379 1 15 . 1 1 21 21 SER N N 21 118.596 118.596 116.975 1.621 25691
1380 1 15 . 1 1 21 21 SER HA H 21 3.858 3.858 4.675 -0.817 25691
1381 1 15 . 1 1 22 22 ASN N N 22 122.807 122.807 124.932 -2.125 25691
1382 1 15 . 1 1 22 22 ASN HA H 22 5.019 5.019 5.206 -0.187 25691
1383 1 15 . 1 1 24 24 HIS N N 24 121.461 121.461 120.030 1.431 25691
1384 1 15 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.541 -1.412 25691
1385 1 15 . 1 1 25 25 CYS N N 25 122.306 122.306 123.055 -0.749 25691
1386 1 15 . 1 1 25 25 CYS HA H 25 5.096 5.096 4.992 0.104 25691
1387 1 15 . 1 1 26 26 GLY N N 26 116.561 116.561 114.804 1.757 25691
1388 1 15 . 1 1 27 27 SER N N 27 116.705 116.705 117.987 -1.282 25691
1389 1 15 . 1 1 27 27 SER HA H 27 3.999 3.999 4.168 -0.169 25691
1390 1 15 . 1 1 28 28 ASP N N 28 121.184 121.184 119.636 1.548 25691
1391 1 15 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.595 -0.118 25691
1392 1 15 . 1 1 29 29 GLY N N 29 109.717 109.717 107.798 1.919 25691
1393 1 15 . 1 1 30 30 GLN N N 30 119.919 119.919 120.705 -0.786 25691
1394 1 15 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.172 0.122 25691
1395 1 15 . 1 1 31 31 THR N N 31 120.852 120.852 118.232 2.620 25691
1396 1 15 . 1 1 31 31 THR HA H 31 4.612 4.612 4.994 -0.382 25691
1397 1 15 . 1 1 32 32 TYR N N 32 129.107 129.107 124.671 4.436 25691
1398 1 15 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.587 -0.102 25691
1399 1 15 . 1 1 33 33 GLY N N 33 109.097 109.097 107.860 1.237 25691
1400 1 15 . 1 1 34 34 ASN N N 34 109.942 109.942 111.520 -1.578 25691
1401 1 15 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.258 -0.194 25691
1402 1 15 . 1 1 35 35 LYS N N 35 119.128 119.128 119.647 -0.519 25691
1403 1 15 . 1 1 35 35 LYS HA H 35 3.029 3.029 4.090 -1.061 25691
1404 1 15 . 1 1 36 36 CYS N N 36 119.799 119.799 117.308 2.491 25691
1405 1 15 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.183 -1.614 25691
1406 1 15 . 1 1 37 37 ALA N N 37 122.356 122.356 123.862 -1.506 25691
1407 1 15 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.021 -0.142 25691
1408 1 15 . 1 1 38 38 PHE N N 38 119.315 119.315 114.588 4.727 25691
1409 1 15 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.317 -0.729 25691
1410 1 15 . 1 1 39 39 CYS N N 39 117.511 117.511 120.892 -3.381 25691
1411 1 15 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.982 0.004 25691
1412 1 15 . 1 1 40 40 LYS N N 40 119.465 119.465 119.822 -0.357 25691
1413 1 15 . 1 1 40 40 LYS HA H 40 3.854 3.854 4.185 -0.331 25691
1414 1 15 . 1 1 41 41 ALA N N 41 123.083 123.083 121.099 1.984 25691
1415 1 15 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.057 -0.005 25691
1416 1 15 . 1 1 42 42 ILE N N 42 120.832 120.832 119.821 1.011 25691
1417 1 15 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.550 -0.340 25691
1418 1 15 . 1 1 43 43 VAL N N 43 121.341 121.341 119.499 1.842 25691
1419 1 15 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.494 0.196 25691
1420 1 15 . 1 1 44 44 LYS N N 44 122.202 122.202 119.789 2.413 25691
1421 1 15 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.075 -0.001 25691
1422 1 15 . 1 1 45 45 SER N N 45 111.517 111.517 113.047 -1.530 25691
1423 1 15 . 1 1 45 45 SER HA H 45 4.475 4.475 4.536 -0.061 25691
1424 1 15 . 1 1 46 46 GLY N N 46 112.139 112.139 107.865 4.274 25691
1425 1 15 . 1 1 47 47 GLY N N 47 105.513 105.513 107.186 -1.673 25691
1426 1 15 . 1 1 48 48 LYS N N 48 118.918 118.918 118.858 0.060 25691
1427 1 15 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.196 -0.049 25691
1428 1 15 . 1 1 49 49 ILE N N 49 118.074 118.074 120.197 -2.123 25691
1429 1 15 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.010 -0.047 25691
1430 1 15 . 1 1 50 50 SER N N 50 118.567 118.567 120.352 -1.785 25691
1431 1 15 . 1 1 50 50 SER HA H 50 4.677 4.677 4.781 -0.104 25691
1432 1 15 . 1 1 51 51 LEU N N 51 121.924 121.924 121.447 0.477 25691
1433 1 15 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.479 -0.143 25691
1434 1 15 . 1 1 52 52 LYS N N 52 131.859 131.859 126.067 5.792 25691
1435 1 15 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.427 -0.112 25691
1436 1 15 . 1 1 53 53 HIS N N 53 107.367 107.367 117.794 -10.427 25691
1437 1 15 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.973 -0.093 25691
1438 1 15 . 1 1 55 55 GLY N N 55 114.104 114.104 113.423 0.681 25691
1439 1 15 . 1 1 56 56 LYS N N 56 113.793 113.793 117.970 -4.177 25691
1440 1 15 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.184 -0.206 25691
1441 1 16 . 1 1 2 2 GLY N N 2 109.255 109.255 107.866 1.389 25691
1442 1 16 . 1 1 3 3 GLY N N 3 108.760 108.760 109.908 -1.148 25691
1443 1 16 . 1 1 4 4 GLN N N 4 119.481 119.481 121.469 -1.988 25691
1444 1 16 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.323 0.073 25691
1445 1 16 . 1 1 5 5 VAL N N 5 121.615 121.615 125.790 -4.175 25691
1446 1 16 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.306 -0.181 25691
1447 1 16 . 1 1 6 6 ASP N N 6 125.372 125.372 125.683 -0.311 25691
1448 1 16 . 1 1 7 7 CYS N N 7 123.728 123.728 122.549 1.179 25691
1449 1 16 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.713 0.313 25691
1450 1 16 . 1 1 8 8 GLY N N 8 111.717 111.717 110.583 1.134 25691
1451 1 16 . 1 1 9 9 GLU N N 9 119.502 119.502 119.411 0.091 25691
1452 1 16 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.109 -0.068 25691
1453 1 16 . 1 1 10 10 PHE N N 10 116.513 116.513 117.094 -0.581 25691
1454 1 16 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.177 0.605 25691
1455 1 16 . 1 1 11 11 GLN N N 11 118.042 118.042 115.396 2.646 25691
1456 1 16 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.001 -0.038 25691
1457 1 16 . 1 1 12 12 ASP N N 12 120.313 120.313 112.727 7.586 25691
1458 1 16 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.531 -0.028 25691
1459 1 16 . 1 1 13 13 THR N N 13 118.013 118.013 115.197 2.816 25691
1460 1 16 . 1 1 13 13 THR HA H 13 4.090 4.090 3.789 0.301 25691
1461 1 16 . 1 1 14 14 LYS N N 14 119.942 119.942 119.241 0.701 25691
1462 1 16 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.565 -0.404 25691
1463 1 16 . 1 1 15 15 VAL N N 15 120.212 120.212 121.310 -1.098 25691
1464 1 16 . 1 1 15 15 VAL HA H 15 3.888 3.888 4.040 -0.152 25691
1465 1 16 . 1 1 16 16 TYR N N 16 126.887 126.887 120.222 6.665 25691
1466 1 16 . 1 1 16 16 TYR HA H 16 4.683 4.683 5.055 -0.372 25691
1467 1 16 . 1 1 17 17 CYS N N 17 120.474 120.474 118.835 1.639 25691
1468 1 16 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.724 0.224 25691
