data_17932
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 17932
_Entry.PDB_ID 2LJF
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 17932
_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 22 22 LEU N N 717 123.186 123.186 120.714 2.472 17932
2 1 1 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.515 -0.215 17932
3 1 1 . 1 1 22 22 LEU H H 717 8.121 8.121 7.838 0.283 17932
4 1 1 . 1 1 23 23 LEU N N 718 123.575 123.575 115.357 8.218 17932
5 1 1 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.580 -0.230 17932
6 1 1 . 1 1 23 23 LEU H H 718 8.189 8.189 8.281 -0.092 17932
7 1 1 . 1 1 24 24 ILE N N 719 121.952 121.952 114.878 7.074 17932
8 1 1 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.181 0.082 17932
9 1 1 . 1 1 24 24 ILE H H 719 8.079 8.079 8.436 -0.357 17932
10 1 1 . 1 1 25 25 THR N N 720 118.098 118.098 113.166 4.932 17932
11 1 1 . 1 1 25 25 THR HA H 720 4.359 4.359 3.734 0.625 17932
12 1 1 . 1 1 25 25 THR H H 720 8.296 8.296 8.340 -0.044 17932
13 1 1 . 1 1 26 26 ILE N N 721 122.588 122.588 115.339 7.249 17932
14 1 1 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.277 -0.244 17932
15 1 1 . 1 1 26 26 ILE H H 721 8.156 8.156 8.080 0.076 17932
16 1 1 . 1 1 27 27 HIS N N 722 122.251 122.251 119.315 2.936 17932
17 1 1 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.503 0.058 17932
18 1 1 . 1 1 27 27 HIS H H 722 8.346 8.346 8.320 0.026 17932
19 1 1 . 1 1 28 28 ASP N N 723 120.954 120.954 117.803 3.151 17932
20 1 1 . 1 1 28 28 ASP HA H 723 4.552 4.552 2.484 2.068 17932
21 1 1 . 1 1 28 28 ASP H H 723 8.155 8.155 8.439 -0.284 17932
22 1 1 . 1 1 29 29 ARG N N 724 121.468 121.468 115.757 5.711 17932
23 1 1 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.729 -0.543 17932
24 1 1 . 1 1 29 29 ARG H H 724 8.322 8.322 7.233 1.089 17932
25 1 1 . 1 1 30 30 LYS N N 725 121.800 121.800 120.959 0.841 17932
26 1 1 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.066 0.107 17932
27 1 1 . 1 1 30 30 LYS H H 725 8.382 8.382 7.509 0.873 17932
28 1 1 . 1 1 31 31 GLU N N 726 120.681 120.681 117.107 3.574 17932
29 1 1 . 1 1 31 31 GLU HA H 726 4.145 4.145 4.411 -0.266 17932
30 1 1 . 1 1 31 31 GLU H H 726 8.323 8.323 7.542 0.781 17932
31 1 1 . 1 1 32 32 PHE N N 727 120.355 120.355 117.560 2.795 17932
32 1 1 . 1 1 32 32 PHE HA H 727 4.486 4.486 4.093 0.393 17932
33 1 1 . 1 1 32 32 PHE H H 727 8.151 8.151 7.318 0.833 17932
34 1 1 . 1 1 33 33 ALA N N 728 123.526 123.526 122.213 1.313 17932
35 1 1 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.274 -0.084 17932
36 1 1 . 1 1 33 33 ALA H H 728 8.114 8.114 7.465 0.649 17932
37 1 1 . 1 1 34 34 LYS N N 729 119.476 119.476 116.257 3.219 17932
38 1 1 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.508 -0.357 17932
39 1 1 . 1 1 34 34 LYS H H 729 7.957 7.957 7.525 0.432 17932
40 1 1 . 1 1 35 35 PHE N N 730 120.504 120.504 113.280 7.224 17932
41 1 1 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.407 0.044 17932
42 1 1 . 1 1 35 35 PHE H H 730 8.040 8.040 7.598 0.442 17932
43 1 1 . 1 1 36 36 GLU N N 731 120.883 120.883 115.824 5.059 17932
44 1 1 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.633 0.398 17932
45 1 1 . 1 1 36 36 GLU H H 731 8.281 8.281 8.573 -0.292 17932
46 1 1 . 1 1 37 37 GLU N N 732 120.686 120.686 119.247 1.439 17932
47 1 1 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.248 -0.209 17932
48 1 1 . 1 1 37 37 GLU H H 732 8.222 8.222 8.108 0.114 17932
49 1 1 . 1 1 38 38 GLU N N 733 121.278 121.278 118.439 2.839 17932
50 1 1 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.652 -0.572 17932
51 1 1 . 1 1 38 38 GLU H H 733 8.202 8.202 8.383 -0.181 17932
52 1 1 . 1 1 39 39 ARG N N 734 120.498 120.498 120.913 -0.415 17932
53 1 1 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.161 -0.119 17932
54 1 1 . 1 1 39 39 ARG H H 734 8.102 8.102 9.057 -0.955 17932
55 1 1 . 1 1 40 40 ALA N N 735 123.267 123.267 119.453 3.814 17932
56 1 1 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.356 -0.196 17932
57 1 1 . 1 1 40 40 ALA H H 735 7.934 7.934 8.038 -0.104 17932
58 1 1 . 1 1 41 41 ARG N N 736 118.979 118.979 115.209 3.770 17932
59 1 1 . 1 1 41 41 ARG HA H 736 4.111 4.111 3.965 0.146 17932
60 1 1 . 1 1 41 41 ARG H H 736 7.926 7.926 7.778 0.148 17932
61 1 1 . 1 1 42 42 ALA N N 737 122.585 122.585 120.947 1.638 17932
62 1 1 . 1 1 42 42 ALA HA H 737 4.160 4.160 3.871 0.289 17932
63 1 1 . 1 1 42 42 ALA H H 737 7.944 7.944 9.569 -1.625 17932
64 1 1 . 1 1 43 43 LYS N N 738 118.696 118.696 118.252 0.444 17932
65 1 1 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.597 0.480 17932
66 1 1 . 1 1 43 43 LYS H H 738 7.875 7.875 7.969 -0.094 17932
67 1 1 . 1 1 44 44 TRP N N 739 120.356 120.356 116.440 3.916 17932
68 1 1 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.498 0.133 17932
69 1 1 . 1 1 44 44 TRP H H 739 7.851 7.851 6.963 0.888 17932
70 1 1 . 1 1 45 45 ASP N N 740 121.704 121.704 117.900 3.804 17932
71 1 1 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.271 0.355 17932
72 1 1 . 1 1 45 45 ASP H H 740 8.186 8.186 9.307 -1.121 17932
73 1 1 . 1 1 46 46 THR N N 741 113.983 113.983 108.759 5.224 17932
74 1 1 . 1 1 46 46 THR HA H 741 4.579 4.579 4.425 0.154 17932
75 1 1 . 1 1 46 46 THR H H 741 7.981 7.981 8.447 -0.466 17932
76 1 1 . 1 1 47 47 ALA N N 742 124.742 124.742 121.433 3.309 17932
77 1 1 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.257 -0.066 17932
78 1 1 . 1 1 47 47 ALA H H 742 8.158 8.158 8.128 0.030 17932
79 1 1 . 1 1 48 48 ASN N N 743 116.202 116.202 115.605 0.597 17932
80 1 1 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.814 -0.214 17932
81 1 1 . 1 1 48 48 ASN H H 743 8.103 8.103 7.982 0.121 17932
82 1 1 . 1 1 49 49 ASN N N 744 119.857 119.857 118.998 0.859 17932
83 1 1 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.262 -0.376 17932
84 1 1 . 1 1 49 49 ASN H H 744 8.095 8.095 8.014 0.081 17932
85 1 1 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.347 -0.001 17932
86 1 1 . 1 1 54 54 GLU N N 749 121.972 121.972 121.133 0.839 17932
87 1 1 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.310 -0.136 17932
88 1 1 . 1 1 54 54 GLU H H 749 8.331 8.331 8.247 0.084 17932
89 1 1 . 1 1 55 55 ALA N N 750 125.344 125.344 122.016 3.328 17932
90 1 1 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.600 -0.275 17932
91 1 1 . 1 1 55 55 ALA H H 750 8.406 8.406 7.993 0.413 17932
92 1 1 . 1 1 56 56 THR N N 751 112.838 112.838 116.257 -3.419 17932
93 1 1 . 1 1 56 56 THR HA H 751 4.328 4.328 4.821 -0.492 17932
94 1 1 . 1 1 56 56 THR H H 751 8.089 8.089 8.120 -0.031 17932
95 1 1 . 1 1 57 57 SER N N 752 117.970 117.970 120.272 -2.302 17932
96 1 1 . 1 1 57 57 SER HA H 752 4.490 4.490 4.927 -0.437 17932
97 1 1 . 1 1 57 57 SER H H 752 8.272 8.272 8.594 -0.322 17932
98 1 1 . 1 1 58 58 THR N N 753 115.676 115.676 115.105 0.571 17932
99 1 1 . 1 1 58 58 THR HA H 753 4.333 4.333 5.266 -0.933 17932
100 1 1 . 1 1 58 58 THR H H 753 8.090 8.090 8.371 -0.281 17932
101 1 1 . 1 1 59 59 PHE N N 754 122.160 122.160 122.291 -0.131 17932
102 1 1 . 1 1 59 59 PHE HA H 754 4.713 4.713 4.959 -0.246 17932
103 1 1 . 1 1 59 59 PHE H H 754 8.187 8.187 9.363 -1.176 17932
104 1 1 . 1 1 60 60 THR N N 755 115.583 115.583 113.975 1.608 17932
105 1 1 . 1 1 60 60 THR HA H 755 4.265 4.265 3.680 0.585 17932
106 1 1 . 1 1 60 60 THR H H 755 8.015 8.015 7.449 0.566 17932
107 1 1 . 1 1 61 61 ASN N N 756 121.324 121.324 118.075 3.249 17932
108 1 1 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.658 0.095 17932
109 1 1 . 1 1 61 61 ASN H H 756 8.340 8.340 8.259 0.081 17932
110 1 1 . 1 1 62 62 ILE N N 757 121.251 121.251 113.503 7.748 17932
111 1 1 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.499 -0.323 17932
112 1 1 . 1 1 62 62 ILE H H 757 8.076 8.076 7.594 0.482 17932
113 1 1 . 1 1 63 63 THR N N 758 118.250 118.250 120.208 -1.958 17932
114 1 1 . 1 1 63 63 THR HA H 758 4.264 4.264 4.297 -0.033 17932
115 1 1 . 1 1 63 63 THR H H 758 8.140 8.140 8.523 -0.383 17932
116 1 1 . 1 1 64 64 TYR N N 759 123.728 123.728 124.919 -1.191 17932
117 1 1 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.622 -0.094 17932
118 1 1 . 1 1 64 64 TYR H H 759 8.233 8.233 6.653 1.580 17932
119 1 1 . 1 1 65 65 ARG N N 760 124.423 124.423 118.416 6.007 17932
120 1 1 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.489 -0.248 17932
121 1 1 . 1 1 65 65 ARG H H 760 8.226 8.226 8.494 -0.268 17932
122 1 1 . 1 1 66 66 GLY N N 761 109.761 109.761 110.866 -1.105 17932
123 1 1 . 1 1 66 66 GLY H H 761 7.700 7.700 8.407 -0.707 17932
124 1 2 . 1 1 22 22 LEU N N 717 123.186 123.186 119.739 3.447 17932
125 1 2 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.603 -0.303 17932
126 1 2 . 1 1 22 22 LEU H H 717 8.121 8.121 7.768 0.353 17932
127 1 2 . 1 1 23 23 LEU N N 718 123.575 123.575 114.829 8.746 17932
128 1 2 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.582 -0.232 17932
129 1 2 . 1 1 23 23 LEU H H 718 8.189 8.189 8.242 -0.053 17932
130 1 2 . 1 1 24 24 ILE N N 719 121.952 121.952 114.647 7.305 17932
131 1 2 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.248 0.015 17932
132 1 2 . 1 1 24 24 ILE H H 719 8.079 8.079 8.739 -0.660 17932
133 1 2 . 1 1 25 25 THR N N 720 118.098 118.098 113.981 4.117 17932
134 1 2 . 1 1 25 25 THR HA H 720 4.359 4.359 3.728 0.631 17932
135 1 2 . 1 1 25 25 THR H H 720 8.296 8.296 8.571 -0.275 17932
136 1 2 . 1 1 26 26 ILE N N 721 122.588 122.588 114.046 8.542 17932
137 1 2 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.238 -0.205 17932
138 1 2 . 1 1 26 26 ILE H H 721 8.156 8.156 8.735 -0.579 17932
139 1 2 . 1 1 27 27 HIS N N 722 122.251 122.251 118.141 4.110 17932
140 1 2 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.710 -0.149 17932
141 1 2 . 1 1 27 27 HIS H H 722 8.346 8.346 7.876 0.470 17932
142 1 2 . 1 1 28 28 ASP N N 723 120.954 120.954 121.789 -0.835 17932
143 1 2 . 1 1 28 28 ASP HA H 723 4.552 4.552 2.828 1.724 17932
144 1 2 . 1 1 28 28 ASP H H 723 8.155 8.155 8.503 -0.348 17932
145 1 2 . 1 1 29 29 ARG N N 724 121.468 121.468 116.269 5.199 17932
146 1 2 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.585 -0.399 17932
147 1 2 . 1 1 29 29 ARG H H 724 8.322 8.322 8.212 0.110 17932
148 1 2 . 1 1 30 30 LYS N N 725 121.800 121.800 119.885 1.915 17932
149 1 2 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.158 0.015 17932
150 1 2 . 1 1 30 30 LYS H H 725 8.382 8.382 7.156 1.226 17932
151 1 2 . 1 1 31 31 GLU N N 726 120.681 120.681 118.676 2.005 17932
152 1 2 . 1 1 31 31 GLU HA H 726 4.145 4.145 4.439 -0.294 17932
153 1 2 . 1 1 31 31 GLU H H 726 8.323 8.323 7.828 0.495 17932
154 1 2 . 1 1 32 32 PHE N N 727 120.355 120.355 115.973 4.382 17932
155 1 2 . 1 1 32 32 PHE HA H 727 4.486 4.486 4.361 0.125 17932
156 1 2 . 1 1 32 32 PHE H H 727 8.151 8.151 7.040 1.111 17932
157 1 2 . 1 1 33 33 ALA N N 728 123.526 123.526 120.722 2.804 17932
158 1 2 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.191 -0.001 17932
159 1 2 . 1 1 33 33 ALA H H 728 8.114 8.114 7.238 0.876 17932
160 1 2 . 1 1 34 34 LYS N N 729 119.476 119.476 116.850 2.626 17932
161 1 2 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.435 -0.284 17932
162 1 2 . 1 1 34 34 LYS H H 729 7.957 7.957 7.368 0.589 17932
163 1 2 . 1 1 35 35 PHE N N 730 120.504 120.504 113.704 6.800 17932
164 1 2 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.509 -0.058 17932
165 1 2 . 1 1 35 35 PHE H H 730 8.040 8.040 7.602 0.438 17932
166 1 2 . 1 1 36 36 GLU N N 731 120.883 120.883 116.226 4.657 17932
167 1 2 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.991 0.040 17932
168 1 2 . 1 1 36 36 GLU H H 731 8.281 8.281 8.564 -0.283 17932
169 1 2 . 1 1 37 37 GLU N N 732 120.686 120.686 119.631 1.055 17932
170 1 2 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.117 -0.078 17932
171 1 2 . 1 1 37 37 GLU H H 732 8.222 8.222 8.112 0.110 17932
172 1 2 . 1 1 38 38 GLU N N 733 121.278 121.278 118.705 2.573 17932
173 1 2 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.677 -0.597 17932
174 1 2 . 1 1 38 38 GLU H H 733 8.202 8.202 8.458 -0.256 17932
175 1 2 . 1 1 39 39 ARG N N 734 120.498 120.498 119.858 0.640 17932
176 1 2 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.206 -0.164 17932
177 1 2 . 1 1 39 39 ARG H H 734 8.102 8.102 8.957 -0.855 17932
178 1 2 . 1 1 40 40 ALA N N 735 123.267 123.267 118.767 4.500 17932
179 1 2 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.355 -0.195 17932
180 1 2 . 1 1 40 40 ALA H H 735 7.934 7.934 7.781 0.153 17932
181 1 2 . 1 1 41 41 ARG N N 736 118.979 118.979 115.881 3.098 17932
182 1 2 . 1 1 41 41 ARG HA H 736 4.111 4.111 3.930 0.181 17932
183 1 2 . 1 1 41 41 ARG H H 736 7.926 7.926 7.699 0.227 17932
184 1 2 . 1 1 42 42 ALA N N 737 122.585 122.585 117.536 5.049 17932
185 1 2 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.253 -0.093 17932
186 1 2 . 1 1 42 42 ALA H H 737 7.944 7.944 9.437 -1.493 17932
187 1 2 . 1 1 43 43 LYS N N 738 118.696 118.696 118.323 0.373 17932
188 1 2 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.822 0.255 17932
189 1 2 . 1 1 43 43 LYS H H 738 7.875 7.875 7.847 0.028 17932
190 1 2 . 1 1 44 44 TRP N N 739 120.356 120.356 115.206 5.150 17932
191 1 2 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.563 0.068 17932
192 1 2 . 1 1 44 44 TRP H H 739 7.851 7.851 6.882 0.969 17932
193 1 2 . 1 1 45 45 ASP N N 740 121.704 121.704 118.063 3.641 17932
194 1 2 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.743 -0.117 17932
195 1 2 . 1 1 45 45 ASP H H 740 8.186 8.186 8.999 -0.813 17932
196 1 2 . 1 1 46 46 THR N N 741 113.983 113.983 118.130 -4.147 17932
197 1 2 . 1 1 46 46 THR HA H 741 4.579 4.579 4.685 -0.106 17932
198 1 2 . 1 1 46 46 THR H H 741 7.981 7.981 8.823 -0.842 17932
199 1 2 . 1 1 47 47 ALA N N 742 124.742 124.742 123.505 1.237 17932
200 1 2 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.539 -0.348 17932
201 1 2 . 1 1 47 47 ALA H H 742 8.158 8.158 8.456 -0.298 17932
202 1 2 . 1 1 48 48 ASN N N 743 116.202 116.202 118.188 -1.986 17932
203 1 2 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.590 0.010 17932
204 1 2 . 1 1 48 48 ASN H H 743 8.103 8.103 8.811 -0.708 17932
205 1 2 . 1 1 49 49 ASN N N 744 119.857 119.857 118.166 1.691 17932
206 1 2 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.140 -0.254 17932
207 1 2 . 1 1 49 49 ASN H H 744 8.095 8.095 8.618 -0.523 17932
208 1 2 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.403 -0.057 17932
209 1 2 . 1 1 54 54 GLU N N 749 121.972 121.972 122.168 -0.196 17932
210 1 2 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.445 -0.271 17932
211 1 2 . 1 1 54 54 GLU H H 749 8.331 8.331 8.750 -0.419 17932
212 1 2 . 1 1 55 55 ALA N N 750 125.344 125.344 124.549 0.795 17932
213 1 2 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.691 -0.366 17932
214 1 2 . 1 1 55 55 ALA H H 750 8.406 8.406 8.381 0.025 17932
215 1 2 . 1 1 56 56 THR N N 751 112.838 112.838 116.069 -3.231 17932
216 1 2 . 1 1 56 56 THR HA H 751 4.328 4.328 4.594 -0.266 17932
217 1 2 . 1 1 56 56 THR H H 751 8.089 8.089 8.212 -0.123 17932
218 1 2 . 1 1 57 57 SER N N 752 117.970 117.970 120.105 -2.135 17932
219 1 2 . 1 1 57 57 SER HA H 752 4.490 4.490 4.835 -0.345 17932
220 1 2 . 1 1 57 57 SER H H 752 8.272 8.272 8.596 -0.324 17932
221 1 2 . 1 1 58 58 THR N N 753 115.676 115.676 115.115 0.561 17932
222 1 2 . 1 1 58 58 THR HA H 753 4.333 4.333 4.885 -0.552 17932
223 1 2 . 1 1 58 58 THR H H 753 8.090 8.090 8.118 -0.028 17932
224 1 2 . 1 1 59 59 PHE N N 754 122.160 122.160 119.382 2.778 17932
225 1 2 . 1 1 59 59 PHE HA H 754 4.713 4.713 4.953 -0.240 17932
226 1 2 . 1 1 59 59 PHE H H 754 8.187 8.187 8.005 0.182 17932
227 1 2 . 1 1 60 60 THR N N 755 115.583 115.583 116.299 -0.716 17932
228 1 2 . 1 1 60 60 THR HA H 755 4.265 4.265 4.314 -0.049 17932
229 1 2 . 1 1 60 60 THR H H 755 8.015 8.015 8.159 -0.144 17932
230 1 2 . 1 1 61 61 ASN N N 756 121.324 121.324 117.024 4.300 17932
231 1 2 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.609 0.144 17932
232 1 2 . 1 1 61 61 ASN H H 756 8.340 8.340 8.116 0.224 17932
233 1 2 . 1 1 62 62 ILE N N 757 121.251 121.251 110.827 10.424 17932
234 1 2 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.886 -0.710 17932
235 1 2 . 1 1 62 62 ILE H H 757 8.076 8.076 7.802 0.274 17932
236 1 2 . 1 1 63 63 THR N N 758 118.250 118.250 120.777 -2.527 17932
237 1 2 . 1 1 63 63 THR HA H 758 4.264 4.264 4.456 -0.192 17932
238 1 2 . 1 1 63 63 THR H H 758 8.140 8.140 8.574 -0.434 17932
239 1 2 . 1 1 64 64 TYR N N 759 123.728 123.728 123.526 0.202 17932
240 1 2 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.903 -0.375 17932
241 1 2 . 1 1 64 64 TYR H H 759 8.233 8.233 7.193 1.040 17932
242 1 2 . 1 1 65 65 ARG N N 760 124.423 124.423 119.958 4.465 17932
243 1 2 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.555 -0.314 17932
244 1 2 . 1 1 65 65 ARG H H 760 8.226 8.226 8.068 0.158 17932
245 1 2 . 1 1 66 66 GLY N N 761 109.761 109.761 111.778 -2.017 17932
246 1 2 . 1 1 66 66 GLY H H 761 7.700 7.700 7.947 -0.247 17932
247 1 3 . 1 1 22 22 LEU N N 717 123.186 123.186 120.891 2.295 17932
248 1 3 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.362 -0.062 17932
249 1 3 . 1 1 22 22 LEU H H 717 8.121 8.121 8.273 -0.152 17932
250 1 3 . 1 1 23 23 LEU N N 718 123.575 123.575 115.722 7.853 17932
251 1 3 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.406 -0.056 17932
252 1 3 . 1 1 23 23 LEU H H 718 8.189 8.189 7.894 0.295 17932
253 1 3 . 1 1 24 24 ILE N N 719 121.952 121.952 114.576 7.376 17932
254 1 3 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.040 0.223 17932
255 1 3 . 1 1 24 24 ILE H H 719 8.079 8.079 7.697 0.383 17932
256 1 3 . 1 1 25 25 THR N N 720 118.098 118.098 112.261 5.837 17932
257 1 3 . 1 1 25 25 THR HA H 720 4.359 4.359 4.063 0.296 17932
258 1 3 . 1 1 25 25 THR H H 720 8.296 8.296 8.111 0.185 17932
259 1 3 . 1 1 26 26 ILE N N 721 122.588 122.588 111.994 10.594 17932
260 1 3 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.170 -0.137 17932
261 1 3 . 1 1 26 26 ILE H H 721 8.156 8.156 7.558 0.598 17932
262 1 3 . 1 1 27 27 HIS N N 722 122.251 122.251 116.423 5.828 17932
263 1 3 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.695 -0.134 17932
264 1 3 . 1 1 27 27 HIS H H 722 8.346 8.346 7.766 0.580 17932
265 1 3 . 1 1 28 28 ASP N N 723 120.954 120.954 118.869 2.085 17932
266 1 3 . 1 1 28 28 ASP HA H 723 4.552 4.552 4.201 0.351 17932
267 1 3 . 1 1 28 28 ASP H H 723 8.155 8.155 8.219 -0.064 17932
268 1 3 . 1 1 29 29 ARG N N 724 121.468 121.468 118.840 2.628 17932
269 1 3 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.610 -0.424 17932
270 1 3 . 1 1 29 29 ARG H H 724 8.322 8.322 7.968 0.354 17932
271 1 3 . 1 1 30 30 LYS N N 725 121.800 121.800 119.498 2.302 17932
272 1 3 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.029 0.144 17932
273 1 3 . 1 1 30 30 LYS H H 725 8.382 8.382 8.437 -0.055 17932
274 1 3 . 1 1 31 31 GLU N N 726 120.681 120.681 117.547 3.134 17932
275 1 3 . 1 1 31 31 GLU HA H 726 4.145 4.145 4.170 -0.025 17932
276 1 3 . 1 1 31 31 GLU H H 726 8.323 8.323 8.059 0.264 17932
277 1 3 . 1 1 32 32 PHE N N 727 120.355 120.355 116.207 4.148 17932
278 1 3 . 1 1 32 32 PHE HA H 727 4.486 4.486 3.780 0.706 17932
279 1 3 . 1 1 32 32 PHE H H 727 8.151 8.151 7.295 0.856 17932
280 1 3 . 1 1 33 33 ALA N N 728 123.526 123.526 121.991 1.535 17932
281 1 3 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.248 -0.058 17932
282 1 3 . 1 1 33 33 ALA H H 728 8.114 8.114 7.530 0.584 17932
283 1 3 . 1 1 34 34 LYS N N 729 119.476 119.476 116.093 3.383 17932
284 1 3 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.514 -0.363 17932
285 1 3 . 1 1 34 34 LYS H H 729 7.957 7.957 7.630 0.327 17932
286 1 3 . 1 1 35 35 PHE N N 730 120.504 120.504 114.675 5.829 17932
287 1 3 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.102 0.349 17932
288 1 3 . 1 1 35 35 PHE H H 730 8.040 8.040 7.544 0.496 17932
289 1 3 . 1 1 36 36 GLU N N 731 120.883 120.883 115.465 5.418 17932
290 1 3 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.536 0.495 17932
291 1 3 . 1 1 36 36 GLU H H 731 8.281 8.281 8.249 0.032 17932
292 1 3 . 1 1 37 37 GLU N N 732 120.686 120.686 120.248 0.438 17932
293 1 3 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.141 -0.102 17932
294 1 3 . 1 1 37 37 GLU H H 732 8.222 8.222 7.893 0.329 17932
295 1 3 . 1 1 38 38 GLU N N 733 121.278 121.278 118.983 2.295 17932
296 1 3 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.343 -0.263 17932
297 1 3 . 1 1 38 38 GLU H H 733 8.202 8.202 8.531 -0.329 17932
298 1 3 . 1 1 39 39 ARG N N 734 120.498 120.498 121.054 -0.556 17932
299 1 3 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.216 -0.174 17932
300 1 3 . 1 1 39 39 ARG H H 734 8.102 8.102 8.904 -0.802 17932
301 1 3 . 1 1 40 40 ALA N N 735 123.267 123.267 119.440 3.827 17932
302 1 3 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.347 -0.187 17932
303 1 3 . 1 1 40 40 ALA H H 735 7.934 7.934 8.141 -0.207 17932
304 1 3 . 1 1 41 41 ARG N N 736 118.979 118.979 117.347 1.632 17932
305 1 3 . 1 1 41 41 ARG HA H 736 4.111 4.111 4.011 0.100 17932
306 1 3 . 1 1 41 41 ARG H H 736 7.926 7.926 7.889 0.037 17932
307 1 3 . 1 1 42 42 ALA N N 737 122.585 122.585 120.864 1.721 17932
308 1 3 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.433 -0.273 17932
309 1 3 . 1 1 42 42 ALA H H 737 7.944 7.944 8.923 -0.979 17932
310 1 3 . 1 1 43 43 LYS N N 738 118.696 118.696 118.083 0.613 17932
311 1 3 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.804 0.273 17932
312 1 3 . 1 1 43 43 LYS H H 738 7.875 7.875 7.828 0.047 17932
313 1 3 . 1 1 44 44 TRP N N 739 120.356 120.356 115.003 5.353 17932
314 1 3 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.603 0.028 17932
315 1 3 . 1 1 44 44 TRP H H 739 7.851 7.851 7.035 0.816 17932
316 1 3 . 1 1 45 45 ASP N N 740 121.704 121.704 118.972 2.732 17932
317 1 3 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.986 -0.360 17932
318 1 3 . 1 1 45 45 ASP H H 740 8.186 8.186 8.673 -0.487 17932
319 1 3 . 1 1 46 46 THR N N 741 113.983 113.983 114.507 -0.524 17932
320 1 3 . 1 1 46 46 THR HA H 741 4.579 4.579 4.120 0.459 17932
321 1 3 . 1 1 46 46 THR H H 741 7.981 7.981 8.472 -0.491 17932
322 1 3 . 1 1 47 47 ALA N N 742 124.742 124.742 120.653 4.089 17932
323 1 3 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.368 -0.177 17932
324 1 3 . 1 1 47 47 ALA H H 742 8.158 8.158 8.406 -0.248 17932
325 1 3 . 1 1 48 48 ASN N N 743 116.202 116.202 116.265 -0.063 17932
326 1 3 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.808 -0.208 17932
327 1 3 . 1 1 48 48 ASN H H 743 8.103 8.103 8.547 -0.444 17932
328 1 3 . 1 1 49 49 ASN N N 744 119.857 119.857 118.849 1.008 17932
329 1 3 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.212 -0.326 17932
330 1 3 . 1 1 49 49 ASN H H 744 8.095 8.095 8.744 -0.649 17932
331 1 3 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.413 -0.067 17932
332 1 3 . 1 1 54 54 GLU N N 749 121.972 121.972 121.040 0.932 17932
333 1 3 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.695 -0.521 17932
334 1 3 . 1 1 54 54 GLU H H 749 8.331 8.331 8.592 -0.261 17932
335 1 3 . 1 1 55 55 ALA N N 750 125.344 125.344 122.938 2.406 17932
336 1 3 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.514 -0.189 17932
337 1 3 . 1 1 55 55 ALA H H 750 8.406 8.406 7.633 0.773 17932
338 1 3 . 1 1 56 56 THR N N 751 112.838 112.838 113.159 -0.321 17932
339 1 3 . 1 1 56 56 THR HA H 751 4.328 4.328 4.507 -0.179 17932
340 1 3 . 1 1 56 56 THR H H 751 8.089 8.089 8.252 -0.163 17932
341 1 3 . 1 1 57 57 SER N N 752 117.970 117.970 116.658 1.312 17932
342 1 3 . 1 1 57 57 SER HA H 752 4.490 4.490 4.811 -0.321 17932
343 1 3 . 1 1 57 57 SER H H 752 8.272 8.272 8.676 -0.404 17932
344 1 3 . 1 1 58 58 THR N N 753 115.676 115.676 114.916 0.760 17932
345 1 3 . 1 1 58 58 THR HA H 753 4.333 4.333 4.692 -0.359 17932
346 1 3 . 1 1 58 58 THR H H 753 8.090 8.090 8.423 -0.333 17932
347 1 3 . 1 1 59 59 PHE N N 754 122.160 122.160 121.762 0.398 17932
348 1 3 . 1 1 59 59 PHE HA H 754 4.713 4.713 4.890 -0.177 17932
349 1 3 . 1 1 59 59 PHE H H 754 8.187 8.187 8.386 -0.199 17932
350 1 3 . 1 1 60 60 THR N N 755 115.583 115.583 114.040 1.543 17932
351 1 3 . 1 1 60 60 THR HA H 755 4.265 4.265 3.642 0.623 17932
352 1 3 . 1 1 60 60 THR H H 755 8.015 8.015 7.814 0.201 17932
353 1 3 . 1 1 61 61 ASN N N 756 121.324 121.324 118.894 2.430 17932
354 1 3 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.594 0.159 17932
355 1 3 . 1 1 61 61 ASN H H 756 8.340 8.340 8.575 -0.235 17932
356 1 3 . 1 1 62 62 ILE N N 757 121.251 121.251 110.911 10.340 17932
357 1 3 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.617 -0.441 17932
358 1 3 . 1 1 62 62 ILE H H 757 8.076 8.076 7.745 0.331 17932
359 1 3 . 1 1 63 63 THR N N 758 118.250 118.250 120.713 -2.463 17932
360 1 3 . 1 1 63 63 THR HA H 758 4.264 4.264 4.311 -0.047 17932
361 1 3 . 1 1 63 63 THR H H 758 8.140 8.140 8.527 -0.387 17932
362 1 3 . 1 1 64 64 TYR N N 759 123.728 123.728 125.194 -1.466 17932
363 1 3 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.687 -0.159 17932
364 1 3 . 1 1 64 64 TYR H H 759 8.233 8.233 7.075 1.158 17932
365 1 3 . 1 1 65 65 ARG N N 760 124.423 124.423 119.224 5.199 17932
366 1 3 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.499 -0.258 17932
367 1 3 . 1 1 65 65 ARG H H 760 8.226 8.226 8.604 -0.378 17932
368 1 3 . 1 1 66 66 GLY N N 761 109.761 109.761 110.415 -0.654 17932
369 1 3 . 1 1 66 66 GLY H H 761 7.700 7.700 8.350 -0.650 17932
370 1 4 . 1 1 22 22 LEU N N 717 123.186 123.186 120.914 2.272 17932
371 1 4 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.506 -0.206 17932
372 1 4 . 1 1 22 22 LEU H H 717 8.121 8.121 8.182 -0.061 17932
373 1 4 . 1 1 23 23 LEU N N 718 123.575 123.575 117.880 5.695 17932
374 1 4 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.268 0.082 17932
375 1 4 . 1 1 23 23 LEU H H 718 8.189 8.189 8.061 0.128 17932
376 1 4 . 1 1 24 24 ILE N N 719 121.952 121.952 113.338 8.614 17932
377 1 4 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.072 0.192 17932
378 1 4 . 1 1 24 24 ILE H H 719 8.079 8.079 7.370 0.709 17932
379 1 4 . 1 1 25 25 THR N N 720 118.098 118.098 115.403 2.695 17932
380 1 4 . 1 1 25 25 THR HA H 720 4.359 4.359 3.737 0.622 17932
381 1 4 . 1 1 25 25 THR H H 720 8.296 8.296 7.766 0.530 17932
382 1 4 . 1 1 26 26 ILE N N 721 122.588 122.588 110.484 12.104 17932
383 1 4 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.233 -0.200 17932
384 1 4 . 1 1 26 26 ILE H H 721 8.156 8.156 7.317 0.839 17932
385 1 4 . 1 1 27 27 HIS N N 722 122.251 122.251 118.973 3.278 17932
386 1 4 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.445 0.116 17932
387 1 4 . 1 1 27 27 HIS H H 722 8.346 8.346 8.040 0.306 17932
388 1 4 . 1 1 28 28 ASP N N 723 120.954 120.954 120.064 0.890 17932
389 1 4 . 1 1 28 28 ASP HA H 723 4.552 4.552 4.104 0.448 17932
390 1 4 . 1 1 28 28 ASP H H 723 8.155 8.155 8.366 -0.211 17932
391 1 4 . 1 1 29 29 ARG N N 724 121.468 121.468 116.374 5.094 17932
392 1 4 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.266 -0.080 17932
393 1 4 . 1 1 29 29 ARG H H 724 8.322 8.322 8.245 0.077 17932
394 1 4 . 1 1 30 30 LYS N N 725 121.800 121.800 118.156 3.644 17932
395 1 4 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.104 0.069 17932
396 1 4 . 1 1 30 30 LYS H H 725 8.382 8.382 7.276 1.106 17932
397 1 4 . 1 1 31 31 GLU N N 726 120.681 120.681 118.621 2.060 17932
398 1 4 . 1 1 31 31 GLU HA H 726 4.145 4.145 3.987 0.158 17932