1469 1 16 . 1 1 18 18 THR N N 18 113.766 113.766 112.547 1.219 25691
1470 1 16 . 1 1 18 18 THR HA H 18 4.656 4.656 4.614 0.042 25691
1471 1 16 . 1 1 19 19 ARG N N 19 116.621 116.621 120.638 -4.017 25691
1472 1 16 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.420 -0.106 25691
1473 1 16 . 1 1 20 20 GLU N N 20 121.887 121.887 123.101 -1.214 25691
1474 1 16 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.341 -0.230 25691
1475 1 16 . 1 1 21 21 SER N N 21 118.596 118.596 119.000 -0.404 25691
1476 1 16 . 1 1 21 21 SER HA H 21 3.858 3.858 4.454 -0.596 25691
1477 1 16 . 1 1 22 22 ASN N N 22 122.807 122.807 124.390 -1.583 25691
1478 1 16 . 1 1 22 22 ASN HA H 22 5.019 5.019 5.171 -0.152 25691
1479 1 16 . 1 1 24 24 HIS N N 24 121.461 121.461 121.016 0.445 25691
1480 1 16 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.062 -0.933 25691
1481 1 16 . 1 1 25 25 CYS N N 25 122.306 122.306 126.298 -3.992 25691
1482 1 16 . 1 1 25 25 CYS HA H 25 5.096 5.096 4.986 0.110 25691
1483 1 16 . 1 1 26 26 GLY N N 26 116.561 116.561 114.953 1.608 25691
1484 1 16 . 1 1 27 27 SER N N 27 116.705 116.705 116.319 0.386 25691
1485 1 16 . 1 1 27 27 SER HA H 27 3.999 3.999 4.299 -0.300 25691
1486 1 16 . 1 1 28 28 ASP N N 28 121.184 121.184 119.194 1.990 25691
1487 1 16 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.703 -0.226 25691
1488 1 16 . 1 1 29 29 GLY N N 29 109.717 109.717 107.630 2.087 25691
1489 1 16 . 1 1 30 30 GLN N N 30 119.919 119.919 120.156 -0.237 25691
1490 1 16 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.328 -0.034 25691
1491 1 16 . 1 1 31 31 THR N N 31 120.852 120.852 119.257 1.595 25691
1492 1 16 . 1 1 31 31 THR HA H 31 4.612 4.612 5.343 -0.731 25691
1493 1 16 . 1 1 32 32 TYR N N 32 129.107 129.107 125.983 3.124 25691
1494 1 16 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.730 -0.245 25691
1495 1 16 . 1 1 33 33 GLY N N 33 109.097 109.097 109.756 -0.659 25691
1496 1 16 . 1 1 34 34 ASN N N 34 109.942 109.942 112.974 -3.032 25691
1497 1 16 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.206 -0.142 25691
1498 1 16 . 1 1 35 35 LYS N N 35 119.128 119.128 119.728 -0.600 25691
1499 1 16 . 1 1 35 35 LYS HA H 35 3.029 3.029 3.850 -0.821 25691
1500 1 16 . 1 1 36 36 CYS N N 36 119.799 119.799 117.307 2.492 25691
1501 1 16 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.163 -1.594 25691
1502 1 16 . 1 1 37 37 ALA N N 37 122.356 122.356 122.015 0.341 25691
1503 1 16 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.118 -0.239 25691
1504 1 16 . 1 1 38 38 PHE N N 38 119.315 119.315 117.443 1.872 25691
1505 1 16 . 1 1 38 38 PHE HA H 38 3.588 3.588 3.936 -0.348 25691
1506 1 16 . 1 1 39 39 CYS N N 39 117.511 117.511 119.557 -2.046 25691
1507 1 16 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.696 0.290 25691
1508 1 16 . 1 1 40 40 LYS N N 40 119.465 119.465 119.768 -0.303 25691
1509 1 16 . 1 1 40 40 LYS HA H 40 3.854 3.854 3.945 -0.091 25691
1510 1 16 . 1 1 41 41 ALA N N 41 123.083 123.083 120.231 2.852 25691
1511 1 16 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.087 -0.035 25691
1512 1 16 . 1 1 42 42 ILE N N 42 120.832 120.832 117.893 2.939 25691
1513 1 16 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.535 -0.325 25691
1514 1 16 . 1 1 43 43 VAL N N 43 121.341 121.341 120.196 1.145 25691
1515 1 16 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.408 0.282 25691
1516 1 16 . 1 1 44 44 LYS N N 44 122.202 122.202 119.120 3.082 25691
1517 1 16 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.036 0.038 25691
1518 1 16 . 1 1 45 45 SER N N 45 111.517 111.517 114.441 -2.924 25691
1519 1 16 . 1 1 45 45 SER HA H 45 4.475 4.475 4.693 -0.218 25691
1520 1 16 . 1 1 46 46 GLY N N 46 112.139 112.139 109.537 2.602 25691
1521 1 16 . 1 1 47 47 GLY N N 47 105.513 105.513 106.468 -0.955 25691
1522 1 16 . 1 1 48 48 LYS N N 48 118.918 118.918 119.425 -0.507 25691
1523 1 16 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.250 -0.103 25691
1524 1 16 . 1 1 49 49 ILE N N 49 118.074 118.074 120.726 -2.652 25691
1525 1 16 . 1 1 49 49 ILE HA H 49 3.963 3.963 3.941 0.022 25691
1526 1 16 . 1 1 50 50 SER N N 50 118.567 118.567 118.228 0.339 25691
1527 1 16 . 1 1 50 50 SER HA H 50 4.677 4.677 4.760 -0.083 25691
1528 1 16 . 1 1 51 51 LEU N N 51 121.924 121.924 120.839 1.085 25691
1529 1 16 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.559 -0.223 25691
1530 1 16 . 1 1 52 52 LYS N N 52 131.859 131.859 125.071 6.788 25691
1531 1 16 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.349 -0.034 25691
1532 1 16 . 1 1 53 53 HIS N N 53 107.367 107.367 118.309 -10.942 25691
1533 1 16 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.914 -0.034 25691
1534 1 16 . 1 1 55 55 GLY N N 55 114.104 114.104 112.996 1.108 25691
1535 1 16 . 1 1 56 56 LYS N N 56 113.793 113.793 119.972 -6.179 25691
1536 1 16 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.186 -0.208 25691
1537 1 17 . 1 1 2 2 GLY N N 2 109.255 109.255 111.794 -2.539 25691
1538 1 17 . 1 1 3 3 GLY N N 3 108.760 108.760 106.176 2.584 25691
1539 1 17 . 1 1 4 4 GLN N N 4 119.481 119.481 118.070 1.411 25691
1540 1 17 . 1 1 4 4 GLN HA H 4 4.396 4.396 3.174 1.222 25691
1541 1 17 . 1 1 5 5 VAL N N 5 121.615 121.615 120.979 0.636 25691
1542 1 17 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.282 -0.157 25691
1543 1 17 . 1 1 6 6 ASP N N 6 125.372 125.372 124.293 1.079 25691
1544 1 17 . 1 1 7 7 CYS N N 7 123.728 123.728 121.788 1.940 25691
1545 1 17 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.022 1.004 25691
1546 1 17 . 1 1 8 8 GLY N N 8 111.717 111.717 112.620 -0.903 25691
1547 1 17 . 1 1 9 9 GLU N N 9 119.502 119.502 122.925 -3.423 25691
1548 1 17 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.336 -0.295 25691
1549 1 17 . 1 1 10 10 PHE N N 10 116.513 116.513 114.921 1.592 25691
1550 1 17 . 1 1 10 10 PHE HA H 10 4.782 4.782 3.943 0.839 25691
1551 1 17 . 1 1 11 11 GLN N N 11 118.042 118.042 114.724 3.318 25691
1552 1 17 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.495 -0.532 25691
1553 1 17 . 1 1 12 12 ASP N N 12 120.313 120.313 120.798 -0.485 25691
1554 1 17 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.577 -0.074 25691
1555 1 17 . 1 1 13 13 THR N N 13 118.013 118.013 111.870 6.143 25691
1556 1 17 . 1 1 13 13 THR HA H 13 4.090 4.090 4.467 -0.377 25691
1557 1 17 . 1 1 14 14 LYS N N 14 119.942 119.942 122.123 -2.181 25691
1558 1 17 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.138 0.023 25691
1559 1 17 . 1 1 15 15 VAL N N 15 120.212 120.212 120.506 -0.294 25691
1560 1 17 . 1 1 15 15 VAL HA H 15 3.888 3.888 3.791 0.097 25691