399 1 4 . 1 1 31 31 GLU H H 726 8.323 8.323 7.824 0.499 17932
400 1 4 . 1 1 32 32 PHE N N 727 120.355 120.355 116.300 4.055 17932
401 1 4 . 1 1 32 32 PHE HA H 727 4.486 4.486 4.075 0.411 17932
402 1 4 . 1 1 32 32 PHE H H 727 8.151 8.151 6.990 1.161 17932
403 1 4 . 1 1 33 33 ALA N N 728 123.526 123.526 120.379 3.147 17932
404 1 4 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.164 0.026 17932
405 1 4 . 1 1 33 33 ALA H H 728 8.114 8.114 6.916 1.198 17932
406 1 4 . 1 1 34 34 LYS N N 729 119.476 119.476 116.195 3.281 17932
407 1 4 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.494 -0.343 17932
408 1 4 . 1 1 34 34 LYS H H 729 7.957 7.957 7.440 0.517 17932
409 1 4 . 1 1 35 35 PHE N N 730 120.504 120.504 114.456 6.048 17932
410 1 4 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.358 0.093 17932
411 1 4 . 1 1 35 35 PHE H H 730 8.040 8.040 7.437 0.603 17932
412 1 4 . 1 1 36 36 GLU N N 731 120.883 120.883 116.834 4.049 17932
413 1 4 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.727 0.304 17932
414 1 4 . 1 1 36 36 GLU H H 731 8.281 8.281 8.429 -0.148 17932
415 1 4 . 1 1 37 37 GLU N N 732 120.686 120.686 119.542 1.144 17932
416 1 4 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.343 -0.304 17932
417 1 4 . 1 1 37 37 GLU H H 732 8.222 8.222 8.111 0.111 17932
418 1 4 . 1 1 38 38 GLU N N 733 121.278 121.278 118.873 2.405 17932
419 1 4 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.763 -0.683 17932
420 1 4 . 1 1 38 38 GLU H H 733 8.202 8.202 8.696 -0.494 17932
421 1 4 . 1 1 39 39 ARG N N 734 120.498 120.498 121.079 -0.581 17932
422 1 4 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.174 -0.132 17932
423 1 4 . 1 1 39 39 ARG H H 734 8.102 8.102 9.336 -1.234 17932
424 1 4 . 1 1 40 40 ALA N N 735 123.267 123.267 118.668 4.599 17932
425 1 4 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.373 -0.213 17932
426 1 4 . 1 1 40 40 ALA H H 735 7.934 7.934 7.716 0.218 17932
427 1 4 . 1 1 41 41 ARG N N 736 118.979 118.979 115.561 3.418 17932
428 1 4 . 1 1 41 41 ARG HA H 736 4.111 4.111 3.918 0.193 17932
429 1 4 . 1 1 41 41 ARG H H 736 7.926 7.926 7.543 0.383 17932
430 1 4 . 1 1 42 42 ALA N N 737 122.585 122.585 117.762 4.823 17932
431 1 4 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.169 -0.009 17932
432 1 4 . 1 1 42 42 ALA H H 737 7.944 7.944 9.356 -1.412 17932
433 1 4 . 1 1 43 43 LYS N N 738 118.696 118.696 117.518 1.178 17932
434 1 4 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.819 0.258 17932
435 1 4 . 1 1 43 43 LYS H H 738 7.875 7.875 7.631 0.244 17932
436 1 4 . 1 1 44 44 TRP N N 739 120.356 120.356 115.973 4.383 17932
437 1 4 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.559 0.072 17932
438 1 4 . 1 1 44 44 TRP H H 739 7.851 7.851 6.968 0.883 17932
439 1 4 . 1 1 45 45 ASP N N 740 121.704 121.704 118.657 3.047 17932
440 1 4 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.944 -0.318 17932
441 1 4 . 1 1 45 45 ASP H H 740 8.186 8.186 8.845 -0.659 17932
442 1 4 . 1 1 46 46 THR N N 741 113.983 113.983 114.870 -0.887 17932
443 1 4 . 1 1 46 46 THR HA H 741 4.579 4.579 4.596 -0.017 17932
444 1 4 . 1 1 46 46 THR H H 741 7.981 7.981 9.593 -1.612 17932
445 1 4 . 1 1 47 47 ALA N N 742 124.742 124.742 123.131 1.611 17932
446 1 4 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.601 -0.410 17932
447 1 4 . 1 1 47 47 ALA H H 742 8.158 8.158 7.802 0.356 17932
448 1 4 . 1 1 48 48 ASN N N 743 116.202 116.202 117.303 -1.101 17932
449 1 4 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.724 -0.124 17932
450 1 4 . 1 1 48 48 ASN H H 743 8.103 8.103 8.774 -0.671 17932
451 1 4 . 1 1 49 49 ASN N N 744 119.857 119.857 118.431 1.426 17932
452 1 4 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.139 -0.253 17932
453 1 4 . 1 1 49 49 ASN H H 744 8.095 8.095 8.606 -0.511 17932
454 1 4 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.362 -0.016 17932
455 1 4 . 1 1 54 54 GLU N N 749 121.972 121.972 120.923 1.049 17932
456 1 4 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.412 -0.238 17932
457 1 4 . 1 1 54 54 GLU H H 749 8.331 8.331 9.052 -0.721 17932
458 1 4 . 1 1 55 55 ALA N N 750 125.344 125.344 122.360 2.984 17932
459 1 4 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.530 -0.205 17932
460 1 4 . 1 1 55 55 ALA H H 750 8.406 8.406 8.038 0.368 17932
461 1 4 . 1 1 56 56 THR N N 751 112.838 112.838 115.237 -2.399 17932
462 1 4 . 1 1 56 56 THR HA H 751 4.328 4.328 4.367 -0.039 17932
463 1 4 . 1 1 56 56 THR H H 751 8.089 8.089 7.508 0.581 17932
464 1 4 . 1 1 57 57 SER N N 752 117.970 117.970 119.930 -1.960 17932
465 1 4 . 1 1 57 57 SER HA H 752 4.490 4.490 4.836 -0.346 17932
466 1 4 . 1 1 57 57 SER H H 752 8.272 8.272 8.536 -0.264 17932
467 1 4 . 1 1 58 58 THR N N 753 115.676 115.676 113.531 2.145 17932
468 1 4 . 1 1 58 58 THR HA H 753 4.333 4.333 5.105 -0.772 17932
469 1 4 . 1 1 58 58 THR H H 753 8.090 8.090 8.084 0.006 17932
470 1 4 . 1 1 59 59 PHE N N 754 122.160 122.160 118.894 3.266 17932
471 1 4 . 1 1 59 59 PHE HA H 754 4.713 4.713 5.056 -0.343 17932
472 1 4 . 1 1 59 59 PHE H H 754 8.187 8.187 8.424 -0.237 17932
473 1 4 . 1 1 60 60 THR N N 755 115.583 115.583 115.221 0.362 17932
474 1 4 . 1 1 60 60 THR HA H 755 4.265 4.265 3.820 0.445 17932
475 1 4 . 1 1 60 60 THR H H 755 8.015 8.015 8.047 -0.032 17932
476 1 4 . 1 1 61 61 ASN N N 756 121.324 121.324 117.617 3.707 17932
477 1 4 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.782 -0.029 17932
478 1 4 . 1 1 61 61 ASN H H 756 8.340 8.340 7.982 0.358 17932
479 1 4 . 1 1 62 62 ILE N N 757 121.251 121.251 114.529 6.722 17932
480 1 4 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.155 0.021 17932
481 1 4 . 1 1 62 62 ILE H H 757 8.076 8.076 8.179 -0.103 17932
482 1 4 . 1 1 63 63 THR N N 758 118.250 118.250 117.960 0.290 17932
483 1 4 . 1 1 63 63 THR HA H 758 4.264 4.264 4.502 -0.238 17932
484 1 4 . 1 1 63 63 THR H H 758 8.140 8.140 8.488 -0.348 17932
485 1 4 . 1 1 64 64 TYR N N 759 123.728 123.728 123.827 -0.099 17932
486 1 4 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.763 -0.235 17932
487 1 4 . 1 1 64 64 TYR H H 759 8.233 8.233 7.723 0.510 17932
488 1 4 . 1 1 65 65 ARG N N 760 124.423 124.423 118.251 6.172 17932
489 1 4 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.503 -0.262 17932
490 1 4 . 1 1 65 65 ARG H H 760 8.226 8.226 7.563 0.663 17932
491 1 4 . 1 1 66 66 GLY N N 761 109.761 109.761 109.943 -0.182 17932
492 1 4 . 1 1 66 66 GLY H H 761 7.700 7.700 8.027 -0.327 17932
493 1 5 . 1 1 22 22 LEU N N 717 123.186 123.186 120.685 2.501 17932
494 1 5 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.368 -0.068 17932
495 1 5 . 1 1 22 22 LEU H H 717 8.121 8.121 7.946 0.175 17932
496 1 5 . 1 1 23 23 LEU N N 718 123.575 123.575 113.952 9.623 17932
497 1 5 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.539 -0.189 17932
498 1 5 . 1 1 23 23 LEU H H 718 8.189 8.189 8.701 -0.512 17932
499 1 5 . 1 1 24 24 ILE N N 719 121.952 121.952 115.067 6.885 17932
500 1 5 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.081 0.182 17932
501 1 5 . 1 1 24 24 ILE H H 719 8.079 8.079 8.130 -0.051 17932
502 1 5 . 1 1 25 25 THR N N 720 118.098 118.098 112.687 5.411 17932
503 1 5 . 1 1 25 25 THR HA H 720 4.359 4.359 3.944 0.415 17932
504 1 5 . 1 1 25 25 THR H H 720 8.296 8.296 8.338 -0.042 17932
505 1 5 . 1 1 26 26 ILE N N 721 122.588 122.588 112.640 9.948 17932
506 1 5 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.499 -0.466 17932
507 1 5 . 1 1 26 26 ILE H H 721 8.156 8.156 8.141 0.015 17932
508 1 5 . 1 1 27 27 HIS N N 722 122.251 122.251 118.808 3.443 17932
509 1 5 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.943 -0.382 17932
510 1 5 . 1 1 27 27 HIS H H 722 8.346 8.346 8.321 0.025 17932
511 1 5 . 1 1 28 28 ASP N N 723 120.954 120.954 118.535 2.419 17932
512 1 5 . 1 1 28 28 ASP HA H 723 4.552 4.552 2.633 1.919 17932
513 1 5 . 1 1 28 28 ASP H H 723 8.155 8.155 8.274 -0.119 17932
514 1 5 . 1 1 29 29 ARG N N 724 121.468 121.468 116.490 4.978 17932
515 1 5 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.696 -0.510 17932
516 1 5 . 1 1 29 29 ARG H H 724 8.322 8.322 7.209 1.113 17932
517 1 5 . 1 1 30 30 LYS N N 725 121.800 121.800 120.234 1.566 17932
518 1 5 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.143 0.030 17932
519 1 5 . 1 1 30 30 LYS H H 725 8.382 8.382 7.513 0.869 17932
520 1 5 . 1 1 31 31 GLU N N 726 120.681 120.681 120.200 0.481 17932
521 1 5 . 1 1 31 31 GLU HA H 726 4.145 4.145 3.846 0.299 17932
522 1 5 . 1 1 31 31 GLU H H 726 8.323 8.323 7.461 0.862 17932
523 1 5 . 1 1 32 32 PHE N N 727 120.355 120.355 116.981 3.374 17932
524 1 5 . 1 1 32 32 PHE HA H 727 4.486 4.486 3.607 0.879 17932
525 1 5 . 1 1 32 32 PHE H H 727 8.151 8.151 7.091 1.060 17932
526 1 5 . 1 1 33 33 ALA N N 728 123.526 123.526 120.378 3.148 17932
527 1 5 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.311 -0.121 17932
528 1 5 . 1 1 33 33 ALA H H 728 8.114 8.114 7.032 1.082 17932
529 1 5 . 1 1 34 34 LYS N N 729 119.476 119.476 117.286 2.190 17932
530 1 5 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.439 -0.288 17932
531 1 5 . 1 1 34 34 LYS H H 729 7.957 7.957 7.164 0.793 17932
532 1 5 . 1 1 35 35 PHE N N 730 120.504 120.504 114.933 5.571 17932
533 1 5 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.259 0.192 17932
534 1 5 . 1 1 35 35 PHE H H 730 8.040 8.040 8.344 -0.304 17932
535 1 5 . 1 1 36 36 GLU N N 731 120.883 120.883 115.044 5.839 17932
536 1 5 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.426 0.605 17932
537 1 5 . 1 1 36 36 GLU H H 731 8.281 8.281 8.426 -0.145 17932
538 1 5 . 1 1 37 37 GLU N N 732 120.686 120.686 119.227 1.459 17932
539 1 5 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.176 -0.137 17932
540 1 5 . 1 1 37 37 GLU H H 732 8.222 8.222 8.089 0.133 17932
541 1 5 . 1 1 38 38 GLU N N 733 121.278 121.278 118.357 2.921 17932
542 1 5 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.229 -0.149 17932
543 1 5 . 1 1 38 38 GLU H H 733 8.202 8.202 8.619 -0.417 17932
544 1 5 . 1 1 39 39 ARG N N 734 120.498 120.498 123.085 -2.587 17932
545 1 5 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.132 -0.090 17932
546 1 5 . 1 1 39 39 ARG H H 734 8.102 8.102 8.969 -0.867 17932
547 1 5 . 1 1 40 40 ALA N N 735 123.267 123.267 119.024 4.243 17932
548 1 5 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.300 -0.140 17932
549 1 5 . 1 1 40 40 ALA H H 735 7.934 7.934 8.331 -0.397 17932
550 1 5 . 1 1 41 41 ARG N N 736 118.979 118.979 115.414 3.565 17932
551 1 5 . 1 1 41 41 ARG HA H 736 4.111 4.111 4.167 -0.056 17932
552 1 5 . 1 1 41 41 ARG H H 736 7.926 7.926 7.854 0.072 17932
553 1 5 . 1 1 42 42 ALA N N 737 122.585 122.585 118.464 4.121 17932
554 1 5 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.051 0.109 17932
555 1 5 . 1 1 42 42 ALA H H 737 7.944 7.944 9.636 -1.692 17932
556 1 5 . 1 1 43 43 LYS N N 738 118.696 118.696 117.905 0.791 17932
557 1 5 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.815 0.262 17932
558 1 5 . 1 1 43 43 LYS H H 738 7.875 7.875 7.948 -0.073 17932
559 1 5 . 1 1 44 44 TRP N N 739 120.356 120.356 115.688 4.668 17932
560 1 5 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.600 0.031 17932
561 1 5 . 1 1 44 44 TRP H H 739 7.851 7.851 7.241 0.610 17932
562 1 5 . 1 1 45 45 ASP N N 740 121.704 121.704 117.087 4.617 17932
563 1 5 . 1 1 45 45 ASP HA H 740 4.626 4.626 5.058 -0.432 17932
564 1 5 . 1 1 45 45 ASP H H 740 8.186 8.186 8.965 -0.779 17932
565 1 5 . 1 1 46 46 THR N N 741 113.983 113.983 114.586 -0.603 17932
566 1 5 . 1 1 46 46 THR HA H 741 4.579 4.579 4.308 0.271 17932
567 1 5 . 1 1 46 46 THR H H 741 7.981 7.981 8.250 -0.269 17932
568 1 5 . 1 1 47 47 ALA N N 742 124.742 124.742 121.194 3.548 17932
569 1 5 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.290 -0.099 17932
570 1 5 . 1 1 47 47 ALA H H 742 8.158 8.158 8.528 -0.370 17932
571 1 5 . 1 1 48 48 ASN N N 743 116.202 116.202 116.310 -0.108 17932
572 1 5 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.814 -0.214 17932
573 1 5 . 1 1 48 48 ASN H H 743 8.103 8.103 8.424 -0.321 17932
574 1 5 . 1 1 49 49 ASN N N 744 119.857 119.857 119.304 0.553 17932
575 1 5 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.266 -0.380 17932
576 1 5 . 1 1 49 49 ASN H H 744 8.095 8.095 8.199 -0.104 17932
577 1 5 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.464 -0.118 17932
578 1 5 . 1 1 54 54 GLU N N 749 121.972 121.972 119.263 2.709 17932
579 1 5 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.438 -0.264 17932
580 1 5 . 1 1 54 54 GLU H H 749 8.331 8.331 8.245 0.086 17932
581 1 5 . 1 1 55 55 ALA N N 750 125.344 125.344 123.868 1.476 17932
582 1 5 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.507 -0.182 17932
583 1 5 . 1 1 55 55 ALA H H 750 8.406 8.406 7.855 0.551 17932
584 1 5 . 1 1 56 56 THR N N 751 112.838 112.838 115.732 -2.894 17932
585 1 5 . 1 1 56 56 THR HA H 751 4.328 4.328 4.658 -0.330 17932
586 1 5 . 1 1 56 56 THR H H 751 8.089 8.089 8.184 -0.095 17932
587 1 5 . 1 1 57 57 SER N N 752 117.970 117.970 118.599 -0.629 17932
588 1 5 . 1 1 57 57 SER HA H 752 4.490 4.490 4.986 -0.496 17932
589 1 5 . 1 1 57 57 SER H H 752 8.272 8.272 8.553 -0.281 17932
590 1 5 . 1 1 58 58 THR N N 753 115.676 115.676 114.895 0.781 17932
591 1 5 . 1 1 58 58 THR HA H 753 4.333 4.333 4.876 -0.543 17932
592 1 5 . 1 1 58 58 THR H H 753 8.090 8.090 8.154 -0.064 17932
593 1 5 . 1 1 59 59 PHE N N 754 122.160 122.160 124.981 -2.821 17932
594 1 5 . 1 1 59 59 PHE HA H 754 4.713 4.713 4.828 -0.115 17932
595 1 5 . 1 1 59 59 PHE H H 754 8.187 8.187 8.687 -0.500 17932
596 1 5 . 1 1 60 60 THR N N 755 115.583 115.583 112.252 3.331 17932
597 1 5 . 1 1 60 60 THR HA H 755 4.265 4.265 3.396 0.869 17932
598 1 5 . 1 1 60 60 THR H H 755 8.015 8.015 6.973 1.042 17932