1561 1 17 . 1 1 16 16 TYR N N 16 126.887 126.887 125.720 1.167 25691
1562 1 17 . 1 1 16 16 TYR HA H 16 4.683 4.683 4.647 0.036 25691
1563 1 17 . 1 1 17 17 CYS N N 17 120.474 120.474 118.931 1.543 25691
1564 1 17 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.756 0.192 25691
1565 1 17 . 1 1 18 18 THR N N 18 113.766 113.766 112.769 0.997 25691
1566 1 17 . 1 1 18 18 THR HA H 18 4.656 4.656 4.274 0.382 25691
1567 1 17 . 1 1 19 19 ARG N N 19 116.621 116.621 118.215 -1.594 25691
1568 1 17 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.354 -0.040 25691
1569 1 17 . 1 1 20 20 GLU N N 20 121.887 121.887 120.533 1.354 25691
1570 1 17 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.487 -0.376 25691
1571 1 17 . 1 1 21 21 SER N N 21 118.596 118.596 117.439 1.157 25691
1572 1 17 . 1 1 21 21 SER HA H 21 3.858 3.858 4.560 -0.702 25691
1573 1 17 . 1 1 22 22 ASN N N 22 122.807 122.807 122.681 0.126 25691
1574 1 17 . 1 1 22 22 ASN HA H 22 5.019 5.019 4.745 0.274 25691
1575 1 17 . 1 1 24 24 HIS N N 24 121.461 121.461 119.462 1.999 25691
1576 1 17 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.055 -0.926 25691
1577 1 17 . 1 1 25 25 CYS N N 25 122.306 122.306 125.419 -3.113 25691
1578 1 17 . 1 1 25 25 CYS HA H 25 5.096 5.096 4.962 0.134 25691
1579 1 17 . 1 1 26 26 GLY N N 26 116.561 116.561 115.113 1.448 25691
1580 1 17 . 1 1 27 27 SER N N 27 116.705 116.705 116.179 0.526 25691
1581 1 17 . 1 1 27 27 SER HA H 27 3.999 3.999 4.423 -0.424 25691
1582 1 17 . 1 1 28 28 ASP N N 28 121.184 121.184 120.017 1.167 25691
1583 1 17 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.614 -0.137 25691
1584 1 17 . 1 1 29 29 GLY N N 29 109.717 109.717 108.166 1.551 25691
1585 1 17 . 1 1 30 30 GLN N N 30 119.919 119.919 121.167 -1.248 25691
1586 1 17 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.396 -0.102 25691
1587 1 17 . 1 1 31 31 THR N N 31 120.852 120.852 117.520 3.332 25691
1588 1 17 . 1 1 31 31 THR HA H 31 4.612 4.612 5.010 -0.398 25691
1589 1 17 . 1 1 32 32 TYR N N 32 129.107 129.107 126.074 3.033 25691
1590 1 17 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.738 -0.253 25691
1591 1 17 . 1 1 33 33 GLY N N 33 109.097 109.097 110.047 -0.950 25691
1592 1 17 . 1 1 34 34 ASN N N 34 109.942 109.942 113.051 -3.109 25691
1593 1 17 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.081 -0.017 25691
1594 1 17 . 1 1 35 35 LYS N N 35 119.128 119.128 120.338 -1.210 25691
1595 1 17 . 1 1 35 35 LYS HA H 35 3.029 3.029 4.486 -1.457 25691
1596 1 17 . 1 1 36 36 CYS N N 36 119.799 119.799 116.723 3.076 25691
1597 1 17 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.258 -1.689 25691
1598 1 17 . 1 1 37 37 ALA N N 37 122.356 122.356 122.905 -0.549 25691
1599 1 17 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.208 -0.329 25691
1600 1 17 . 1 1 38 38 PHE N N 38 119.315 119.315 117.061 2.254 25691
1601 1 17 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.058 -0.470 25691
1602 1 17 . 1 1 39 39 CYS N N 39 117.511 117.511 118.610 -1.099 25691
1603 1 17 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.720 0.266 25691
1604 1 17 . 1 1 40 40 LYS N N 40 119.465 119.465 120.339 -0.874 25691
1605 1 17 . 1 1 40 40 LYS HA H 40 3.854 3.854 3.864 -0.010 25691
1606 1 17 . 1 1 41 41 ALA N N 41 123.083 123.083 121.809 1.274 25691
1607 1 17 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.005 0.047 25691
1608 1 17 . 1 1 42 42 ILE N N 42 120.832 120.832 119.004 1.828 25691
1609 1 17 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.439 -0.229 25691
1610 1 17 . 1 1 43 43 VAL N N 43 121.341 121.341 120.808 0.533 25691
1611 1 17 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.761 -0.071 25691
1612 1 17 . 1 1 44 44 LYS N N 44 122.202 122.202 118.161 4.041 25691
1613 1 17 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.146 -0.072 25691
1614 1 17 . 1 1 45 45 SER N N 45 111.517 111.517 113.043 -1.526 25691
1615 1 17 . 1 1 45 45 SER HA H 45 4.475 4.475 4.336 0.139 25691
1616 1 17 . 1 1 46 46 GLY N N 46 112.139 112.139 105.883 6.256 25691
1617 1 17 . 1 1 47 47 GLY N N 47 105.513 105.513 108.056 -2.543 25691
1618 1 17 . 1 1 48 48 LYS N N 48 118.918 118.918 119.606 -0.688 25691
1619 1 17 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.096 0.051 25691
1620 1 17 . 1 1 49 49 ILE N N 49 118.074 118.074 119.739 -1.665 25691
1621 1 17 . 1 1 49 49 ILE HA H 49 3.963 3.963 3.971 -0.008 25691
1622 1 17 . 1 1 50 50 SER N N 50 118.567 118.567 118.675 -0.108 25691
1623 1 17 . 1 1 50 50 SER HA H 50 4.677 4.677 4.755 -0.078 25691
1624 1 17 . 1 1 51 51 LEU N N 51 121.924 121.924 122.294 -0.370 25691
1625 1 17 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.323 0.013 25691
1626 1 17 . 1 1 52 52 LYS N N 52 131.859 131.859 124.810 7.049 25691
1627 1 17 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.057 0.258 25691
1628 1 17 . 1 1 53 53 HIS N N 53 107.367 107.367 115.870 -8.503 25691
1629 1 17 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.933 -0.053 25691
1630 1 17 . 1 1 55 55 GLY N N 55 114.104 114.104 112.731 1.373 25691
1631 1 17 . 1 1 56 56 LYS N N 56 113.793 113.793 119.707 -5.914 25691
1632 1 17 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.040 -0.062 25691
1633 1 18 . 1 1 2 2 GLY N N 2 109.255 109.255 113.393 -4.138 25691
1634 1 18 . 1 1 3 3 GLY N N 3 108.760 108.760 109.339 -0.579 25691
1635 1 18 . 1 1 4 4 GLN N N 4 119.481 119.481 119.279 0.202 25691
1636 1 18 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.345 0.051 25691
1637 1 18 . 1 1 5 5 VAL N N 5 121.615 121.615 122.805 -1.190 25691
1638 1 18 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.351 -0.227 25691
1639 1 18 . 1 1 6 6 ASP N N 6 125.372 125.372 124.671 0.701 25691
1640 1 18 . 1 1 7 7 CYS N N 7 123.728 123.728 125.188 -1.460 25691
1641 1 18 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.746 0.280 25691
1642 1 18 . 1 1 8 8 GLY N N 8 111.717 111.717 110.400 1.317 25691
1643 1 18 . 1 1 9 9 GLU N N 9 119.502 119.502 119.433 0.069 25691
1644 1 18 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.151 -0.110 25691
1645 1 18 . 1 1 10 10 PHE N N 10 116.513 116.513 117.136 -0.623 25691
1646 1 18 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.120 0.662 25691
1647 1 18 . 1 1 11 11 GLN N N 11 118.042 118.042 116.153 1.889 25691
1648 1 18 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.101 -0.138 25691
1649 1 18 . 1 1 12 12 ASP N N 12 120.313 120.313 115.242 5.071 25691
1650 1 18 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.574 -0.071 25691