599 1 5 . 1 1 61 61 ASN N N 756 121.324 121.324 119.911 1.413 17932
600 1 5 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.720 0.033 17932
601 1 5 . 1 1 61 61 ASN H H 756 8.340 8.340 8.192 0.148 17932
602 1 5 . 1 1 62 62 ILE N N 757 121.251 121.251 115.407 5.844 17932
603 1 5 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.420 -0.244 17932
604 1 5 . 1 1 62 62 ILE H H 757 8.076 8.076 8.057 0.019 17932
605 1 5 . 1 1 63 63 THR N N 758 118.250 118.250 118.594 -0.344 17932
606 1 5 . 1 1 63 63 THR HA H 758 4.264 4.264 4.050 0.214 17932
607 1 5 . 1 1 63 63 THR H H 758 8.140 8.140 7.999 0.141 17932
608 1 5 . 1 1 64 64 TYR N N 759 123.728 123.728 125.513 -1.785 17932
609 1 5 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.359 0.169 17932
610 1 5 . 1 1 64 64 TYR H H 759 8.233 8.233 7.414 0.819 17932
611 1 5 . 1 1 65 65 ARG N N 760 124.423 124.423 121.200 3.223 17932
612 1 5 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.528 -0.287 17932
613 1 5 . 1 1 65 65 ARG H H 760 8.226 8.226 8.782 -0.556 17932
614 1 5 . 1 1 66 66 GLY N N 761 109.761 109.761 109.695 0.066 17932
615 1 5 . 1 1 66 66 GLY H H 761 7.700 7.700 8.304 -0.604 17932
616 1 6 . 1 1 22 22 LEU N N 717 123.186 123.186 121.329 1.857 17932
617 1 6 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.338 -0.038 17932
618 1 6 . 1 1 22 22 LEU H H 717 8.121 8.121 8.159 -0.038 17932
619 1 6 . 1 1 23 23 LEU N N 718 123.575 123.575 116.975 6.600 17932
620 1 6 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.380 -0.030 17932
621 1 6 . 1 1 23 23 LEU H H 718 8.189 8.189 8.075 0.114 17932
622 1 6 . 1 1 24 24 ILE N N 719 121.952 121.952 116.323 5.629 17932
623 1 6 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.093 0.170 17932
624 1 6 . 1 1 24 24 ILE H H 719 8.079 8.079 7.812 0.267 17932
625 1 6 . 1 1 25 25 THR N N 720 118.098 118.098 114.212 3.886 17932
626 1 6 . 1 1 25 25 THR HA H 720 4.359 4.359 4.035 0.324 17932
627 1 6 . 1 1 25 25 THR H H 720 8.296 8.296 7.647 0.649 17932
628 1 6 . 1 1 26 26 ILE N N 721 122.588 122.588 112.399 10.189 17932
629 1 6 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.227 -0.194 17932
630 1 6 . 1 1 26 26 ILE H H 721 8.156 8.156 8.237 -0.081 17932
631 1 6 . 1 1 27 27 HIS N N 722 122.251 122.251 119.213 3.038 17932
632 1 6 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.434 0.127 17932
633 1 6 . 1 1 27 27 HIS H H 722 8.346 8.346 7.976 0.370 17932
634 1 6 . 1 1 28 28 ASP N N 723 120.954 120.954 121.001 -0.047 17932
635 1 6 . 1 1 28 28 ASP HA H 723 4.552 4.552 4.172 0.380 17932
636 1 6 . 1 1 28 28 ASP H H 723 8.155 8.155 8.252 -0.097 17932
637 1 6 . 1 1 29 29 ARG N N 724 121.468 121.468 118.873 2.595 17932
638 1 6 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.253 -0.067 17932
639 1 6 . 1 1 29 29 ARG H H 724 8.322 8.322 8.249 0.073 17932
640 1 6 . 1 1 30 30 LYS N N 725 121.800 121.800 118.084 3.716 17932
641 1 6 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.197 -0.024 17932
642 1 6 . 1 1 30 30 LYS H H 725 8.382 8.382 7.536 0.846 17932
643 1 6 . 1 1 31 31 GLU N N 726 120.681 120.681 119.930 0.751 17932
644 1 6 . 1 1 31 31 GLU HA H 726 4.145 4.145 4.195 -0.050 17932
645 1 6 . 1 1 31 31 GLU H H 726 8.323 8.323 7.711 0.612 17932
646 1 6 . 1 1 32 32 PHE N N 727 120.355 120.355 116.871 3.484 17932
647 1 6 . 1 1 32 32 PHE HA H 727 4.486 4.486 4.386 0.101 17932
648 1 6 . 1 1 32 32 PHE H H 727 8.151 8.151 7.131 1.020 17932
649 1 6 . 1 1 33 33 ALA N N 728 123.526 123.526 120.744 2.782 17932
650 1 6 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.174 0.016 17932
651 1 6 . 1 1 33 33 ALA H H 728 8.114 8.114 7.323 0.791 17932
652 1 6 . 1 1 34 34 LYS N N 729 119.476 119.476 117.083 2.393 17932
653 1 6 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.403 -0.252 17932
654 1 6 . 1 1 34 34 LYS H H 729 7.957 7.957 7.931 0.026 17932
655 1 6 . 1 1 35 35 PHE N N 730 120.504 120.504 113.052 7.452 17932
656 1 6 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.415 0.036 17932
657 1 6 . 1 1 35 35 PHE H H 730 8.040 8.040 7.284 0.756 17932
658 1 6 . 1 1 36 36 GLU N N 731 120.883 120.883 116.004 4.879 17932
659 1 6 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.173 0.858 17932
660 1 6 . 1 1 36 36 GLU H H 731 8.281 8.281 8.491 -0.210 17932
661 1 6 . 1 1 37 37 GLU N N 732 120.686 120.686 119.478 1.208 17932
662 1 6 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.293 -0.254 17932
663 1 6 . 1 1 37 37 GLU H H 732 8.222 8.222 8.018 0.204 17932
664 1 6 . 1 1 38 38 GLU N N 733 121.278 121.278 116.737 4.541 17932
665 1 6 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.590 -0.510 17932
666 1 6 . 1 1 38 38 GLU H H 733 8.202 8.202 8.591 -0.389 17932
667 1 6 . 1 1 39 39 ARG N N 734 120.498 120.498 118.529 1.969 17932
668 1 6 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.209 -0.167 17932
669 1 6 . 1 1 39 39 ARG H H 734 8.102 8.102 9.234 -1.132 17932
670 1 6 . 1 1 40 40 ALA N N 735 123.267 123.267 118.359 4.908 17932
671 1 6 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.341 -0.181 17932
672 1 6 . 1 1 40 40 ALA H H 735 7.934 7.934 7.541 0.393 17932
673 1 6 . 1 1 41 41 ARG N N 736 118.979 118.979 115.934 3.045 17932
674 1 6 . 1 1 41 41 ARG HA H 736 4.111 4.111 3.924 0.187 17932
675 1 6 . 1 1 41 41 ARG H H 736 7.926 7.926 7.715 0.211 17932
676 1 6 . 1 1 42 42 ALA N N 737 122.585 122.585 117.013 5.572 17932
677 1 6 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.160 0.000 17932
678 1 6 . 1 1 42 42 ALA H H 737 7.944 7.944 9.452 -1.508 17932
679 1 6 . 1 1 43 43 LYS N N 738 118.696 118.696 117.924 0.772 17932
680 1 6 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.748 0.329 17932
681 1 6 . 1 1 43 43 LYS H H 738 7.875 7.875 7.979 -0.104 17932
682 1 6 . 1 1 44 44 TRP N N 739 120.356 120.356 115.745 4.611 17932
683 1 6 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.592 0.039 17932
684 1 6 . 1 1 44 44 TRP H H 739 7.851 7.851 7.133 0.718 17932
685 1 6 . 1 1 45 45 ASP N N 740 121.704 121.704 117.010 4.694 17932
686 1 6 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.919 -0.293 17932
687 1 6 . 1 1 45 45 ASP H H 740 8.186 8.186 8.996 -0.810 17932
688 1 6 . 1 1 46 46 THR N N 741 113.983 113.983 114.394 -0.411 17932
689 1 6 . 1 1 46 46 THR HA H 741 4.579 4.579 4.339 0.240 17932
690 1 6 . 1 1 46 46 THR H H 741 7.981 7.981 8.708 -0.727 17932
691 1 6 . 1 1 47 47 ALA N N 742 124.742 124.742 121.407 3.335 17932
692 1 6 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.616 -0.425 17932
693 1 6 . 1 1 47 47 ALA H H 742 8.158 8.158 8.006 0.152 17932
694 1 6 . 1 1 48 48 ASN N N 743 116.202 116.202 116.534 -0.332 17932
695 1 6 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.804 -0.204 17932
696 1 6 . 1 1 48 48 ASN H H 743 8.103 8.103 8.325 -0.222 17932
697 1 6 . 1 1 49 49 ASN N N 744 119.857 119.857 119.221 0.636 17932
698 1 6 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.122 -0.236 17932
699 1 6 . 1 1 49 49 ASN H H 744 8.095 8.095 8.713 -0.618 17932
700 1 6 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.393 -0.047 17932
701 1 6 . 1 1 54 54 GLU N N 749 121.972 121.972 120.139 1.833 17932
702 1 6 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.485 -0.311 17932
703 1 6 . 1 1 54 54 GLU H H 749 8.331 8.331 8.573 -0.242 17932
704 1 6 . 1 1 55 55 ALA N N 750 125.344 125.344 125.005 0.339 17932
705 1 6 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.712 -0.387 17932
706 1 6 . 1 1 55 55 ALA H H 750 8.406 8.406 7.818 0.588 17932
707 1 6 . 1 1 56 56 THR N N 751 112.838 112.838 117.241 -4.403 17932
708 1 6 . 1 1 56 56 THR HA H 751 4.328 4.328 4.627 -0.299 17932
709 1 6 . 1 1 56 56 THR H H 751 8.089 8.089 8.090 -0.001 17932
710 1 6 . 1 1 57 57 SER N N 752 117.970 117.970 120.016 -2.046 17932
711 1 6 . 1 1 57 57 SER HA H 752 4.490 4.490 4.951 -0.461 17932
712 1 6 . 1 1 57 57 SER H H 752 8.272 8.272 8.744 -0.472 17932
713 1 6 . 1 1 58 58 THR N N 753 115.676 115.676 115.014 0.662 17932
714 1 6 . 1 1 58 58 THR HA H 753 4.333 4.333 5.644 -1.311 17932
715 1 6 . 1 1 58 58 THR H H 753 8.090 8.090 8.043 0.047 17932
716 1 6 . 1 1 59 59 PHE N N 754 122.160 122.160 120.527 1.633 17932
717 1 6 . 1 1 59 59 PHE HA H 754 4.713 4.713 5.134 -0.421 17932
718 1 6 . 1 1 59 59 PHE H H 754 8.187 8.187 9.784 -1.597 17932
719 1 6 . 1 1 60 60 THR N N 755 115.583 115.583 116.066 -0.483 17932
720 1 6 . 1 1 60 60 THR HA H 755 4.265 4.265 3.629 0.636 17932
721 1 6 . 1 1 60 60 THR H H 755 8.015 8.015 7.344 0.671 17932
722 1 6 . 1 1 61 61 ASN N N 756 121.324 121.324 115.564 5.760 17932
723 1 6 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.597 0.156 17932
724 1 6 . 1 1 61 61 ASN H H 756 8.340 8.340 8.199 0.141 17932
725 1 6 . 1 1 62 62 ILE N N 757 121.251 121.251 114.492 6.759 17932
726 1 6 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.056 0.120 17932
727 1 6 . 1 1 62 62 ILE H H 757 8.076 8.076 7.749 0.327 17932
728 1 6 . 1 1 63 63 THR N N 758 118.250 118.250 117.340 0.910 17932
729 1 6 . 1 1 63 63 THR HA H 758 4.264 4.264 4.282 -0.018 17932
730 1 6 . 1 1 63 63 THR H H 758 8.140 8.140 7.880 0.260 17932
731 1 6 . 1 1 64 64 TYR N N 759 123.728 123.728 123.939 -0.211 17932
732 1 6 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.788 -0.260 17932
733 1 6 . 1 1 64 64 TYR H H 759 8.233 8.233 6.920 1.313 17932
734 1 6 . 1 1 65 65 ARG N N 760 124.423 124.423 120.246 4.177 17932
735 1 6 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.471 -0.230 17932
736 1 6 . 1 1 65 65 ARG H H 760 8.226 8.226 8.361 -0.135 17932
737 1 6 . 1 1 66 66 GLY N N 761 109.761 109.761 110.200 -0.439 17932
738 1 6 . 1 1 66 66 GLY H H 761 7.700 7.700 8.083 -0.383 17932
739 1 7 . 1 1 22 22 LEU N N 717 123.186 123.186 121.017 2.169 17932
740 1 7 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.528 -0.228 17932
741 1 7 . 1 1 22 22 LEU H H 717 8.121 8.121 7.839 0.282 17932
742 1 7 . 1 1 23 23 LEU N N 718 123.575 123.575 116.489 7.086 17932
743 1 7 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.543 -0.193 17932
744 1 7 . 1 1 23 23 LEU H H 718 8.189 8.189 7.713 0.476 17932
745 1 7 . 1 1 24 24 ILE N N 719 121.952 121.952 113.040 8.912 17932
746 1 7 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.087 0.176 17932
747 1 7 . 1 1 24 24 ILE H H 719 8.079 8.079 7.968 0.111 17932
748 1 7 . 1 1 25 25 THR N N 720 118.098 118.098 114.660 3.438 17932
749 1 7 . 1 1 25 25 THR HA H 720 4.359 4.359 3.862 0.497 17932
750 1 7 . 1 1 25 25 THR H H 720 8.296 8.296 7.925 0.371 17932
751 1 7 . 1 1 26 26 ILE N N 721 122.588 122.588 113.355 9.233 17932
752 1 7 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.177 -0.144 17932
753 1 7 . 1 1 26 26 ILE H H 721 8.156 8.156 7.636 0.520 17932
754 1 7 . 1 1 27 27 HIS N N 722 122.251 122.251 117.711 4.540 17932
755 1 7 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.628 -0.067 17932
756 1 7 . 1 1 27 27 HIS H H 722 8.346 8.346 7.855 0.491 17932
757 1 7 . 1 1 28 28 ASP N N 723 120.954 120.954 120.820 0.134 17932
758 1 7 . 1 1 28 28 ASP HA H 723 4.552 4.552 2.657 1.895 17932
759 1 7 . 1 1 28 28 ASP H H 723 8.155 8.155 8.428 -0.273 17932
760 1 7 . 1 1 29 29 ARG N N 724 121.468 121.468 116.987 4.481 17932
761 1 7 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.367 -0.181 17932
762 1 7 . 1 1 29 29 ARG H H 724 8.322 8.322 7.951 0.371 17932
763 1 7 . 1 1 30 30 LYS N N 725 121.800 121.800 120.077 1.723 17932
764 1 7 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.101 0.072 17932
765 1 7 . 1 1 30 30 LYS H H 725 8.382 8.382 7.775 0.607 17932
766 1 7 . 1 1 31 31 GLU N N 726 120.681 120.681 117.109 3.572 17932
767 1 7 . 1 1 31 31 GLU HA H 726 4.145 4.145 4.382 -0.237 17932
768 1 7 . 1 1 31 31 GLU H H 726 8.323 8.323 7.659 0.664 17932
769 1 7 . 1 1 32 32 PHE N N 727 120.355 120.355 116.259 4.096 17932
770 1 7 . 1 1 32 32 PHE HA H 727 4.486 4.486 4.012 0.474 17932
771 1 7 . 1 1 32 32 PHE H H 727 8.151 8.151 6.904 1.247 17932
772 1 7 . 1 1 33 33 ALA N N 728 123.526 123.526 121.101 2.425 17932
773 1 7 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.224 -0.034 17932
774 1 7 . 1 1 33 33 ALA H H 728 8.114 8.114 7.250 0.864 17932
775 1 7 . 1 1 34 34 LYS N N 729 119.476 119.476 116.729 2.747 17932
776 1 7 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.481 -0.330 17932
777 1 7 . 1 1 34 34 LYS H H 729 7.957 7.957 7.339 0.618 17932
778 1 7 . 1 1 35 35 PHE N N 730 120.504 120.504 114.036 6.468 17932
779 1 7 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.412 0.039 17932
780 1 7 . 1 1 35 35 PHE H H 730 8.040 8.040 7.620 0.420 17932
781 1 7 . 1 1 36 36 GLU N N 731 120.883 120.883 116.033 4.850 17932
782 1 7 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.356 0.675 17932
783 1 7 . 1 1 36 36 GLU H H 731 8.281 8.281 8.447 -0.166 17932
784 1 7 . 1 1 37 37 GLU N N 732 120.686 120.686 119.620 1.066 17932
785 1 7 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.150 -0.111 17932
786 1 7 . 1 1 37 37 GLU H H 732 8.222 8.222 8.133 0.089 17932
787 1 7 . 1 1 38 38 GLU N N 733 121.278 121.278 118.643 2.635 17932
788 1 7 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.699 -0.619 17932
789 1 7 . 1 1 38 38 GLU H H 733 8.202 8.202 8.473 -0.271 17932
790 1 7 . 1 1 39 39 ARG N N 734 120.498 120.498 120.513 -0.015 17932
791 1 7 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.290 -0.248 17932
792 1 7 . 1 1 39 39 ARG H H 734 8.102 8.102 9.110 -1.008 17932
793 1 7 . 1 1 40 40 ALA N N 735 123.267 123.267 119.151 4.116 17932
794 1 7 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.420 -0.260 17932
795 1 7 . 1 1 40 40 ALA H H 735 7.934 7.934 7.525 0.409 17932
796 1 7 . 1 1 41 41 ARG N N 736 118.979 118.979 117.738 1.241 17932
797 1 7 . 1 1 41 41 ARG HA H 736 4.111 4.111 4.037 0.074 17932
798 1 7 . 1 1 41 41 ARG H H 736 7.926 7.926 7.775 0.151 17932