1651 1 18 . 1 1 13 13 THR N N 13 118.013 118.013 118.447 -0.434 25691
1652 1 18 . 1 1 13 13 THR HA H 13 4.090 4.090 2.997 1.093 25691
1653 1 18 . 1 1 14 14 LYS N N 14 119.942 119.942 120.357 -0.415 25691
1654 1 18 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.412 -0.251 25691
1655 1 18 . 1 1 15 15 VAL N N 15 120.212 120.212 123.416 -3.204 25691
1656 1 18 . 1 1 15 15 VAL HA H 15 3.888 3.888 4.080 -0.192 25691
1657 1 18 . 1 1 16 16 TYR N N 16 126.887 126.887 123.235 3.652 25691
1658 1 18 . 1 1 16 16 TYR HA H 16 4.683 4.683 4.902 -0.219 25691
1659 1 18 . 1 1 17 17 CYS N N 17 120.474 120.474 119.252 1.222 25691
1660 1 18 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.613 0.335 25691
1661 1 18 . 1 1 18 18 THR N N 18 113.766 113.766 113.174 0.592 25691
1662 1 18 . 1 1 18 18 THR HA H 18 4.656 4.656 4.670 -0.014 25691
1663 1 18 . 1 1 19 19 ARG N N 19 116.621 116.621 120.367 -3.746 25691
1664 1 18 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.452 -0.138 25691
1665 1 18 . 1 1 20 20 GLU N N 20 121.887 121.887 122.261 -0.374 25691
1666 1 18 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.517 -0.406 25691
1667 1 18 . 1 1 21 21 SER N N 21 118.596 118.596 119.302 -0.706 25691
1668 1 18 . 1 1 21 21 SER HA H 21 3.858 3.858 4.110 -0.252 25691
1669 1 18 . 1 1 22 22 ASN N N 22 122.807 122.807 120.600 2.207 25691
1670 1 18 . 1 1 22 22 ASN HA H 22 5.019 5.019 5.116 -0.097 25691
1671 1 18 . 1 1 24 24 HIS N N 24 121.461 121.461 119.071 2.390 25691
1672 1 18 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.060 -0.931 25691
1673 1 18 . 1 1 25 25 CYS N N 25 122.306 122.306 125.898 -3.592 25691
1674 1 18 . 1 1 25 25 CYS HA H 25 5.096 5.096 5.174 -0.078 25691
1675 1 18 . 1 1 26 26 GLY N N 26 116.561 116.561 113.882 2.679 25691
1676 1 18 . 1 1 27 27 SER N N 27 116.705 116.705 116.938 -0.233 25691
1677 1 18 . 1 1 27 27 SER HA H 27 3.999 3.999 4.309 -0.310 25691
1678 1 18 . 1 1 28 28 ASP N N 28 121.184 121.184 120.351 0.833 25691
1679 1 18 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.580 -0.103 25691
1680 1 18 . 1 1 29 29 GLY N N 29 109.717 109.717 108.073 1.644 25691
1681 1 18 . 1 1 30 30 GLN N N 30 119.919 119.919 120.180 -0.261 25691
1682 1 18 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.388 -0.094 25691
1683 1 18 . 1 1 31 31 THR N N 31 120.852 120.852 116.827 4.025 25691
1684 1 18 . 1 1 31 31 THR HA H 31 4.612 4.612 4.917 -0.305 25691
1685 1 18 . 1 1 32 32 TYR N N 32 129.107 129.107 125.655 3.452 25691
1686 1 18 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.727 -0.242 25691
1687 1 18 . 1 1 33 33 GLY N N 33 109.097 109.097 110.447 -1.350 25691
1688 1 18 . 1 1 34 34 ASN N N 34 109.942 109.942 113.454 -3.512 25691
1689 1 18 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.203 -0.139 25691
1690 1 18 . 1 1 35 35 LYS N N 35 119.128 119.128 119.953 -0.825 25691
1691 1 18 . 1 1 35 35 LYS HA H 35 3.029 3.029 3.776 -0.747 25691
1692 1 18 . 1 1 36 36 CYS N N 36 119.799 119.799 118.174 1.625 25691
1693 1 18 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.090 -1.521 25691
1694 1 18 . 1 1 37 37 ALA N N 37 122.356 122.356 122.792 -0.436 25691
1695 1 18 . 1 1 37 37 ALA HA H 37 3.879 3.879 3.987 -0.108 25691
1696 1 18 . 1 1 38 38 PHE N N 38 119.315 119.315 115.010 4.305 25691
1697 1 18 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.291 -0.703 25691
1698 1 18 . 1 1 39 39 CYS N N 39 117.511 117.511 120.579 -3.068 25691
1699 1 18 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.752 0.234 25691
1700 1 18 . 1 1 40 40 LYS N N 40 119.465 119.465 120.109 -0.644 25691
1701 1 18 . 1 1 40 40 LYS HA H 40 3.854 3.854 4.067 -0.213 25691
1702 1 18 . 1 1 41 41 ALA N N 41 123.083 123.083 120.978 2.105 25691
1703 1 18 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.134 -0.082 25691
1704 1 18 . 1 1 42 42 ILE N N 42 120.832 120.832 119.870 0.962 25691
1705 1 18 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.393 -0.183 25691
1706 1 18 . 1 1 43 43 VAL N N 43 121.341 121.341 118.700 2.641 25691
1707 1 18 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.454 0.236 25691
1708 1 18 . 1 1 44 44 LYS N N 44 122.202 122.202 119.029 3.173 25691
1709 1 18 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.178 -0.104 25691
1710 1 18 . 1 1 45 45 SER N N 45 111.517 111.517 112.169 -0.652 25691
1711 1 18 . 1 1 45 45 SER HA H 45 4.475 4.475 4.672 -0.197 25691
1712 1 18 . 1 1 46 46 GLY N N 46 112.139 112.139 108.090 4.049 25691
1713 1 18 . 1 1 47 47 GLY N N 47 105.513 105.513 106.159 -0.646 25691
1714 1 18 . 1 1 48 48 LYS N N 48 118.918 118.918 119.823 -0.905 25691
1715 1 18 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.289 -0.142 25691
1716 1 18 . 1 1 49 49 ILE N N 49 118.074 118.074 120.583 -2.509 25691
1717 1 18 . 1 1 49 49 ILE HA H 49 3.963 3.963 3.942 0.021 25691
1718 1 18 . 1 1 50 50 SER N N 50 118.567 118.567 118.101 0.466 25691
1719 1 18 . 1 1 50 50 SER HA H 50 4.677 4.677 4.785 -0.108 25691
1720 1 18 . 1 1 51 51 LEU N N 51 121.924 121.924 121.933 -0.009 25691
1721 1 18 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.496 -0.160 25691
1722 1 18 . 1 1 52 52 LYS N N 52 131.859 131.859 125.760 6.099 25691
1723 1 18 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.257 0.058 25691
1724 1 18 . 1 1 53 53 HIS N N 53 107.367 107.367 117.177 -9.810 25691
1725 1 18 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.897 -0.017 25691
1726 1 18 . 1 1 55 55 GLY N N 55 114.104 114.104 113.062 1.042 25691
1727 1 18 . 1 1 56 56 LYS N N 56 113.793 113.793 118.755 -4.962 25691
1728 1 18 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.356 -0.378 25691
1729 1 19 . 1 1 2 2 GLY N N 2 109.255 109.255 113.381 -4.126 25691
1730 1 19 . 1 1 3 3 GLY N N 3 108.760 108.760 112.497 -3.737 25691
1731 1 19 . 1 1 4 4 GLN N N 4 119.481 119.481 123.849 -4.368 25691
1732 1 19 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.453 -0.057 25691
1733 1 19 . 1 1 5 5 VAL N N 5 121.615 121.615 126.599 -4.984 25691
1734 1 19 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.239 -0.114 25691
1735 1 19 . 1 1 6 6 ASP N N 6 125.372 125.372 120.210 5.162 25691
1736 1 19 . 1 1 7 7 CYS N N 7 123.728 123.728 117.156 6.572 25691
1737 1 19 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.249 0.777 25691
1738 1 19 . 1 1 8 8 GLY N N 8 111.717 111.717 110.311 1.406 25691
1739 1 19 . 1 1 9 9 GLU N N 9 119.502 119.502 120.838 -1.336 25691
1740 1 19 . 1 1 9 9 GLU HA H 9 4.041 4.041 3.991 0.050 25691
1741 1 19 . 1 1 10 10 PHE N N 10 116.513 116.513 118.197 -1.684 25691
1742 1 19 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.819 -0.037 25691
1743 1 19 . 1 1 11 11 GLN N N 11 118.042 118.042 120.568 -2.526 25691
1744 1 19 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.064 -0.101 25691
1745 1 19 . 1 1 12 12 ASP N N 12 120.313 120.313 118.003 2.310 25691
1746 1 19 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.613 -0.110 25691
1747 1 19 . 1 1 13 13 THR N N 13 118.013 118.013 111.140 6.873 25691
1748 1 19 . 1 1 13 13 THR HA H 13 4.090 4.090 4.352 -0.262 25691
1749 1 19 . 1 1 14 14 LYS N N 14 119.942 119.942 123.033 -3.091 25691
1750 1 19 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.315 -0.154 25691
1751 1 19 . 1 1 15 15 VAL N N 15 120.212 120.212 120.529 -0.317 25691
1752 1 19 . 1 1 15 15 VAL HA H 15 3.888 3.888 4.110 -0.222 25691
1753 1 19 . 1 1 16 16 TYR N N 16 126.887 126.887 120.515 6.372 25691
1754 1 19 . 1 1 16 16 TYR HA H 16 4.683 4.683 5.034 -0.351 25691
1755 1 19 . 1 1 17 17 CYS N N 17 120.474 120.474 117.433 3.041 25691
1756 1 19 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.726 0.222 25691
1757 1 19 . 1 1 18 18 THR N N 18 113.766 113.766 114.353 -0.587 25691
1758 1 19 . 1 1 18 18 THR HA H 18 4.656 4.656 4.397 0.259 25691
1759 1 19 . 1 1 19 19 ARG N N 19 116.621 116.621 118.979 -2.358 25691
1760 1 19 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.341 -0.027 25691
1761 1 19 . 1 1 20 20 GLU N N 20 121.887 121.887 122.304 -0.417 25691
1762 1 19 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.307 -0.196 25691
1763 1 19 . 1 1 21 21 SER N N 21 118.596 118.596 118.058 0.538 25691
1764 1 19 . 1 1 21 21 SER HA H 21 3.858 3.858 4.388 -0.530 25691
1765 1 19 . 1 1 22 22 ASN N N 22 122.807 122.807 121.708 1.099 25691
1766 1 19 . 1 1 22 22 ASN HA H 22 5.019 5.019 4.934 0.085 25691
1767 1 19 . 1 1 24 24 HIS N N 24 121.461 121.461 118.805 2.656 25691
1768 1 19 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.281 -1.152 25691
1769 1 19 . 1 1 25 25 CYS N N 25 122.306 122.306 125.535 -3.229 25691
1770 1 19 . 1 1 25 25 CYS HA H 25 5.096 5.096 5.148 -0.052 25691
1771 1 19 . 1 1 26 26 GLY N N 26 116.561 116.561 114.961 1.600 25691
1772 1 19 . 1 1 27 27 SER N N 27 116.705 116.705 115.754 0.951 25691
1773 1 19 . 1 1 27 27 SER HA H 27 3.999 3.999 4.139 -0.140 25691
1774 1 19 . 1 1 28 28 ASP N N 28 121.184 121.184 121.190 -0.006 25691
1775 1 19 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.484 -0.007 25691
1776 1 19 . 1 1 29 29 GLY N N 29 109.717 109.717 107.366 2.351 25691
1777 1 19 . 1 1 30 30 GLN N N 30 119.919 119.919 120.741 -0.822 25691
1778 1 19 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.156 0.138 25691
1779 1 19 . 1 1 31 31 THR N N 31 120.852 120.852 118.373 2.479 25691
1780 1 19 . 1 1 31 31 THR HA H 31 4.612 4.612 5.305 -0.693 25691
1781 1 19 . 1 1 32 32 TYR N N 32 129.107 129.107 125.201 3.906 25691
1782 1 19 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.740 -0.255 25691
1783 1 19 . 1 1 33 33 GLY N N 33 109.097 109.097 107.927 1.170 25691
1784 1 19 . 1 1 34 34 ASN N N 34 109.942 109.942 111.931 -1.989 25691
1785 1 19 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.036 0.028 25691
1786 1 19 . 1 1 35 35 LYS N N 35 119.128 119.128 120.017 -0.889 25691
1787 1 19 . 1 1 35 35 LYS HA H 35 3.029 3.029 3.758 -0.729 25691
1788 1 19 . 1 1 36 36 CYS N N 36 119.799 119.799 116.708 3.091 25691
1789 1 19 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.015 -1.446 25691
1790 1 19 . 1 1 37 37 ALA N N 37 122.356 122.356 124.335 -1.979 25691
1791 1 19 . 1 1 37 37 ALA HA H 37 3.879 3.879 3.963 -0.084 25691
1792 1 19 . 1 1 38 38 PHE N N 38 119.315 119.315 115.973 3.342 25691
1793 1 19 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.436 -0.848 25691
1794 1 19 . 1 1 39 39 CYS N N 39 117.511 117.511 118.806 -1.295 25691
1795 1 19 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.949 0.037 25691
1796 1 19 . 1 1 40 40 LYS N N 40 119.465 119.465 121.859 -2.394 25691
1797 1 19 . 1 1 40 40 LYS HA H 40 3.854 3.854 3.959 -0.105 25691
1798 1 19 . 1 1 41 41 ALA N N 41 123.083 123.083 121.293 1.790 25691
1799 1 19 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.055 -0.003 25691
1800 1 19 . 1 1 42 42 ILE N N 42 120.832 120.832 119.050 1.782 25691
1801 1 19 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.416 -0.206 25691
1802 1 19 . 1 1 43 43 VAL N N 43 121.341 121.341 120.430 0.911 25691
1803 1 19 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.474 0.216 25691
1804 1 19 . 1 1 44 44 LYS N N 44 122.202 122.202 116.298 5.904 25691
1805 1 19 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.206 -0.132 25691
1806 1 19 . 1 1 45 45 SER N N 45 111.517 111.517 112.378 -0.861 25691
1807 1 19 . 1 1 45 45 SER HA H 45 4.475 4.475 4.506 -0.031 25691
1808 1 19 . 1 1 46 46 GLY N N 46 112.139 112.139 107.433 4.706 25691
1809 1 19 . 1 1 47 47 GLY N N 47 105.513 105.513 107.835 -2.322 25691
1810 1 19 . 1 1 48 48 LYS N N 48 118.918 118.918 119.465 -0.547 25691
1811 1 19 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.190 -0.043 25691
1812 1 19 . 1 1 49 49 ILE N N 49 118.074 118.074 120.005 -1.931 25691
1813 1 19 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.077 -0.114 25691
1814 1 19 . 1 1 50 50 SER N N 50 118.567 118.567 119.848 -1.281 25691
1815 1 19 . 1 1 50 50 SER HA H 50 4.677 4.677 4.882 -0.205 25691
1816 1 19 . 1 1 51 51 LEU N N 51 121.924 121.924 122.270 -0.346 25691
1817 1 19 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.458 -0.122 25691
1818 1 19 . 1 1 52 52 LYS N N 52 131.859 131.859 126.385 5.474 25691
1819 1 19 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.242 0.073 25691
1820 1 19 . 1 1 53 53 HIS N N 53 107.367 107.367 116.571 -9.204 25691
1821 1 19 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.905 -0.025 25691
1822 1 19 . 1 1 55 55 GLY N N 55 114.104 114.104 112.953 1.151 25691
1823 1 19 . 1 1 56 56 LYS N N 56 113.793 113.793 117.991 -4.198 25691
1824 1 19 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.328 -0.350 25691
1825 1 20 . 1 1 2 2 GLY N N 2 109.255 109.255 108.963 0.292 25691
1826 1 20 . 1 1 3 3 GLY N N 3 108.760 108.760 110.592 -1.832 25691
1827 1 20 . 1 1 4 4 GLN N N 4 119.481 119.481 124.493 -5.012 25691
1828 1 20 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.471 -0.075 25691
1829 1 20 . 1 1 5 5 VAL N N 5 121.615 121.615 119.011 2.604 25691
1830 1 20 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.221 -0.096 25691
1831 1 20 . 1 1 6 6 ASP N N 6 125.372 125.372 119.663 5.709 25691
1832 1 20 . 1 1 7 7 CYS N N 7 123.728 123.728 120.639 3.089 25691