799 1 7 . 1 1 42 42 ALA N N 737 122.585 122.585 117.531 5.054 17932
800 1 7 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.160 -0.000 17932
801 1 7 . 1 1 42 42 ALA H H 737 7.944 7.944 9.421 -1.477 17932
802 1 7 . 1 1 43 43 LYS N N 738 118.696 118.696 117.592 1.104 17932
803 1 7 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.753 0.324 17932
804 1 7 . 1 1 43 43 LYS H H 738 7.875 7.875 7.780 0.095 17932
805 1 7 . 1 1 44 44 TRP N N 739 120.356 120.356 115.146 5.210 17932
806 1 7 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.578 0.053 17932
807 1 7 . 1 1 44 44 TRP H H 739 7.851 7.851 6.939 0.912 17932
808 1 7 . 1 1 45 45 ASP N N 740 121.704 121.704 117.942 3.762 17932
809 1 7 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.810 -0.184 17932
810 1 7 . 1 1 45 45 ASP H H 740 8.186 8.186 9.096 -0.910 17932
811 1 7 . 1 1 46 46 THR N N 741 113.983 113.983 118.396 -4.413 17932
812 1 7 . 1 1 46 46 THR HA H 741 4.579 4.579 4.549 0.030 17932
813 1 7 . 1 1 46 46 THR H H 741 7.981 7.981 8.860 -0.879 17932
814 1 7 . 1 1 47 47 ALA N N 742 124.742 124.742 122.305 2.437 17932
815 1 7 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.694 -0.503 17932
816 1 7 . 1 1 47 47 ALA H H 742 8.158 8.158 8.198 -0.040 17932
817 1 7 . 1 1 48 48 ASN N N 743 116.202 116.202 117.361 -1.159 17932
818 1 7 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.682 -0.082 17932
819 1 7 . 1 1 48 48 ASN H H 743 8.103 8.103 8.809 -0.706 17932
820 1 7 . 1 1 49 49 ASN N N 744 119.857 119.857 118.124 1.733 17932
821 1 7 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.101 -0.215 17932
822 1 7 . 1 1 49 49 ASN H H 744 8.095 8.095 8.705 -0.610 17932
823 1 7 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.376 -0.030 17932
824 1 7 . 1 1 54 54 GLU N N 749 121.972 121.972 119.549 2.423 17932
825 1 7 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.448 -0.274 17932
826 1 7 . 1 1 54 54 GLU H H 749 8.331 8.331 8.778 -0.447 17932
827 1 7 . 1 1 55 55 ALA N N 750 125.344 125.344 125.529 -0.185 17932
828 1 7 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.749 -0.424 17932
829 1 7 . 1 1 55 55 ALA H H 750 8.406 8.406 8.000 0.406 17932
830 1 7 . 1 1 56 56 THR N N 751 112.838 112.838 116.802 -3.964 17932
831 1 7 . 1 1 56 56 THR HA H 751 4.328 4.328 4.671 -0.343 17932
832 1 7 . 1 1 56 56 THR H H 751 8.089 8.089 8.147 -0.058 17932
833 1 7 . 1 1 57 57 SER N N 752 117.970 117.970 117.662 0.308 17932
834 1 7 . 1 1 57 57 SER HA H 752 4.490 4.490 4.817 -0.327 17932
835 1 7 . 1 1 57 57 SER H H 752 8.272 8.272 8.599 -0.327 17932
836 1 7 . 1 1 58 58 THR N N 753 115.676 115.676 120.284 -4.608 17932
837 1 7 . 1 1 58 58 THR HA H 753 4.333 4.333 4.857 -0.524 17932
838 1 7 . 1 1 58 58 THR H H 753 8.090 8.090 8.361 -0.271 17932
839 1 7 . 1 1 59 59 PHE N N 754 122.160 122.160 124.169 -2.009 17932
840 1 7 . 1 1 59 59 PHE HA H 754 4.713 4.713 5.066 -0.353 17932
841 1 7 . 1 1 59 59 PHE H H 754 8.187 8.187 8.481 -0.294 17932
842 1 7 . 1 1 60 60 THR N N 755 115.583 115.583 113.641 1.942 17932
843 1 7 . 1 1 60 60 THR HA H 755 4.265 4.265 3.917 0.348 17932
844 1 7 . 1 1 60 60 THR H H 755 8.015 8.015 7.448 0.567 17932
845 1 7 . 1 1 61 61 ASN N N 756 121.324 121.324 116.958 4.366 17932
846 1 7 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.192 0.561 17932
847 1 7 . 1 1 61 61 ASN H H 756 8.340 8.340 7.662 0.678 17932
848 1 7 . 1 1 62 62 ILE N N 757 121.251 121.251 118.035 3.216 17932
849 1 7 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.482 -0.306 17932
850 1 7 . 1 1 62 62 ILE H H 757 8.076 8.076 7.827 0.249 17932
851 1 7 . 1 1 63 63 THR N N 758 118.250 118.250 120.078 -1.828 17932
852 1 7 . 1 1 63 63 THR HA H 758 4.264 4.264 4.620 -0.356 17932
853 1 7 . 1 1 63 63 THR H H 758 8.140 8.140 8.815 -0.675 17932
854 1 7 . 1 1 64 64 TYR N N 759 123.728 123.728 124.432 -0.704 17932
855 1 7 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.858 -0.330 17932
856 1 7 . 1 1 64 64 TYR H H 759 8.233 8.233 8.488 -0.255 17932
857 1 7 . 1 1 65 65 ARG N N 760 124.423 124.423 119.725 4.698 17932
858 1 7 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.540 -0.299 17932
859 1 7 . 1 1 65 65 ARG H H 760 8.226 8.226 7.552 0.674 17932
860 1 7 . 1 1 66 66 GLY N N 761 109.761 109.761 111.176 -1.415 17932
861 1 7 . 1 1 66 66 GLY H H 761 7.700 7.700 7.840 -0.140 17932
862 1 8 . 1 1 22 22 LEU N N 717 123.186 123.186 121.821 1.365 17932
863 1 8 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.569 -0.269 17932
864 1 8 . 1 1 22 22 LEU H H 717 8.121 8.121 8.884 -0.763 17932
865 1 8 . 1 1 23 23 LEU N N 718 123.575 123.575 117.655 5.920 17932
866 1 8 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.470 -0.120 17932
867 1 8 . 1 1 23 23 LEU H H 718 8.189 8.189 8.022 0.167 17932
868 1 8 . 1 1 24 24 ILE N N 719 121.952 121.952 113.507 8.445 17932
869 1 8 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.243 0.020 17932
870 1 8 . 1 1 24 24 ILE H H 719 8.079 8.079 7.680 0.399 17932
871 1 8 . 1 1 25 25 THR N N 720 118.098 118.098 112.448 5.650 17932
872 1 8 . 1 1 25 25 THR HA H 720 4.359 4.359 3.924 0.435 17932
873 1 8 . 1 1 25 25 THR H H 720 8.296 8.296 7.761 0.535 17932
874 1 8 . 1 1 26 26 ILE N N 721 122.588 122.588 112.769 9.819 17932
875 1 8 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.233 -0.200 17932
876 1 8 . 1 1 26 26 ILE H H 721 8.156 8.156 7.426 0.730 17932
877 1 8 . 1 1 27 27 HIS N N 722 122.251 122.251 118.382 3.869 17932
878 1 8 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.634 -0.073 17932
879 1 8 . 1 1 27 27 HIS H H 722 8.346 8.346 8.241 0.105 17932
880 1 8 . 1 1 28 28 ASP N N 723 120.954 120.954 120.891 0.063 17932
881 1 8 . 1 1 28 28 ASP HA H 723 4.552 4.552 3.802 0.750 17932
882 1 8 . 1 1 28 28 ASP H H 723 8.155 8.155 8.299 -0.144 17932
883 1 8 . 1 1 29 29 ARG N N 724 121.468 121.468 117.773 3.695 17932
884 1 8 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.166 0.020 17932
885 1 8 . 1 1 29 29 ARG H H 724 8.322 8.322 8.095 0.227 17932
886 1 8 . 1 1 30 30 LYS N N 725 121.800 121.800 118.072 3.728 17932
887 1 8 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.173 0.000 17932
888 1 8 . 1 1 30 30 LYS H H 725 8.382 8.382 7.241 1.141 17932
889 1 8 . 1 1 31 31 GLU N N 726 120.681 120.681 118.258 2.423 17932
890 1 8 . 1 1 31 31 GLU HA H 726 4.145 4.145 4.371 -0.226 17932
891 1 8 . 1 1 31 31 GLU H H 726 8.323 8.323 7.715 0.608 17932
892 1 8 . 1 1 32 32 PHE N N 727 120.355 120.355 116.283 4.072 17932
893 1 8 . 1 1 32 32 PHE HA H 727 4.486 4.486 3.664 0.822 17932
894 1 8 . 1 1 32 32 PHE H H 727 8.151 8.151 6.794 1.357 17932
895 1 8 . 1 1 33 33 ALA N N 728 123.526 123.526 122.027 1.499 17932
896 1 8 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.202 -0.012 17932
897 1 8 . 1 1 33 33 ALA H H 728 8.114 8.114 7.178 0.936 17932
898 1 8 . 1 1 34 34 LYS N N 729 119.476 119.476 115.961 3.515 17932
899 1 8 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.536 -0.385 17932
900 1 8 . 1 1 34 34 LYS H H 729 7.957 7.957 7.435 0.522 17932
901 1 8 . 1 1 35 35 PHE N N 730 120.504 120.504 115.894 4.610 17932
902 1 8 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.193 0.258 17932
903 1 8 . 1 1 35 35 PHE H H 730 8.040 8.040 7.581 0.459 17932
904 1 8 . 1 1 36 36 GLU N N 731 120.883 120.883 116.617 4.266 17932
905 1 8 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.475 0.556 17932
906 1 8 . 1 1 36 36 GLU H H 731 8.281 8.281 8.207 0.074 17932
907 1 8 . 1 1 37 37 GLU N N 732 120.686 120.686 119.372 1.314 17932
908 1 8 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.148 -0.109 17932
909 1 8 . 1 1 37 37 GLU H H 732 8.222 8.222 8.012 0.210 17932
910 1 8 . 1 1 38 38 GLU N N 733 121.278 121.278 118.786 2.492 17932
911 1 8 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.681 -0.601 17932
912 1 8 . 1 1 38 38 GLU H H 733 8.202 8.202 8.483 -0.281 17932
913 1 8 . 1 1 39 39 ARG N N 734 120.498 120.498 120.471 0.027 17932
914 1 8 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.172 -0.130 17932
915 1 8 . 1 1 39 39 ARG H H 734 8.102 8.102 9.119 -1.017 17932
916 1 8 . 1 1 40 40 ALA N N 735 123.267 123.267 118.709 4.558 17932
917 1 8 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.337 -0.177 17932
918 1 8 . 1 1 40 40 ALA H H 735 7.934 7.934 8.296 -0.362 17932
919 1 8 . 1 1 41 41 ARG N N 736 118.979 118.979 115.786 3.193 17932
920 1 8 . 1 1 41 41 ARG HA H 736 4.111 4.111 3.938 0.173 17932
921 1 8 . 1 1 41 41 ARG H H 736 7.926 7.926 7.944 -0.018 17932
922 1 8 . 1 1 42 42 ALA N N 737 122.585 122.585 122.929 -0.344 17932
923 1 8 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.022 0.138 17932
924 1 8 . 1 1 42 42 ALA H H 737 7.944 7.944 9.658 -1.714 17932
925 1 8 . 1 1 43 43 LYS N N 738 118.696 118.696 119.328 -0.632 17932
926 1 8 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.624 0.453 17932
927 1 8 . 1 1 43 43 LYS H H 738 7.875 7.875 8.270 -0.395 17932
928 1 8 . 1 1 44 44 TRP N N 739 120.356 120.356 115.553 4.803 17932
929 1 8 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.686 -0.055 17932
930 1 8 . 1 1 44 44 TRP H H 739 7.851 7.851 6.968 0.883 17932
931 1 8 . 1 1 45 45 ASP N N 740 121.704 121.704 117.980 3.724 17932
932 1 8 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.631 -0.005 17932
933 1 8 . 1 1 45 45 ASP H H 740 8.186 8.186 9.299 -1.113 17932
934 1 8 . 1 1 46 46 THR N N 741 113.983 113.983 112.692 1.291 17932
935 1 8 . 1 1 46 46 THR HA H 741 4.579 4.579 4.185 0.394 17932
936 1 8 . 1 1 46 46 THR H H 741 7.981 7.981 8.865 -0.884 17932
937 1 8 . 1 1 47 47 ALA N N 742 124.742 124.742 120.730 4.012 17932
938 1 8 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.372 -0.181 17932
939 1 8 . 1 1 47 47 ALA H H 742 8.158 8.158 8.347 -0.189 17932
940 1 8 . 1 1 48 48 ASN N N 743 116.202 116.202 116.779 -0.577 17932
941 1 8 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.826 -0.226 17932
942 1 8 . 1 1 48 48 ASN H H 743 8.103 8.103 8.421 -0.318 17932
943 1 8 . 1 1 49 49 ASN N N 744 119.857 119.857 118.950 0.907 17932
944 1 8 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.208 -0.322 17932
945 1 8 . 1 1 49 49 ASN H H 744 8.095 8.095 8.324 -0.229 17932
946 1 8 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.454 -0.108 17932
947 1 8 . 1 1 54 54 GLU N N 749 121.972 121.972 120.695 1.277 17932
948 1 8 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.387 -0.213 17932
949 1 8 . 1 1 54 54 GLU H H 749 8.331 8.331 8.637 -0.306 17932
950 1 8 . 1 1 55 55 ALA N N 750 125.344 125.344 121.025 4.319 17932
951 1 8 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.630 -0.305 17932
952 1 8 . 1 1 55 55 ALA H H 750 8.406 8.406 7.867 0.539 17932
953 1 8 . 1 1 56 56 THR N N 751 112.838 112.838 114.607 -1.769 17932
954 1 8 . 1 1 56 56 THR HA H 751 4.328 4.328 4.814 -0.486 17932
955 1 8 . 1 1 56 56 THR H H 751 8.089 8.089 8.418 -0.329 17932
956 1 8 . 1 1 57 57 SER N N 752 117.970 117.970 119.906 -1.936 17932
957 1 8 . 1 1 57 57 SER HA H 752 4.490 4.490 4.595 -0.105 17932
958 1 8 . 1 1 57 57 SER H H 752 8.272 8.272 9.500 -1.228 17932
959 1 8 . 1 1 58 58 THR N N 753 115.676 115.676 111.614 4.062 17932
960 1 8 . 1 1 58 58 THR HA H 753 4.333 4.333 4.852 -0.519 17932
961 1 8 . 1 1 58 58 THR H H 753 8.090 8.090 7.672 0.418 17932
962 1 8 . 1 1 59 59 PHE N N 754 122.160 122.160 117.458 4.702 17932
963 1 8 . 1 1 59 59 PHE HA H 754 4.713 4.713 4.925 -0.212 17932
964 1 8 . 1 1 59 59 PHE H H 754 8.187 8.187 8.545 -0.358 17932
965 1 8 . 1 1 60 60 THR N N 755 115.583 115.583 112.958 2.625 17932
966 1 8 . 1 1 60 60 THR HA H 755 4.265 4.265 4.022 0.243 17932
967 1 8 . 1 1 60 60 THR H H 755 8.015 8.015 7.705 0.310 17932
968 1 8 . 1 1 61 61 ASN N N 756 121.324 121.324 116.894 4.430 17932
969 1 8 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.985 -0.232 17932
970 1 8 . 1 1 61 61 ASN H H 756 8.340 8.340 7.877 0.463 17932
971 1 8 . 1 1 62 62 ILE N N 757 121.251 121.251 116.128 5.123 17932
972 1 8 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.825 -0.649 17932
973 1 8 . 1 1 62 62 ILE H H 757 8.076 8.076 8.379 -0.303 17932
974 1 8 . 1 1 63 63 THR N N 758 118.250 118.250 112.927 5.323 17932
975 1 8 . 1 1 63 63 THR HA H 758 4.264 4.264 4.228 0.036 17932
976 1 8 . 1 1 63 63 THR H H 758 8.140 8.140 8.173 -0.033 17932
977 1 8 . 1 1 64 64 TYR N N 759 123.728 123.728 121.574 2.154 17932
978 1 8 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.108 0.420 17932
979 1 8 . 1 1 64 64 TYR H H 759 8.233 8.233 8.179 0.054 17932
980 1 8 . 1 1 65 65 ARG N N 760 124.423 124.423 118.661 5.762 17932
981 1 8 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.325 -0.084 17932
982 1 8 . 1 1 65 65 ARG H H 760 8.226 8.226 7.106 1.120 17932
983 1 8 . 1 1 66 66 GLY N N 761 109.761 109.761 107.769 1.992 17932
984 1 8 . 1 1 66 66 GLY H H 761 7.700 7.700 7.243 0.457 17932
985 1 9 . 1 1 22 22 LEU N N 717 123.186 123.186 119.813 3.373 17932
986 1 9 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.324 -0.024 17932
987 1 9 . 1 1 22 22 LEU H H 717 8.121 8.121 8.338 -0.217 17932
988 1 9 . 1 1 23 23 LEU N N 718 123.575 123.575 113.895 9.680 17932
989 1 9 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.559 -0.209 17932
990 1 9 . 1 1 23 23 LEU H H 718 8.189 8.189 8.889 -0.700 17932
991 1 9 . 1 1 24 24 ILE N N 719 121.952 121.952 115.052 6.900 17932
992 1 9 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.221 0.042 17932
993 1 9 . 1 1 24 24 ILE H H 719 8.079 8.079 8.357 -0.278 17932
994 1 9 . 1 1 25 25 THR N N 720 118.098 118.098 113.982 4.116 17932
995 1 9 . 1 1 25 25 THR HA H 720 4.359 4.359 3.890 0.469 17932
996 1 9 . 1 1 25 25 THR H H 720 8.296 8.296 8.631 -0.335 17932
997 1 9 . 1 1 26 26 ILE N N 721 122.588 122.588 114.677 7.911 17932
998 1 9 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.303 -0.270 17932