1833 1 20 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.423 0.603 25691
1834 1 20 . 1 1 8 8 GLY N N 8 111.717 111.717 108.041 3.676 25691
1835 1 20 . 1 1 9 9 GLU N N 9 119.502 119.502 122.291 -2.789 25691
1836 1 20 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.032 0.009 25691
1837 1 20 . 1 1 10 10 PHE N N 10 116.513 116.513 117.851 -1.338 25691
1838 1 20 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.780 0.002 25691
1839 1 20 . 1 1 11 11 GLN N N 11 118.042 118.042 119.623 -1.581 25691
1840 1 20 . 1 1 11 11 GLN HA H 11 3.963 3.963 3.961 0.002 25691
1841 1 20 . 1 1 12 12 ASP N N 12 120.313 120.313 118.006 2.307 25691
1842 1 20 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.582 -0.079 25691
1843 1 20 . 1 1 13 13 THR N N 13 118.013 118.013 120.989 -2.976 25691
1844 1 20 . 1 1 13 13 THR HA H 13 4.090 4.090 4.021 0.069 25691
1845 1 20 . 1 1 14 14 LYS N N 14 119.942 119.942 118.690 1.252 25691
1846 1 20 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.237 -0.076 25691
1847 1 20 . 1 1 15 15 VAL N N 15 120.212 120.212 121.054 -0.842 25691
1848 1 20 . 1 1 15 15 VAL HA H 15 3.888 3.888 3.876 0.012 25691
1849 1 20 . 1 1 16 16 TYR N N 16 126.887 126.887 124.189 2.698 25691
1850 1 20 . 1 1 16 16 TYR HA H 16 4.683 4.683 4.811 -0.128 25691
1851 1 20 . 1 1 17 17 CYS N N 17 120.474 120.474 117.160 3.314 25691
1852 1 20 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.723 0.225 25691
1853 1 20 . 1 1 18 18 THR N N 18 113.766 113.766 115.059 -1.293 25691
1854 1 20 . 1 1 18 18 THR HA H 18 4.656 4.656 4.472 0.184 25691
1855 1 20 . 1 1 19 19 ARG N N 19 116.621 116.621 119.062 -2.441 25691
1856 1 20 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.358 -0.044 25691
1857 1 20 . 1 1 20 20 GLU N N 20 121.887 121.887 122.893 -1.006 25691
1858 1 20 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.319 -0.208 25691
1859 1 20 . 1 1 21 21 SER N N 21 118.596 118.596 120.319 -1.723 25691
1860 1 20 . 1 1 21 21 SER HA H 21 3.858 3.858 4.533 -0.675 25691
1861 1 20 . 1 1 22 22 ASN N N 22 122.807 122.807 124.930 -2.123 25691
1862 1 20 . 1 1 22 22 ASN HA H 22 5.019 5.019 5.016 0.003 25691
1863 1 20 . 1 1 24 24 HIS N N 24 121.461 121.461 123.984 -2.523 25691
1864 1 20 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.022 -0.893 25691
1865 1 20 . 1 1 25 25 CYS N N 25 122.306 122.306 124.766 -2.460 25691
1866 1 20 . 1 1 25 25 CYS HA H 25 5.096 5.096 4.587 0.509 25691
1867 1 20 . 1 1 26 26 GLY N N 26 116.561 116.561 115.600 0.961 25691
1868 1 20 . 1 1 27 27 SER N N 27 116.705 116.705 117.511 -0.806 25691
1869 1 20 . 1 1 27 27 SER HA H 27 3.999 3.999 4.236 -0.237 25691
1870 1 20 . 1 1 28 28 ASP N N 28 121.184 121.184 119.509 1.675 25691
1871 1 20 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.658 -0.181 25691
1872 1 20 . 1 1 29 29 GLY N N 29 109.717 109.717 108.222 1.495 25691
1873 1 20 . 1 1 30 30 GLN N N 30 119.919 119.919 121.171 -1.252 25691
1874 1 20 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.212 0.082 25691
1875 1 20 . 1 1 31 31 THR N N 31 120.852 120.852 120.833 0.019 25691
1876 1 20 . 1 1 31 31 THR HA H 31 4.612 4.612 5.065 -0.453 25691
1877 1 20 . 1 1 32 32 TYR N N 32 129.107 129.107 123.865 5.242 25691
1878 1 20 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.855 -0.370 25691
1879 1 20 . 1 1 33 33 GLY N N 33 109.097 109.097 110.620 -1.523 25691
1880 1 20 . 1 1 34 34 ASN N N 34 109.942 109.942 115.067 -5.125 25691
1881 1 20 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.259 -0.195 25691
1882 1 20 . 1 1 35 35 LYS N N 35 119.128 119.128 119.656 -0.528 25691
1883 1 20 . 1 1 35 35 LYS HA H 35 3.029 3.029 4.278 -1.249 25691
1884 1 20 . 1 1 36 36 CYS N N 36 119.799 119.799 118.294 1.505 25691
1885 1 20 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.221 -1.652 25691
1886 1 20 . 1 1 37 37 ALA N N 37 122.356 122.356 122.093 0.263 25691
1887 1 20 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.074 -0.195 25691
1888 1 20 . 1 1 38 38 PHE N N 38 119.315 119.315 114.359 4.956 25691
1889 1 20 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.672 -1.084 25691
1890 1 20 . 1 1 39 39 CYS N N 39 117.511 117.511 119.658 -2.147 25691
1891 1 20 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.982 0.004 25691
1892 1 20 . 1 1 40 40 LYS N N 40 119.465 119.465 122.656 -3.191 25691
1893 1 20 . 1 1 40 40 LYS HA H 40 3.854 3.854 4.016 -0.162 25691
1894 1 20 . 1 1 41 41 ALA N N 41 123.083 123.083 119.299 3.784 25691
1895 1 20 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.014 0.038 25691
1896 1 20 . 1 1 42 42 ILE N N 42 120.832 120.832 120.790 0.042 25691
1897 1 20 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.657 -0.447 25691
1898 1 20 . 1 1 43 43 VAL N N 43 121.341 121.341 120.035 1.306 25691
1899 1 20 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.948 -0.258 25691
1900 1 20 . 1 1 44 44 LYS N N 44 122.202 122.202 118.053 4.149 25691
1901 1 20 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.201 -0.127 25691
1902 1 20 . 1 1 45 45 SER N N 45 111.517 111.517 113.683 -2.166 25691
1903 1 20 . 1 1 45 45 SER HA H 45 4.475 4.475 4.567 -0.092 25691
1904 1 20 . 1 1 46 46 GLY N N 46 112.139 112.139 107.159 4.980 25691
1905 1 20 . 1 1 47 47 GLY N N 47 105.513 105.513 108.475 -2.962 25691
1906 1 20 . 1 1 48 48 LYS N N 48 118.918 118.918 118.305 0.613 25691
1907 1 20 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.127 0.020 25691
1908 1 20 . 1 1 49 49 ILE N N 49 118.074 118.074 121.017 -2.943 25691
1909 1 20 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.134 -0.171 25691
1910 1 20 . 1 1 50 50 SER N N 50 118.567 118.567 121.090 -2.523 25691
1911 1 20 . 1 1 50 50 SER HA H 50 4.677 4.677 4.681 -0.004 25691
1912 1 20 . 1 1 51 51 LEU N N 51 121.924 121.924 121.081 0.843 25691
1913 1 20 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.468 -0.132 25691
1914 1 20 . 1 1 52 52 LYS N N 52 131.859 131.859 125.136 6.723 25691
1915 1 20 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.336 -0.021 25691
1916 1 20 . 1 1 53 53 HIS N N 53 107.367 107.367 118.186 -10.819 25691
1917 1 20 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.885 -0.005 25691
1918 1 20 . 1 1 55 55 GLY N N 55 114.104 114.104 112.370 1.734 25691
1919 1 20 . 1 1 56 56 LYS N N 56 113.793 113.793 119.443 -5.650 25691
1920 1 20 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.113 -0.135 25691
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 53 2.985 -0.536 2.965 25691
2 1 1 "Average Difference" HA 52 0.436 0.051 0.438 25691
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25691
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25691
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25691
6 1 1 "Average Difference" HN 0 0.000 0.000 0.000 25691
7 1 2 "Average Difference" N 53 3.015 -0.315 3.027 25691
8 1 2 "Average Difference" HA 52 0.431 0.047 0.433 25691
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25691
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25691
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25691
12 1 2 "Average Difference" HN 0 0.000 0.000 0.000 25691
13 1 3 "Average Difference" N 53 3.246 -0.212 3.270 25691
14 1 3 "Average Difference" HA 52 0.425 0.068 0.424 25691
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25691
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25691
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25691
18 1 3 "Average Difference" HN 0 0.000 0.000 0.000 25691
19 1 4 "Average Difference" N 53 3.211 -0.451 3.209 25691
20 1 4 "Average Difference" HA 52 0.471 0.093 0.466 25691
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25691
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25691
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25691
24 1 4 "Average Difference" HN 0 0.000 0.000 0.000 25691
25 1 5 "Average Difference" N 53 3.100 -0.954 2.977 25691
26 1 5 "Average Difference" HA 52 0.462 0.078 0.459 25691
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25691
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25691
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25691
30 1 5 "Average Difference" HN 0 0.000 0.000 0.000 25691
31 1 6 "Average Difference" N 53 3.132 -0.323 3.146 25691
32 1 6 "Average Difference" HA 52 0.476 0.105 0.468 25691
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25691
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25691
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25691
36 1 6 "Average Difference" HN 0 0.000 0.000 0.000 25691
37 1 7 "Average Difference" N 53 3.165 -0.333 3.178 25691
38 1 7 "Average Difference" HA 52 0.461 0.028 0.464 25691
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25691
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25691
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25691
42 1 7 "Average Difference" HN 0 0.000 0.000 0.000 25691
43 1 8 "Average Difference" N 53 2.940 -0.230 2.959 25691
44 1 8 "Average Difference" HA 52 0.468 0.111 0.459 25691
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25691
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25691
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25691
48 1 8 "Average Difference" HN 0 0.000 0.000 0.000 25691
49 1 9 "Average Difference" N 53 2.681 0.072 2.706 25691
50 1 9 "Average Difference" HA 52 0.457 0.030 0.460 25691
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25691
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25691
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25691
54 1 9 "Average Difference" HN 0 0.000 0.000 0.000 25691
55 1 10 "Average Difference" N 53 3.096 -0.069 3.125 25691
56 1 10 "Average Difference" HA 52 0.460 0.080 0.457 25691
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25691
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25691
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25691
60 1 10 "Average Difference" HN 0 0.000 0.000 0.000 25691
61 1 11 "Average Difference" N 53 3.329 -0.297 3.347 25691
62 1 11 "Average Difference" HA 52 0.456 0.071 0.455 25691
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25691
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25691
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25691
66 1 11 "Average Difference" HN 0 0.000 0.000 0.000 25691
67 1 12 "Average Difference" N 53 3.011 -0.251 3.030 25691
68 1 12 "Average Difference" HA 52 0.414 0.127 0.398 25691
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25691
70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25691
71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25691
72 1 12 "Average Difference" HN 0 0.000 0.000 0.000 25691
73 1 13 "Average Difference" N 53 3.024 -0.048 3.053 25691
74 1 13 "Average Difference" HA 52 0.440 0.060 0.440 25691
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25691
76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 25691
77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 25691
78 1 13 "Average Difference" HN 0 0.000 0.000 0.000 25691
79 1 14 "Average Difference" N 53 3.129 -0.142 3.155 25691
80 1 14 "Average Difference" HA 52 0.491 0.101 0.486 25691
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25691
82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 25691
83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 25691
84 1 14 "Average Difference" HN 0 0.000 0.000 0.000 25691
85 1 15 "Average Difference" N 53 2.736 -0.271 2.749 25691
86 1 15 "Average Difference" HA 52 0.446 0.082 0.443 25691
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25691
88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 25691
89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 25691
90 1 15 "Average Difference" HN 0 0.000 0.000 0.000 25691
91 1 16 "Average Difference" N 53 3.047 -0.253 3.065 25691
92 1 16 "Average Difference" HA 52 0.414 0.074 0.412 25691
93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25691
94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 25691
95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 25691
96 1 16 "Average Difference" HN 0 0.000 0.000 0.000 25691
97 1 17 "Average Difference" N 53 2.754 -0.394 2.752 25691
98 1 17 "Average Difference" HA 52 0.522 -0.003 0.527 25691
99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25691
100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 25691
101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 25691
102 1 17 "Average Difference" HN 0 0.000 0.000 0.000 25691
103 1 18 "Average Difference" N 53 2.774 -0.153 2.796 25691
104 1 18 "Average Difference" HA 52 0.431 0.043 0.433 25691
105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25691
106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 25691
107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 25691
108 1 18 "Average Difference" HN 0 0.000 0.000 0.000 25691
109 1 19 "Average Difference" N 53 3.291 -0.261 3.312 25691
110 1 19 "Average Difference" HA 52 0.408 0.072 0.405 25691
111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25691
112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 25691