999 1 9 . 1 1 26 26 ILE H H 721 8.156 8.156 7.746 0.410 17932
1000 1 9 . 1 1 27 27 HIS N N 722 122.251 122.251 117.302 4.949 17932
1001 1 9 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.744 -0.183 17932
1002 1 9 . 1 1 27 27 HIS H H 722 8.346 8.346 7.968 0.378 17932
1003 1 9 . 1 1 28 28 ASP N N 723 120.954 120.954 119.639 1.315 17932
1004 1 9 . 1 1 28 28 ASP HA H 723 4.552 4.552 2.489 2.063 17932
1005 1 9 . 1 1 28 28 ASP H H 723 8.155 8.155 8.294 -0.139 17932
1006 1 9 . 1 1 29 29 ARG N N 724 121.468 121.468 115.799 5.669 17932
1007 1 9 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.656 -0.470 17932
1008 1 9 . 1 1 29 29 ARG H H 724 8.322 8.322 8.171 0.151 17932
1009 1 9 . 1 1 30 30 LYS N N 725 121.800 121.800 121.281 0.519 17932
1010 1 9 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.059 0.114 17932
1011 1 9 . 1 1 30 30 LYS H H 725 8.382 8.382 8.113 0.269 17932
1012 1 9 . 1 1 31 31 GLU N N 726 120.681 120.681 116.753 3.928 17932
1013 1 9 . 1 1 31 31 GLU HA H 726 4.145 4.145 4.304 -0.159 17932
1014 1 9 . 1 1 31 31 GLU H H 726 8.323 8.323 7.708 0.615 17932
1015 1 9 . 1 1 32 32 PHE N N 727 120.355 120.355 116.616 3.739 17932
1016 1 9 . 1 1 32 32 PHE HA H 727 4.486 4.486 3.865 0.621 17932
1017 1 9 . 1 1 32 32 PHE H H 727 8.151 8.151 7.276 0.875 17932
1018 1 9 . 1 1 33 33 ALA N N 728 123.526 123.526 120.867 2.659 17932
1019 1 9 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.300 -0.110 17932
1020 1 9 . 1 1 33 33 ALA H H 728 8.114 8.114 7.509 0.605 17932
1021 1 9 . 1 1 34 34 LYS N N 729 119.476 119.476 116.596 2.880 17932
1022 1 9 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.396 -0.245 17932
1023 1 9 . 1 1 34 34 LYS H H 729 7.957 7.957 7.329 0.628 17932
1024 1 9 . 1 1 35 35 PHE N N 730 120.504 120.504 114.373 6.131 17932
1025 1 9 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.122 0.329 17932
1026 1 9 . 1 1 35 35 PHE H H 730 8.040 8.040 7.503 0.537 17932
1027 1 9 . 1 1 36 36 GLU N N 731 120.883 120.883 116.282 4.601 17932
1028 1 9 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.536 0.495 17932
1029 1 9 . 1 1 36 36 GLU H H 731 8.281 8.281 8.385 -0.104 17932
1030 1 9 . 1 1 37 37 GLU N N 732 120.686 120.686 118.999 1.687 17932
1031 1 9 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.231 -0.192 17932
1032 1 9 . 1 1 37 37 GLU H H 732 8.222 8.222 8.015 0.207 17932
1033 1 9 . 1 1 38 38 GLU N N 733 121.278 121.278 118.657 2.621 17932
1034 1 9 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.615 -0.535 17932
1035 1 9 . 1 1 38 38 GLU H H 733 8.202 8.202 8.299 -0.097 17932
1036 1 9 . 1 1 39 39 ARG N N 734 120.498 120.498 122.653 -2.155 17932
1037 1 9 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.369 -0.327 17932
1038 1 9 . 1 1 39 39 ARG H H 734 8.102 8.102 8.948 -0.846 17932
1039 1 9 . 1 1 40 40 ALA N N 735 123.267 123.267 120.196 3.071 17932
1040 1 9 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.395 -0.235 17932
1041 1 9 . 1 1 40 40 ALA H H 735 7.934 7.934 7.738 0.196 17932
1042 1 9 . 1 1 41 41 ARG N N 736 118.979 118.979 116.444 2.535 17932
1043 1 9 . 1 1 41 41 ARG HA H 736 4.111 4.111 4.011 0.100 17932
1044 1 9 . 1 1 41 41 ARG H H 736 7.926 7.926 7.963 -0.037 17932
1045 1 9 . 1 1 42 42 ALA N N 737 122.585 122.585 117.509 5.076 17932
1046 1 9 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.003 0.157 17932
1047 1 9 . 1 1 42 42 ALA H H 737 7.944 7.944 9.001 -1.057 17932
1048 1 9 . 1 1 43 43 LYS N N 738 118.696 118.696 118.178 0.518 17932
1049 1 9 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.742 0.335 17932
1050 1 9 . 1 1 43 43 LYS H H 738 7.875 7.875 6.940 0.935 17932
1051 1 9 . 1 1 44 44 TRP N N 739 120.356 120.356 116.298 4.058 17932
1052 1 9 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.536 0.095 17932
1053 1 9 . 1 1 44 44 TRP H H 739 7.851 7.851 6.962 0.889 17932
1054 1 9 . 1 1 45 45 ASP N N 740 121.704 121.704 115.526 6.178 17932
1055 1 9 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.329 0.297 17932
1056 1 9 . 1 1 45 45 ASP H H 740 8.186 8.186 9.207 -1.021 17932
1057 1 9 . 1 1 46 46 THR N N 741 113.983 113.983 109.565 4.418 17932
1058 1 9 . 1 1 46 46 THR HA H 741 4.579 4.579 4.378 0.201 17932
1059 1 9 . 1 1 46 46 THR H H 741 7.981 7.981 8.414 -0.433 17932
1060 1 9 . 1 1 47 47 ALA N N 742 124.742 124.742 121.472 3.270 17932
1061 1 9 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.045 0.146 17932
1062 1 9 . 1 1 47 47 ALA H H 742 8.158 8.158 7.819 0.339 17932
1063 1 9 . 1 1 48 48 ASN N N 743 116.202 116.202 115.113 1.089 17932
1064 1 9 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.860 -0.260 17932
1065 1 9 . 1 1 48 48 ASN H H 743 8.103 8.103 7.959 0.144 17932
1066 1 9 . 1 1 49 49 ASN N N 744 119.857 119.857 117.774 2.083 17932
1067 1 9 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.114 -0.228 17932
1068 1 9 . 1 1 49 49 ASN H H 744 8.095 8.095 8.207 -0.112 17932
1069 1 9 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.306 0.040 17932
1070 1 9 . 1 1 54 54 GLU N N 749 121.972 121.972 122.451 -0.479 17932
1071 1 9 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.524 -0.350 17932
1072 1 9 . 1 1 54 54 GLU H H 749 8.331 8.331 8.394 -0.063 17932
1073 1 9 . 1 1 55 55 ALA N N 750 125.344 125.344 120.477 4.867 17932
1074 1 9 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.756 -0.431 17932
1075 1 9 . 1 1 55 55 ALA H H 750 8.406 8.406 7.491 0.915 17932
1076 1 9 . 1 1 56 56 THR N N 751 112.838 112.838 113.887 -1.049 17932
1077 1 9 . 1 1 56 56 THR HA H 751 4.328 4.328 4.717 -0.389 17932
1078 1 9 . 1 1 56 56 THR H H 751 8.089 8.089 7.898 0.191 17932
1079 1 9 . 1 1 57 57 SER N N 752 117.970 117.970 119.707 -1.737 17932
1080 1 9 . 1 1 57 57 SER HA H 752 4.490 4.490 4.588 -0.098 17932
1081 1 9 . 1 1 57 57 SER H H 752 8.272 8.272 8.567 -0.295 17932
1082 1 9 . 1 1 58 58 THR N N 753 115.676 115.676 114.052 1.624 17932
1083 1 9 . 1 1 58 58 THR HA H 753 4.333 4.333 5.393 -1.060 17932
1084 1 9 . 1 1 58 58 THR H H 753 8.090 8.090 7.939 0.151 17932
1085 1 9 . 1 1 59 59 PHE N N 754 122.160 122.160 117.973 4.187 17932
1086 1 9 . 1 1 59 59 PHE HA H 754 4.713 4.713 4.897 -0.184 17932
1087 1 9 . 1 1 59 59 PHE H H 754 8.187 8.187 8.302 -0.115 17932
1088 1 9 . 1 1 60 60 THR N N 755 115.583 115.583 115.314 0.269 17932
1089 1 9 . 1 1 60 60 THR HA H 755 4.265 4.265 4.052 0.213 17932
1090 1 9 . 1 1 60 60 THR H H 755 8.015 8.015 7.303 0.712 17932
1091 1 9 . 1 1 61 61 ASN N N 756 121.324 121.324 117.892 3.432 17932
1092 1 9 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.754 -0.001 17932
1093 1 9 . 1 1 61 61 ASN H H 756 8.340 8.340 7.721 0.619 17932
1094 1 9 . 1 1 62 62 ILE N N 757 121.251 121.251 118.223 3.028 17932
1095 1 9 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.401 -0.225 17932
1096 1 9 . 1 1 62 62 ILE H H 757 8.076 8.076 8.409 -0.333 17932
1097 1 9 . 1 1 63 63 THR N N 758 118.250 118.250 116.692 1.558 17932
1098 1 9 . 1 1 63 63 THR HA H 758 4.264 4.264 4.116 0.148 17932
1099 1 9 . 1 1 63 63 THR H H 758 8.140 8.140 8.053 0.087 17932
1100 1 9 . 1 1 64 64 TYR N N 759 123.728 123.728 122.133 1.595 17932
1101 1 9 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.480 0.048 17932
1102 1 9 . 1 1 64 64 TYR H H 759 8.233 8.233 7.183 1.050 17932
1103 1 9 . 1 1 65 65 ARG N N 760 124.423 124.423 120.012 4.411 17932
1104 1 9 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.418 -0.177 17932
1105 1 9 . 1 1 65 65 ARG H H 760 8.226 8.226 8.316 -0.090 17932
1106 1 9 . 1 1 66 66 GLY N N 761 109.761 109.761 111.134 -1.373 17932
1107 1 9 . 1 1 66 66 GLY H H 761 7.700 7.700 7.942 -0.242 17932
1108 1 10 . 1 1 22 22 LEU N N 717 123.186 123.186 120.515 2.671 17932
1109 1 10 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.577 -0.277 17932
1110 1 10 . 1 1 22 22 LEU H H 717 8.121 8.121 7.893 0.228 17932
1111 1 10 . 1 1 23 23 LEU N N 718 123.575 123.575 115.613 7.962 17932
1112 1 10 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.569 -0.219 17932
1113 1 10 . 1 1 23 23 LEU H H 718 8.189 8.189 8.790 -0.601 17932
1114 1 10 . 1 1 24 24 ILE N N 719 121.952 121.952 115.973 5.979 17932
1115 1 10 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.283 -0.020 17932
1116 1 10 . 1 1 24 24 ILE H H 719 8.079 8.079 8.348 -0.269 17932
1117 1 10 . 1 1 25 25 THR N N 720 118.098 118.098 114.819 3.279 17932
1118 1 10 . 1 1 25 25 THR HA H 720 4.359 4.359 3.862 0.497 17932
1119 1 10 . 1 1 25 25 THR H H 720 8.296 8.296 8.137 0.159 17932
1120 1 10 . 1 1 26 26 ILE N N 721 122.588 122.588 114.020 8.568 17932
1121 1 10 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.251 -0.218 17932
1122 1 10 . 1 1 26 26 ILE H H 721 8.156 8.156 8.119 0.037 17932
1123 1 10 . 1 1 27 27 HIS N N 722 122.251 122.251 117.889 4.362 17932
1124 1 10 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.801 -0.240 17932
1125 1 10 . 1 1 27 27 HIS H H 722 8.346 8.346 7.921 0.425 17932
1126 1 10 . 1 1 28 28 ASP N N 723 120.954 120.954 120.179 0.775 17932
1127 1 10 . 1 1 28 28 ASP HA H 723 4.552 4.552 2.230 2.322 17932
1128 1 10 . 1 1 28 28 ASP H H 723 8.155 8.155 8.189 -0.034 17932
1129 1 10 . 1 1 29 29 ARG N N 724 121.468 121.468 114.774 6.694 17932
1130 1 10 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.786 -0.600 17932
1131 1 10 . 1 1 29 29 ARG H H 724 8.322 8.322 7.948 0.374 17932
1132 1 10 . 1 1 30 30 LYS N N 725 121.800 121.800 119.372 2.428 17932
1133 1 10 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.256 -0.083 17932
1134 1 10 . 1 1 30 30 LYS H H 725 8.382 8.382 7.363 1.019 17932
1135 1 10 . 1 1 31 31 GLU N N 726 120.681 120.681 119.509 1.172 17932
1136 1 10 . 1 1 31 31 GLU HA H 726 4.145 4.145 4.025 0.120 17932
1137 1 10 . 1 1 31 31 GLU H H 726 8.323 8.323 7.864 0.459 17932
1138 1 10 . 1 1 32 32 PHE N N 727 120.355 120.355 116.249 4.106 17932
1139 1 10 . 1 1 32 32 PHE HA H 727 4.486 4.486 4.380 0.106 17932
1140 1 10 . 1 1 32 32 PHE H H 727 8.151 8.151 7.097 1.054 17932
1141 1 10 . 1 1 33 33 ALA N N 728 123.526 123.526 120.884 2.642 17932
1142 1 10 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.230 -0.040 17932
1143 1 10 . 1 1 33 33 ALA H H 728 8.114 8.114 7.445 0.669 17932
1144 1 10 . 1 1 34 34 LYS N N 729 119.476 119.476 116.092 3.384 17932
1145 1 10 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.352 -0.201 17932
1146 1 10 . 1 1 34 34 LYS H H 729 7.957 7.957 7.220 0.737 17932
1147 1 10 . 1 1 35 35 PHE N N 730 120.504 120.504 114.094 6.410 17932
1148 1 10 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.307 0.144 17932
1149 1 10 . 1 1 35 35 PHE H H 730 8.040 8.040 7.191 0.849 17932
1150 1 10 . 1 1 36 36 GLU N N 731 120.883 120.883 116.306 4.577 17932
1151 1 10 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.460 0.571 17932
1152 1 10 . 1 1 36 36 GLU H H 731 8.281 8.281 8.396 -0.115 17932
1153 1 10 . 1 1 37 37 GLU N N 732 120.686 120.686 118.831 1.855 17932
1154 1 10 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.375 -0.336 17932
1155 1 10 . 1 1 37 37 GLU H H 732 8.222 8.222 7.816 0.406 17932
1156 1 10 . 1 1 38 38 GLU N N 733 121.278 121.278 118.690 2.588 17932
1157 1 10 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.684 -0.604 17932
1158 1 10 . 1 1 38 38 GLU H H 733 8.202 8.202 8.523 -0.321 17932
1159 1 10 . 1 1 39 39 ARG N N 734 120.498 120.498 120.546 -0.048 17932
1160 1 10 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.221 -0.179 17932
1161 1 10 . 1 1 39 39 ARG H H 734 8.102 8.102 8.927 -0.825 17932
1162 1 10 . 1 1 40 40 ALA N N 735 123.267 123.267 119.200 4.067 17932
1163 1 10 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.314 -0.154 17932
1164 1 10 . 1 1 40 40 ALA H H 735 7.934 7.934 7.866 0.068 17932
1165 1 10 . 1 1 41 41 ARG N N 736 118.979 118.979 115.285 3.694 17932
1166 1 10 . 1 1 41 41 ARG HA H 736 4.111 4.111 3.895 0.216 17932
1167 1 10 . 1 1 41 41 ARG H H 736 7.926 7.926 7.556 0.370 17932
1168 1 10 . 1 1 42 42 ALA N N 737 122.585 122.585 117.586 4.999 17932
1169 1 10 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.081 0.079 17932
1170 1 10 . 1 1 42 42 ALA H H 737 7.944 7.944 9.419 -1.475 17932
1171 1 10 . 1 1 43 43 LYS N N 738 118.696 118.696 118.649 0.047 17932
1172 1 10 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.870 0.207 17932
1173 1 10 . 1 1 43 43 LYS H H 738 7.875 7.875 7.805 0.070 17932
1174 1 10 . 1 1 44 44 TRP N N 739 120.356 120.356 116.699 3.657 17932
1175 1 10 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.488 0.143 17932
1176 1 10 . 1 1 44 44 TRP H H 739 7.851 7.851 6.763 1.088 17932
1177 1 10 . 1 1 45 45 ASP N N 740 121.704 121.704 115.610 6.094 17932
1178 1 10 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.371 0.255 17932
1179 1 10 . 1 1 45 45 ASP H H 740 8.186 8.186 9.207 -1.021 17932
1180 1 10 . 1 1 46 46 THR N N 741 113.983 113.983 113.410 0.573 17932
1181 1 10 . 1 1 46 46 THR HA H 741 4.579 4.579 4.228 0.351 17932
1182 1 10 . 1 1 46 46 THR H H 741 7.981 7.981 8.670 -0.689 17932
1183 1 10 . 1 1 47 47 ALA N N 742 124.742 124.742 120.049 4.693 17932
1184 1 10 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.252 -0.061 17932
1185 1 10 . 1 1 47 47 ALA H H 742 8.158 8.158 8.077 0.081 17932
1186 1 10 . 1 1 48 48 ASN N N 743 116.202 116.202 115.461 0.741 17932
1187 1 10 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.964 -0.364 17932
1188 1 10 . 1 1 48 48 ASN H H 743 8.103 8.103 8.064 0.039 17932
1189 1 10 . 1 1 49 49 ASN N N 744 119.857 119.857 117.815 2.042 17932
1190 1 10 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.121 -0.235 17932
1191 1 10 . 1 1 49 49 ASN H H 744 8.095 8.095 8.040 0.055 17932
1192 1 10 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.348 -0.002 17932
1193 1 10 . 1 1 54 54 GLU N N 749 121.972 121.972 121.140 0.832 17932