113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 25691
114 1 19 "Average Difference" HN 0 0.000 0.000 0.000 25691
115 1 20 "Average Difference" N 53 3.243 0.120 3.272 25691
116 1 20 "Average Difference" HA 52 0.437 0.093 0.431 25691
117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25691
118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 25691
119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 25691
120 1 20 "Average Difference" HN 0 0.000 0.000 0.000 25691
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 25691
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 GLY N N 2 109.255 109.255 109.947 -0.692 25691
2 1 . 1 1 3 3 GLY N N 3 108.760 108.760 109.892 -1.132 25691
3 1 . 1 1 4 4 GLN N N 4 119.481 119.481 121.654 -2.173 25691
4 1 . 1 1 4 4 GLN HA H 4 4.396 4.396 4.323 0.073 25691
5 1 . 1 1 5 5 VAL N N 5 121.615 121.615 121.884 -0.269 25691
6 1 . 1 1 5 5 VAL HA H 5 4.125 4.125 4.193 -0.068 25691
7 1 . 1 1 6 6 ASP N N 6 125.372 125.372 123.423 1.949 25691
8 1 . 1 1 7 7 CYS N N 7 123.728 123.728 122.069 1.659 25691
9 1 . 1 1 7 7 CYS HA H 7 5.026 5.026 4.397 0.629 25691
10 1 . 1 1 8 8 GLY N N 8 111.717 111.717 110.637 1.080 25691
11 1 . 1 1 9 9 GLU N N 9 119.502 119.502 120.640 -1.138 25691
12 1 . 1 1 9 9 GLU HA H 9 4.041 4.041 4.174 -0.133 25691
13 1 . 1 1 10 10 PHE N N 10 116.513 116.513 117.042 -0.529 25691
14 1 . 1 1 10 10 PHE HA H 10 4.782 4.782 4.303 0.479 25691
15 1 . 1 1 11 11 GLN N N 11 118.042 118.042 117.555 0.487 25691
16 1 . 1 1 11 11 GLN HA H 11 3.963 3.963 4.101 -0.138 25691
17 1 . 1 1 12 12 ASP N N 12 120.313 120.313 116.032 4.281 25691
18 1 . 1 1 12 12 ASP HA H 12 4.503 4.503 4.583 -0.080 25691
19 1 . 1 1 13 13 THR N N 13 118.013 118.013 115.123 2.890 25691
20 1 . 1 1 13 13 THR HA H 13 4.090 4.090 3.853 0.238 25691
21 1 . 1 1 14 14 LYS N N 14 119.942 119.942 120.195 -0.253 25691
22 1 . 1 1 14 14 LYS HA H 14 4.161 4.161 4.390 -0.229 25691
23 1 . 1 1 15 15 VAL N N 15 120.212 120.212 122.169 -1.957 25691
24 1 . 1 1 15 15 VAL HA H 15 3.888 3.888 3.965 -0.077 25691
25 1 . 1 1 16 16 TYR N N 16 126.887 126.887 122.558 4.329 25691
26 1 . 1 1 16 16 TYR HA H 16 4.683 4.683 4.991 -0.308 25691
27 1 . 1 1 17 17 CYS N N 17 120.474 120.474 118.561 1.914 25691
28 1 . 1 1 17 17 CYS HA H 17 4.948 4.948 4.765 0.183 25691
29 1 . 1 1 18 18 THR N N 18 113.766 113.766 113.016 0.750 25691
30 1 . 1 1 18 18 THR HA H 18 4.656 4.656 4.565 0.091 25691
31 1 . 1 1 19 19 ARG N N 19 116.621 116.621 119.614 -2.993 25691
32 1 . 1 1 19 19 ARG HA H 19 4.314 4.314 4.412 -0.098 25691
33 1 . 1 1 20 20 GLU N N 20 121.887 121.887 121.573 0.314 25691
34 1 . 1 1 20 20 GLU HA H 20 4.111 4.111 4.413 -0.302 25691
35 1 . 1 1 21 21 SER N N 21 118.596 118.596 117.553 1.043 25691
36 1 . 1 1 21 21 SER HA H 21 3.858 3.858 4.457 -0.599 25691
37 1 . 1 1 22 22 ASN N N 22 122.807 122.807 123.347 -0.540 25691
38 1 . 1 1 22 22 ASN HA H 22 5.019 5.019 5.005 0.014 25691
39 1 . 1 1 24 24 HIS N N 24 121.461 121.461 120.883 0.578 25691
40 1 . 1 1 24 24 HIS HA H 24 4.129 4.129 5.181 -1.052 25691
41 1 . 1 1 25 25 CYS N N 25 122.306 122.306 125.146 -2.840 25691
42 1 . 1 1 25 25 CYS HA H 25 5.096 5.096 5.026 0.070 25691
43 1 . 1 1 26 26 GLY N N 26 116.561 116.561 115.059 1.502 25691
44 1 . 1 1 27 27 SER N N 27 116.705 116.705 116.905 -0.200 25691
45 1 . 1 1 27 27 SER HA H 27 3.999 3.999 4.230 -0.231 25691
46 1 . 1 1 28 28 ASP N N 28 121.184 121.184 119.763 1.421 25691
47 1 . 1 1 28 28 ASP HA H 28 4.477 4.477 4.581 -0.104 25691
48 1 . 1 1 29 29 GLY N N 29 109.717 109.717 107.862 1.855 25691
49 1 . 1 1 30 30 GLN N N 30 119.919 119.919 120.783 -0.864 25691
50 1 . 1 1 30 30 GLN HA H 30 4.294 4.294 4.275 0.019 25691
51 1 . 1 1 31 31 THR N N 31 120.852 120.852 118.458 2.394 25691
52 1 . 1 1 31 31 THR HA H 31 4.612 4.612 5.142 -0.530 25691
53 1 . 1 1 32 32 TYR N N 32 129.107 129.107 125.433 3.674 25691
54 1 . 1 1 32 32 TYR HA H 32 4.485 4.485 4.722 -0.237 25691
55 1 . 1 1 33 33 GLY N N 33 109.097 109.097 109.489 -0.392 25691
56 1 . 1 1 34 34 ASN N N 34 109.942 109.942 113.073 -3.131 25691
57 1 . 1 1 34 34 ASN HA H 34 5.064 5.064 5.144 -0.080 25691
58 1 . 1 1 35 35 LYS N N 35 119.128 119.128 119.821 -0.693 25691
59 1 . 1 1 35 35 LYS HA H 35 3.029 3.029 4.096 -1.067 25691
60 1 . 1 1 36 36 CYS N N 36 119.799 119.799 117.579 2.220 25691
61 1 . 1 1 36 36 CYS HA H 36 2.569 2.569 4.184 -1.615 25691
62 1 . 1 1 37 37 ALA N N 37 122.356 122.356 122.763 -0.407 25691
63 1 . 1 1 37 37 ALA HA H 37 3.879 3.879 4.061 -0.182 25691
64 1 . 1 1 38 38 PHE N N 38 119.315 119.315 115.742 3.573 25691
65 1 . 1 1 38 38 PHE HA H 38 3.588 3.588 4.226 -0.638 25691
66 1 . 1 1 39 39 CYS N N 39 117.511 117.511 120.392 -2.881 25691
67 1 . 1 1 39 39 CYS HA H 39 3.986 3.986 3.850 0.136 25691
68 1 . 1 1 40 40 LYS N N 40 119.465 119.465 120.087 -0.622 25691
69 1 . 1 1 40 40 LYS HA H 40 3.854 3.854 4.033 -0.179 25691
70 1 . 1 1 41 41 ALA N N 41 123.083 123.083 120.894 2.189 25691
71 1 . 1 1 41 41 ALA HA H 41 4.052 4.052 4.117 -0.065 25691
72 1 . 1 1 42 42 ILE N N 42 120.832 120.832 119.714 1.118 25691
73 1 . 1 1 42 42 ILE HA H 42 3.210 3.210 3.474 -0.264 25691
74 1 . 1 1 43 43 VAL N N 43 121.341 121.341 119.465 1.876 25691
75 1 . 1 1 43 43 VAL HA H 43 3.690 3.690 3.635 0.055 25691
76 1 . 1 1 44 44 LYS N N 44 122.202 122.202 118.412 3.790 25691
77 1 . 1 1 44 44 LYS HA H 44 4.074 4.074 4.148 -0.074 25691
78 1 . 1 1 45 45 SER N N 45 111.517 111.517 112.817 -1.300 25691
79 1 . 1 1 45 45 SER HA H 45 4.475 4.475 4.507 -0.032 25691
80 1 . 1 1 46 46 GLY N N 46 112.139 112.139 107.181 4.958 25691
81 1 . 1 1 47 47 GLY N N 47 105.513 105.513 107.861 -2.348 25691
82 1 . 1 1 48 48 LYS N N 48 118.918 118.918 119.472 -0.554 25691
83 1 . 1 1 48 48 LYS HA H 48 4.147 4.147 4.127 0.020 25691
84 1 . 1 1 49 49 ILE N N 49 118.074 118.074 119.841 -1.767 25691
85 1 . 1 1 49 49 ILE HA H 49 3.963 3.963 4.037 -0.074 25691
86 1 . 1 1 50 50 SER N N 50 118.567 118.567 119.703 -1.136 25691
87 1 . 1 1 50 50 SER HA H 50 4.677 4.677 4.784 -0.107 25691
88 1 . 1 1 51 51 LEU N N 51 121.924 121.924 121.858 0.066 25691
89 1 . 1 1 51 51 LEU HA H 51 4.336 4.336 4.488 -0.152 25691
90 1 . 1 1 52 52 LYS N N 52 131.859 131.859 125.656 6.203 25691
91 1 . 1 1 52 52 LYS HA H 52 4.315 4.315 4.291 0.024 25691
92 1 . 1 1 53 53 HIS N N 53 107.367 107.367 116.914 -9.547 25691
93 1 . 1 1 53 53 HIS HA H 53 4.880 4.880 4.919 -0.039 25691
94 1 . 1 1 55 55 GLY N N 55 114.104 114.104 112.717 1.387 25691
95 1 . 1 1 56 56 LYS N N 56 113.793 113.793 118.882 -5.089 25691
96 1 . 1 1 56 56 LYS HA H 56 3.978 3.978 4.215 -0.237 25691
stop_
save_