1194 1 10 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.369 -0.195 17932
1195 1 10 . 1 1 54 54 GLU H H 749 8.331 8.331 8.585 -0.254 17932
1196 1 10 . 1 1 55 55 ALA N N 750 125.344 125.344 122.565 2.779 17932
1197 1 10 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.540 -0.215 17932
1198 1 10 . 1 1 55 55 ALA H H 750 8.406 8.406 8.003 0.403 17932
1199 1 10 . 1 1 56 56 THR N N 751 112.838 112.838 114.183 -1.345 17932
1200 1 10 . 1 1 56 56 THR HA H 751 4.328 4.328 4.629 -0.301 17932
1201 1 10 . 1 1 56 56 THR H H 751 8.089 8.089 8.283 -0.194 17932
1202 1 10 . 1 1 57 57 SER N N 752 117.970 117.970 118.909 -0.939 17932
1203 1 10 . 1 1 57 57 SER HA H 752 4.490 4.490 4.743 -0.253 17932
1204 1 10 . 1 1 57 57 SER H H 752 8.272 8.272 8.487 -0.215 17932
1205 1 10 . 1 1 58 58 THR N N 753 115.676 115.676 114.647 1.029 17932
1206 1 10 . 1 1 58 58 THR HA H 753 4.333 4.333 5.232 -0.899 17932
1207 1 10 . 1 1 58 58 THR H H 753 8.090 8.090 8.109 -0.019 17932
1208 1 10 . 1 1 59 59 PHE N N 754 122.160 122.160 121.934 0.226 17932
1209 1 10 . 1 1 59 59 PHE HA H 754 4.713 4.713 5.009 -0.296 17932
1210 1 10 . 1 1 59 59 PHE H H 754 8.187 8.187 8.465 -0.278 17932
1211 1 10 . 1 1 60 60 THR N N 755 115.583 115.583 114.555 1.028 17932
1212 1 10 . 1 1 60 60 THR HA H 755 4.265 4.265 3.880 0.385 17932
1213 1 10 . 1 1 60 60 THR H H 755 8.015 8.015 7.224 0.791 17932
1214 1 10 . 1 1 61 61 ASN N N 756 121.324 121.324 121.058 0.266 17932
1215 1 10 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.416 0.337 17932
1216 1 10 . 1 1 61 61 ASN H H 756 8.340 8.340 7.748 0.592 17932
1217 1 10 . 1 1 62 62 ILE N N 757 121.251 121.251 112.734 8.517 17932
1218 1 10 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.184 -0.008 17932
1219 1 10 . 1 1 62 62 ILE H H 757 8.076 8.076 7.325 0.751 17932
1220 1 10 . 1 1 63 63 THR N N 758 118.250 118.250 116.715 1.535 17932
1221 1 10 . 1 1 63 63 THR HA H 758 4.264 4.264 4.090 0.174 17932
1222 1 10 . 1 1 63 63 THR H H 758 8.140 8.140 7.285 0.855 17932
1223 1 10 . 1 1 64 64 TYR N N 759 123.728 123.728 119.827 3.901 17932
1224 1 10 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.088 0.440 17932
1225 1 10 . 1 1 64 64 TYR H H 759 8.233 8.233 6.996 1.237 17932
1226 1 10 . 1 1 65 65 ARG N N 760 124.423 124.423 119.015 5.408 17932
1227 1 10 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.470 -0.229 17932
1228 1 10 . 1 1 65 65 ARG H H 760 8.226 8.226 8.463 -0.237 17932
1229 1 10 . 1 1 66 66 GLY N N 761 109.761 109.761 109.584 0.177 17932
1230 1 10 . 1 1 66 66 GLY H H 761 7.700 7.700 8.239 -0.539 17932
1231 1 11 . 1 1 22 22 LEU N N 717 123.186 123.186 121.065 2.121 17932
1232 1 11 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.290 0.010 17932
1233 1 11 . 1 1 22 22 LEU H H 717 8.121 8.121 7.912 0.209 17932
1234 1 11 . 1 1 23 23 LEU N N 718 123.575 123.575 115.943 7.632 17932
1235 1 11 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.430 -0.080 17932
1236 1 11 . 1 1 23 23 LEU H H 718 8.189 8.189 7.810 0.379 17932
1237 1 11 . 1 1 24 24 ILE N N 719 121.952 121.952 113.784 8.168 17932
1238 1 11 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.113 0.150 17932
1239 1 11 . 1 1 24 24 ILE H H 719 8.079 8.079 7.576 0.503 17932
1240 1 11 . 1 1 25 25 THR N N 720 118.098 118.098 114.165 3.933 17932
1241 1 11 . 1 1 25 25 THR HA H 720 4.359 4.359 3.802 0.557 17932
1242 1 11 . 1 1 25 25 THR H H 720 8.296 8.296 8.049 0.247 17932
1243 1 11 . 1 1 26 26 ILE N N 721 122.588 122.588 113.325 9.263 17932
1244 1 11 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.217 -0.184 17932
1245 1 11 . 1 1 26 26 ILE H H 721 8.156 8.156 7.522 0.634 17932
1246 1 11 . 1 1 27 27 HIS N N 722 122.251 122.251 117.375 4.876 17932
1247 1 11 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.575 -0.014 17932
1248 1 11 . 1 1 27 27 HIS H H 722 8.346 8.346 7.816 0.530 17932
1249 1 11 . 1 1 28 28 ASP N N 723 120.954 120.954 120.934 0.020 17932
1250 1 11 . 1 1 28 28 ASP HA H 723 4.552 4.552 3.546 1.006 17932
1251 1 11 . 1 1 28 28 ASP H H 723 8.155 8.155 8.529 -0.374 17932
1252 1 11 . 1 1 29 29 ARG N N 724 121.468 121.468 117.459 4.009 17932
1253 1 11 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.344 -0.158 17932
1254 1 11 . 1 1 29 29 ARG H H 724 8.322 8.322 8.014 0.308 17932
1255 1 11 . 1 1 30 30 LYS N N 725 121.800 121.800 119.107 2.693 17932
1256 1 11 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.120 0.053 17932
1257 1 11 . 1 1 30 30 LYS H H 725 8.382 8.382 7.764 0.618 17932
1258 1 11 . 1 1 31 31 GLU N N 726 120.681 120.681 118.410 2.271 17932
1259 1 11 . 1 1 31 31 GLU HA H 726 4.145 4.145 4.325 -0.180 17932
1260 1 11 . 1 1 31 31 GLU H H 726 8.323 8.323 7.965 0.358 17932
1261 1 11 . 1 1 32 32 PHE N N 727 120.355 120.355 115.373 4.982 17932
1262 1 11 . 1 1 32 32 PHE HA H 727 4.486 4.486 4.030 0.456 17932
1263 1 11 . 1 1 32 32 PHE H H 727 8.151 8.151 6.820 1.331 17932
1264 1 11 . 1 1 33 33 ALA N N 728 123.526 123.526 121.120 2.406 17932
1265 1 11 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.292 -0.102 17932
1266 1 11 . 1 1 33 33 ALA H H 728 8.114 8.114 7.371 0.743 17932
1267 1 11 . 1 1 34 34 LYS N N 729 119.476 119.476 116.917 2.559 17932
1268 1 11 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.392 -0.241 17932
1269 1 11 . 1 1 34 34 LYS H H 729 7.957 7.957 7.838 0.119 17932
1270 1 11 . 1 1 35 35 PHE N N 730 120.504 120.504 114.325 6.179 17932
1271 1 11 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.376 0.075 17932
1272 1 11 . 1 1 35 35 PHE H H 730 8.040 8.040 7.652 0.388 17932
1273 1 11 . 1 1 36 36 GLU N N 731 120.883 120.883 115.671 5.212 17932
1274 1 11 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.017 1.014 17932
1275 1 11 . 1 1 36 36 GLU H H 731 8.281 8.281 8.383 -0.102 17932
1276 1 11 . 1 1 37 37 GLU N N 732 120.686 120.686 119.101 1.585 17932
1277 1 11 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.141 -0.102 17932
1278 1 11 . 1 1 37 37 GLU H H 732 8.222 8.222 7.901 0.321 17932
1279 1 11 . 1 1 38 38 GLU N N 733 121.278 121.278 118.839 2.439 17932
1280 1 11 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.664 -0.584 17932
1281 1 11 . 1 1 38 38 GLU H H 733 8.202 8.202 8.425 -0.223 17932
1282 1 11 . 1 1 39 39 ARG N N 734 120.498 120.498 120.247 0.251 17932
1283 1 11 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.275 -0.233 17932
1284 1 11 . 1 1 39 39 ARG H H 734 8.102 8.102 8.857 -0.755 17932
1285 1 11 . 1 1 40 40 ALA N N 735 123.267 123.267 118.869 4.398 17932
1286 1 11 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.413 -0.253 17932
1287 1 11 . 1 1 40 40 ALA H H 735 7.934 7.934 7.658 0.276 17932
1288 1 11 . 1 1 41 41 ARG N N 736 118.979 118.979 118.011 0.968 17932
1289 1 11 . 1 1 41 41 ARG HA H 736 4.111 4.111 4.020 0.091 17932
1290 1 11 . 1 1 41 41 ARG H H 736 7.926 7.926 7.609 0.317 17932
1291 1 11 . 1 1 42 42 ALA N N 737 122.585 122.585 119.180 3.405 17932
1292 1 11 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.218 -0.058 17932
1293 1 11 . 1 1 42 42 ALA H H 737 7.944 7.944 9.487 -1.543 17932
1294 1 11 . 1 1 43 43 LYS N N 738 118.696 118.696 117.818 0.878 17932
1295 1 11 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.769 0.308 17932
1296 1 11 . 1 1 43 43 LYS H H 738 7.875 7.875 7.820 0.055 17932
1297 1 11 . 1 1 44 44 TRP N N 739 120.356 120.356 115.186 5.170 17932
1298 1 11 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.553 0.078 17932
1299 1 11 . 1 1 44 44 TRP H H 739 7.851 7.851 7.235 0.616 17932
1300 1 11 . 1 1 45 45 ASP N N 740 121.704 121.704 117.621 4.083 17932
1301 1 11 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.883 -0.257 17932
1302 1 11 . 1 1 45 45 ASP H H 740 8.186 8.186 8.928 -0.742 17932
1303 1 11 . 1 1 46 46 THR N N 741 113.983 113.983 117.182 -3.199 17932
1304 1 11 . 1 1 46 46 THR HA H 741 4.579 4.579 4.414 0.165 17932
1305 1 11 . 1 1 46 46 THR H H 741 7.981 7.981 8.991 -1.010 17932
1306 1 11 . 1 1 47 47 ALA N N 742 124.742 124.742 120.802 3.940 17932
1307 1 11 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.564 -0.373 17932
1308 1 11 . 1 1 47 47 ALA H H 742 8.158 8.158 7.842 0.316 17932
1309 1 11 . 1 1 48 48 ASN N N 743 116.202 116.202 118.462 -2.260 17932
1310 1 11 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.797 -0.197 17932
1311 1 11 . 1 1 48 48 ASN H H 743 8.103 8.103 9.512 -1.409 17932
1312 1 11 . 1 1 49 49 ASN N N 744 119.857 119.857 116.495 3.362 17932
1313 1 11 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.006 -0.120 17932
1314 1 11 . 1 1 49 49 ASN H H 744 8.095 8.095 8.536 -0.441 17932
1315 1 11 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.456 -0.110 17932
1316 1 11 . 1 1 54 54 GLU N N 749 121.972 121.972 120.490 1.482 17932
1317 1 11 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.357 -0.183 17932
1318 1 11 . 1 1 54 54 GLU H H 749 8.331 8.331 8.312 0.019 17932
1319 1 11 . 1 1 55 55 ALA N N 750 125.344 125.344 122.995 2.349 17932
1320 1 11 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.655 -0.330 17932
1321 1 11 . 1 1 55 55 ALA H H 750 8.406 8.406 8.088 0.318 17932
1322 1 11 . 1 1 56 56 THR N N 751 112.838 112.838 117.826 -4.988 17932
1323 1 11 . 1 1 56 56 THR HA H 751 4.328 4.328 4.460 -0.132 17932
1324 1 11 . 1 1 56 56 THR H H 751 8.089 8.089 8.317 -0.228 17932
1325 1 11 . 1 1 57 57 SER N N 752 117.970 117.970 116.020 1.950 17932
1326 1 11 . 1 1 57 57 SER HA H 752 4.490 4.490 4.830 -0.340 17932
1327 1 11 . 1 1 57 57 SER H H 752 8.272 8.272 8.588 -0.316 17932
1328 1 11 . 1 1 58 58 THR N N 753 115.676 115.676 116.233 -0.557 17932
1329 1 11 . 1 1 58 58 THR HA H 753 4.333 4.333 5.208 -0.875 17932
1330 1 11 . 1 1 58 58 THR H H 753 8.090 8.090 8.343 -0.253 17932
1331 1 11 . 1 1 59 59 PHE N N 754 122.160 122.160 124.064 -1.904 17932
1332 1 11 . 1 1 59 59 PHE HA H 754 4.713 4.713 4.808 -0.095 17932
1333 1 11 . 1 1 59 59 PHE H H 754 8.187 8.187 9.308 -1.121 17932
1334 1 11 . 1 1 60 60 THR N N 755 115.583 115.583 113.323 2.260 17932
1335 1 11 . 1 1 60 60 THR HA H 755 4.265 4.265 3.444 0.821 17932
1336 1 11 . 1 1 60 60 THR H H 755 8.015 8.015 7.176 0.839 17932
1337 1 11 . 1 1 61 61 ASN N N 756 121.324 121.324 116.750 4.574 17932
1338 1 11 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.633 0.120 17932
1339 1 11 . 1 1 61 61 ASN H H 756 8.340 8.340 8.027 0.313 17932
1340 1 11 . 1 1 62 62 ILE N N 757 121.251 121.251 118.389 2.862 17932
1341 1 11 . 1 1 62 62 ILE HA H 757 4.176 4.176 3.958 0.218 17932
1342 1 11 . 1 1 62 62 ILE H H 757 8.076 8.076 7.678 0.398 17932
1343 1 11 . 1 1 63 63 THR N N 758 118.250 118.250 116.259 1.991 17932
1344 1 11 . 1 1 63 63 THR HA H 758 4.264 4.264 4.011 0.253 17932
1345 1 11 . 1 1 63 63 THR H H 758 8.140 8.140 7.588 0.552 17932
1346 1 11 . 1 1 64 64 TYR N N 759 123.728 123.728 118.895 4.833 17932
1347 1 11 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.155 0.373 17932
1348 1 11 . 1 1 64 64 TYR H H 759 8.233 8.233 6.919 1.314 17932
1349 1 11 . 1 1 65 65 ARG N N 760 124.423 124.423 119.021 5.402 17932
1350 1 11 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.535 -0.294 17932
1351 1 11 . 1 1 65 65 ARG H H 760 8.226 8.226 8.158 0.068 17932
1352 1 11 . 1 1 66 66 GLY N N 761 109.761 109.761 109.341 0.420 17932
1353 1 11 . 1 1 66 66 GLY H H 761 7.700 7.700 8.453 -0.753 17932
1354 1 12 . 1 1 22 22 LEU N N 717 123.186 123.186 120.346 2.840 17932
1355 1 12 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.373 -0.073 17932
1356 1 12 . 1 1 22 22 LEU H H 717 8.121 8.121 7.987 0.134 17932
1357 1 12 . 1 1 23 23 LEU N N 718 123.575 123.575 114.082 9.493 17932
1358 1 12 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.576 -0.226 17932
1359 1 12 . 1 1 23 23 LEU H H 718 8.189 8.189 8.559 -0.370 17932
1360 1 12 . 1 1 24 24 ILE N N 719 121.952 121.952 115.169 6.783 17932
1361 1 12 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.182 0.081 17932
1362 1 12 . 1 1 24 24 ILE H H 719 8.079 8.079 8.665 -0.586 17932
1363 1 12 . 1 1 25 25 THR N N 720 118.098 118.098 115.424 2.674 17932
1364 1 12 . 1 1 25 25 THR HA H 720 4.359 4.359 3.866 0.493 17932
1365 1 12 . 1 1 25 25 THR H H 720 8.296 8.296 8.262 0.034 17932
1366 1 12 . 1 1 26 26 ILE N N 721 122.588 122.588 114.123 8.465 17932
1367 1 12 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.303 -0.270 17932
1368 1 12 . 1 1 26 26 ILE H H 721 8.156 8.156 8.165 -0.009 17932
1369 1 12 . 1 1 27 27 HIS N N 722 122.251 122.251 117.682 4.569 17932
1370 1 12 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.680 -0.119 17932
1371 1 12 . 1 1 27 27 HIS H H 722 8.346 8.346 8.091 0.255 17932
1372 1 12 . 1 1 28 28 ASP N N 723 120.954 120.954 120.233 0.721 17932
1373 1 12 . 1 1 28 28 ASP HA H 723 4.552 4.552 2.314 2.238 17932
1374 1 12 . 1 1 28 28 ASP H H 723 8.155 8.155 8.442 -0.287 17932
1375 1 12 . 1 1 29 29 ARG N N 724 121.468 121.468 117.157 4.311 17932
1376 1 12 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.677 -0.491 17932
1377 1 12 . 1 1 29 29 ARG H H 724 8.322 8.322 8.168 0.154 17932
1378 1 12 . 1 1 30 30 LYS N N 725 121.800 121.800 121.067 0.733 17932
1379 1 12 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.124 0.049 17932
1380 1 12 . 1 1 30 30 LYS H H 725 8.382 8.382 8.042 0.340 17932
1381 1 12 . 1 1 31 31 GLU N N 726 120.681 120.681 117.532 3.149 17932
1382 1 12 . 1 1 31 31 GLU HA H 726 4.145 4.145 4.325 -0.180 17932
1383 1 12 . 1 1 31 31 GLU H H 726 8.323 8.323 7.642 0.681 17932
1384 1 12 . 1 1 32 32 PHE N N 727 120.355 120.355 117.474 2.881 17932
1385 1 12 . 1 1 32 32 PHE HA H 727 4.486 4.486 4.118 0.368 17932
1386 1 12 . 1 1 32 32 PHE H H 727 8.151 8.151 7.121 1.030 17932
1387 1 12 . 1 1 33 33 ALA N N 728 123.526 123.526 122.148 1.378 17932
1388 1 12 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.270 -0.080 17932
1389 1 12 . 1 1 33 33 ALA H H 728 8.114 8.114 7.570 0.544 17932
1390 1 12 . 1 1 34 34 LYS N N 729 119.476 119.476 117.040 2.436 17932
1391 1 12 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.434 -0.283 17932
1392 1 12 . 1 1 34 34 LYS H H 729 7.957 7.957 7.683 0.274 17932
1393 1 12 . 1 1 35 35 PHE N N 730 120.504 120.504 113.532 6.972 17932
1394 1 12 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.334 0.117 17932
1395 1 12 . 1 1 35 35 PHE H H 730 8.040 8.040 7.393 0.647 17932
1396 1 12 . 1 1 36 36 GLU N N 731 120.883 120.883 116.334 4.549 17932
1397 1 12 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.620 0.411 17932
1398 1 12 . 1 1 36 36 GLU H H 731 8.281 8.281 8.529 -0.248 17932
1399 1 12 . 1 1 37 37 GLU N N 732 120.686 120.686 119.274 1.412 17932
1400 1 12 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.164 -0.125 17932
1401 1 12 . 1 1 37 37 GLU H H 732 8.222 8.222 8.156 0.066 17932
1402 1 12 . 1 1 38 38 GLU N N 733 121.278 121.278 118.665 2.613 17932
1403 1 12 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.633 -0.553 17932
1404 1 12 . 1 1 38 38 GLU H H 733 8.202 8.202 8.287 -0.085 17932
1405 1 12 . 1 1 39 39 ARG N N 734 120.498 120.498 120.981 -0.483 17932
1406 1 12 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.226 -0.184 17932
1407 1 12 . 1 1 39 39 ARG H H 734 8.102 8.102 8.777 -0.675 17932
1408 1 12 . 1 1 40 40 ALA N N 735 123.267 123.267 119.179 4.088 17932
1409 1 12 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.408 -0.248 17932
1410 1 12 . 1 1 40 40 ALA H H 735 7.934 7.934 7.937 -0.003 17932
1411 1 12 . 1 1 41 41 ARG N N 736 118.979 118.979 115.677 3.302 17932
1412 1 12 . 1 1 41 41 ARG HA H 736 4.111 4.111 3.832 0.279 17932
1413 1 12 . 1 1 41 41 ARG H H 736 7.926 7.926 7.674 0.252 17932
1414 1 12 . 1 1 42 42 ALA N N 737 122.585 122.585 117.315 5.270 17932
1415 1 12 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.152 0.008 17932
1416 1 12 . 1 1 42 42 ALA H H 737 7.944 7.944 9.477 -1.533 17932
1417 1 12 . 1 1 43 43 LYS N N 738 118.696 118.696 118.026 0.670 17932
1418 1 12 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.802 0.275 17932
1419 1 12 . 1 1 43 43 LYS H H 738 7.875 7.875 7.801 0.074 17932
1420 1 12 . 1 1 44 44 TRP N N 739 120.356 120.356 114.571 5.785 17932
1421 1 12 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.517 0.114 17932
1422 1 12 . 1 1 44 44 TRP H H 739 7.851 7.851 6.887 0.964 17932
1423 1 12 . 1 1 45 45 ASP N N 740 121.704 121.704 116.836 4.868 17932
1424 1 12 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.462 0.164 17932
1425 1 12 . 1 1 45 45 ASP H H 740 8.186 8.186 8.811 -0.625 17932
1426 1 12 . 1 1 46 46 THR N N 741 113.983 113.983 112.844 1.139 17932
1427 1 12 . 1 1 46 46 THR HA H 741 4.579 4.579 3.960 0.619 17932
1428 1 12 . 1 1 46 46 THR H H 741 7.981 7.981 8.291 -0.310 17932
1429 1 12 . 1 1 47 47 ALA N N 742 124.742 124.742 120.772 3.970 17932
1430 1 12 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.300 -0.109 17932
1431 1 12 . 1 1 47 47 ALA H H 742 8.158 8.158 7.684 0.474 17932
1432 1 12 . 1 1 48 48 ASN N N 743 116.202 116.202 116.745 -0.543 17932
1433 1 12 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.842 -0.242 17932
1434 1 12 . 1 1 48 48 ASN H H 743 8.103 8.103 8.319 -0.216 17932
1435 1 12 . 1 1 49 49 ASN N N 744 119.857 119.857 119.002 0.855 17932
1436 1 12 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.112 -0.226 17932
1437 1 12 . 1 1 49 49 ASN H H 744 8.095 8.095 8.600 -0.505 17932
1438 1 12 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.318 0.028 17932
1439 1 12 . 1 1 54 54 GLU N N 749 121.972 121.972 122.017 -0.045 17932
1440 1 12 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.453 -0.279 17932
1441 1 12 . 1 1 54 54 GLU H H 749 8.331 8.331 8.688 -0.357 17932
1442 1 12 . 1 1 55 55 ALA N N 750 125.344 125.344 120.631 4.713 17932
1443 1 12 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.841 -0.516 17932
1444 1 12 . 1 1 55 55 ALA H H 750 8.406 8.406 7.700 0.706 17932
1445 1 12 . 1 1 56 56 THR N N 751 112.838 112.838 112.742 0.096 17932
1446 1 12 . 1 1 56 56 THR HA H 751 4.328 4.328 4.773 -0.445 17932
1447 1 12 . 1 1 56 56 THR H H 751 8.089 8.089 8.349 -0.260 17932
1448 1 12 . 1 1 57 57 SER N N 752 117.970 117.970 118.794 -0.824 17932
1449 1 12 . 1 1 57 57 SER HA H 752 4.490 4.490 4.737 -0.247 17932
1450 1 12 . 1 1 57 57 SER H H 752 8.272 8.272 8.761 -0.489 17932
1451 1 12 . 1 1 58 58 THR N N 753 115.676 115.676 118.503 -2.827 17932
1452 1 12 . 1 1 58 58 THR HA H 753 4.333 4.333 4.911 -0.578 17932
1453 1 12 . 1 1 58 58 THR H H 753 8.090 8.090 8.359 -0.269 17932
1454 1 12 . 1 1 59 59 PHE N N 754 122.160 122.160 118.912 3.248 17932
1455 1 12 . 1 1 59 59 PHE HA H 754 4.713 4.713 5.034 -0.321 17932
1456 1 12 . 1 1 59 59 PHE H H 754 8.187 8.187 8.369 -0.182 17932
1457 1 12 . 1 1 60 60 THR N N 755 115.583 115.583 115.220 0.363 17932
1458 1 12 . 1 1 60 60 THR HA H 755 4.265 4.265 4.063 0.202 17932
1459 1 12 . 1 1 60 60 THR H H 755 8.015 8.015 7.469 0.546 17932
1460 1 12 . 1 1 61 61 ASN N N 756 121.324 121.324 116.710 4.614 17932
1461 1 12 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.760 -0.007 17932
1462 1 12 . 1 1 61 61 ASN H H 756 8.340 8.340 7.601 0.739 17932
1463 1 12 . 1 1 62 62 ILE N N 757 121.251 121.251 113.402 7.849 17932
1464 1 12 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.871 -0.695 17932
1465 1 12 . 1 1 62 62 ILE H H 757 8.076 8.076 8.347 -0.271 17932
1466 1 12 . 1 1 63 63 THR N N 758 118.250 118.250 115.178 3.072 17932
1467 1 12 . 1 1 63 63 THR HA H 758 4.264 4.264 4.564 -0.300 17932
1468 1 12 . 1 1 63 63 THR H H 758 8.140 8.140 8.349 -0.209 17932
1469 1 12 . 1 1 64 64 TYR N N 759 123.728 123.728 123.693 0.035 17932
1470 1 12 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.763 -0.235 17932
1471 1 12 . 1 1 64 64 TYR H H 759 8.233 8.233 7.849 0.384 17932
1472 1 12 . 1 1 65 65 ARG N N 760 124.423 124.423 120.244 4.179 17932
1473 1 12 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.353 -0.112 17932
1474 1 12 . 1 1 65 65 ARG H H 760 8.226 8.226 7.325 0.901 17932
1475 1 12 . 1 1 66 66 GLY N N 761 109.761 109.761 108.714 1.047 17932
1476 1 12 . 1 1 66 66 GLY H H 761 7.700 7.700 7.446 0.254 17932
1477 1 13 . 1 1 22 22 LEU N N 717 123.186 123.186 119.672 3.514 17932
1478 1 13 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.408 -0.108 17932
1479 1 13 . 1 1 22 22 LEU H H 717 8.121 8.121 9.000 -0.879 17932
1480 1 13 . 1 1 23 23 LEU N N 718 123.575 123.575 117.507 6.068 17932
1481 1 13 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.374 -0.024 17932
1482 1 13 . 1 1 23 23 LEU H H 718 8.189 8.189 7.630 0.559 17932
1483 1 13 . 1 1 24 24 ILE N N 719 121.952 121.952 114.719 7.233 17932
1484 1 13 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.190 0.073 17932
1485 1 13 . 1 1 24 24 ILE H H 719 8.079 8.079 7.859 0.220 17932
1486 1 13 . 1 1 25 25 THR N N 720 118.098 118.098 113.537 4.561 17932
1487 1 13 . 1 1 25 25 THR HA H 720 4.359 4.359 3.763 0.596 17932
1488 1 13 . 1 1 25 25 THR H H 720 8.296 8.296 8.845 -0.549 17932
1489 1 13 . 1 1 26 26 ILE N N 721 122.588 122.588 114.583 8.005 17932
1490 1 13 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.273 -0.240 17932
1491 1 13 . 1 1 26 26 ILE H H 721 8.156 8.156 7.585 0.571 17932
1492 1 13 . 1 1 27 27 HIS N N 722 122.251 122.251 116.954 5.297 17932
1493 1 13 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.651 -0.090 17932
1494 1 13 . 1 1 27 27 HIS H H 722 8.346 8.346 7.762 0.584 17932
1495 1 13 . 1 1 28 28 ASP N N 723 120.954 120.954 119.714 1.240 17932
1496 1 13 . 1 1 28 28 ASP HA H 723 4.552 4.552 2.793 1.759 17932
1497 1 13 . 1 1 28 28 ASP H H 723 8.155 8.155 8.453 -0.298 17932
1498 1 13 . 1 1 29 29 ARG N N 724 121.468 121.468 117.547 3.921 17932
1499 1 13 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.564 -0.378 17932
1500 1 13 . 1 1 29 29 ARG H H 724 8.322 8.322 8.106 0.216 17932
1501 1 13 . 1 1 30 30 LYS N N 725 121.800 121.800 120.567 1.233 17932
1502 1 13 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.059 0.114 17932
1503 1 13 . 1 1 30 30 LYS H H 725 8.382 8.382 8.126 0.256 17932
1504 1 13 . 1 1 31 31 GLU N N 726 120.681 120.681 119.059 1.622 17932
1505 1 13 . 1 1 31 31 GLU HA H 726 4.145 4.145 4.045 0.100 17932
1506 1 13 . 1 1 31 31 GLU H H 726 8.323 8.323 7.721 0.602 17932
1507 1 13 . 1 1 32 32 PHE N N 727 120.355 120.355 114.911 5.444 17932
1508 1 13 . 1 1 32 32 PHE HA H 727 4.486 4.486 3.522 0.964 17932
1509 1 13 . 1 1 32 32 PHE H H 727 8.151 8.151 7.612 0.538 17932
1510 1 13 . 1 1 33 33 ALA N N 728 123.526 123.526 121.007 2.519 17932
1511 1 13 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.297 -0.107 17932
1512 1 13 . 1 1 33 33 ALA H H 728 8.114 8.114 7.394 0.720 17932
1513 1 13 . 1 1 34 34 LYS N N 729 119.476 119.476 115.621 3.855 17932
1514 1 13 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.559 -0.408 17932
1515 1 13 . 1 1 34 34 LYS H H 729 7.957 7.957 7.643 0.314 17932
1516 1 13 . 1 1 35 35 PHE N N 730 120.504 120.504 115.838 4.666 17932
1517 1 13 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.083 0.368 17932
1518 1 13 . 1 1 35 35 PHE H H 730 8.040 8.040 7.714 0.326 17932
1519 1 13 . 1 1 36 36 GLU N N 731 120.883 120.883 116.026 4.857 17932
1520 1 13 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.362 0.669 17932
1521 1 13 . 1 1 36 36 GLU H H 731 8.281 8.281 8.425 -0.144 17932
1522 1 13 . 1 1 37 37 GLU N N 732 120.686 120.686 119.707 0.979 17932
1523 1 13 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.319 -0.280 17932
1524 1 13 . 1 1 37 37 GLU H H 732 8.222 8.222 8.038 0.184 17932
1525 1 13 . 1 1 38 38 GLU N N 733 121.278 121.278 118.532 2.746 17932
1526 1 13 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.658 -0.578 17932
1527 1 13 . 1 1 38 38 GLU H H 733 8.202 8.202 8.373 -0.171 17932
1528 1 13 . 1 1 39 39 ARG N N 734 120.498 120.498 121.512 -1.014 17932
1529 1 13 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.284 -0.242 17932
1530 1 13 . 1 1 39 39 ARG H H 734 8.102 8.102 8.588 -0.486 17932
1531 1 13 . 1 1 40 40 ALA N N 735 123.267 123.267 119.781 3.486 17932
1532 1 13 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.387 -0.227 17932
1533 1 13 . 1 1 40 40 ALA H H 735 7.934 7.934 7.978 -0.044 17932
1534 1 13 . 1 1 41 41 ARG N N 736 118.979 118.979 115.518 3.461 17932
1535 1 13 . 1 1 41 41 ARG HA H 736 4.111 4.111 3.839 0.272 17932
1536 1 13 . 1 1 41 41 ARG H H 736 7.926 7.926 7.575 0.351 17932
1537 1 13 . 1 1 42 42 ALA N N 737 122.585 122.585 116.526 6.059 17932
1538 1 13 . 1 1 42 42 ALA HA H 737 4.160 4.160 3.909 0.251 17932
1539 1 13 . 1 1 42 42 ALA H H 737 7.944 7.944 9.040 -1.096 17932
1540 1 13 . 1 1 43 43 LYS N N 738 118.696 118.696 117.782 0.914 17932
1541 1 13 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.794 0.283 17932
1542 1 13 . 1 1 43 43 LYS H H 738 7.875 7.875 7.692 0.183 17932
1543 1 13 . 1 1 44 44 TRP N N 739 120.356 120.356 114.593 5.763 17932
1544 1 13 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.529 0.102 17932
1545 1 13 . 1 1 44 44 TRP H H 739 7.851 7.851 6.872 0.979 17932
1546 1 13 . 1 1 45 45 ASP N N 740 121.704 121.704 117.477 4.227 17932
1547 1 13 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.853 -0.227 17932
1548 1 13 . 1 1 45 45 ASP H H 740 8.186 8.186 8.796 -0.610 17932
1549 1 13 . 1 1 46 46 THR N N 741 113.983 113.983 113.704 0.279 17932
1550 1 13 . 1 1 46 46 THR HA H 741 4.579 4.579 4.238 0.341 17932
1551 1 13 . 1 1 46 46 THR H H 741 7.981 7.981 8.035 -0.054 17932
1552 1 13 . 1 1 47 47 ALA N N 742 124.742 124.742 121.181 3.561 17932
1553 1 13 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.068 0.123 17932
1554 1 13 . 1 1 47 47 ALA H H 742 8.158 8.158 7.906 0.252 17932
1555 1 13 . 1 1 48 48 ASN N N 743 116.202 116.202 114.232 1.970 17932
1556 1 13 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.837 -0.237 17932
1557 1 13 . 1 1 48 48 ASN H H 743 8.103 8.103 8.081 0.022 17932
1558 1 13 . 1 1 49 49 ASN N N 744 119.857 119.857 117.943 1.914 17932
1559 1 13 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.105 -0.219 17932
1560 1 13 . 1 1 49 49 ASN H H 744 8.095 8.095 8.206 -0.111 17932
1561 1 13 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.342 0.004 17932
1562 1 13 . 1 1 54 54 GLU N N 749 121.972 121.972 120.822 1.150 17932
1563 1 13 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.527 -0.353 17932
1564 1 13 . 1 1 54 54 GLU H H 749 8.331 8.331 8.655 -0.324 17932
1565 1 13 . 1 1 55 55 ALA N N 750 125.344 125.344 120.449 4.895 17932
1566 1 13 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.678 -0.353 17932
1567 1 13 . 1 1 55 55 ALA H H 750 8.406 8.406 8.159 0.247 17932
1568 1 13 . 1 1 56 56 THR N N 751 112.838 112.838 113.194 -0.356 17932
1569 1 13 . 1 1 56 56 THR HA H 751 4.328 4.328 4.659 -0.331 17932
1570 1 13 . 1 1 56 56 THR H H 751 8.089 8.089 8.197 -0.108 17932
1571 1 13 . 1 1 57 57 SER N N 752 117.970 117.970 116.809 1.161 17932
1572 1 13 . 1 1 57 57 SER HA H 752 4.490 4.490 4.680 -0.190 17932
1573 1 13 . 1 1 57 57 SER H H 752 8.272 8.272 8.582 -0.310 17932
1574 1 13 . 1 1 58 58 THR N N 753 115.676 115.676 113.353 2.323 17932
1575 1 13 . 1 1 58 58 THR HA H 753 4.333 4.333 5.110 -0.777 17932
1576 1 13 . 1 1 58 58 THR H H 753 8.090 8.090 7.761 0.329 17932
1577 1 13 . 1 1 59 59 PHE N N 754 122.160 122.160 121.521 0.639 17932
1578 1 13 . 1 1 59 59 PHE HA H 754 4.713 4.713 4.948 -0.235 17932
1579 1 13 . 1 1 59 59 PHE H H 754 8.187 8.187 9.292 -1.105 17932
1580 1 13 . 1 1 60 60 THR N N 755 115.583 115.583 113.246 2.337 17932
1581 1 13 . 1 1 60 60 THR HA H 755 4.265 4.265 3.582 0.683 17932
1582 1 13 . 1 1 60 60 THR H H 755 8.015 8.015 7.464 0.551 17932
1583 1 13 . 1 1 61 61 ASN N N 756 121.324 121.324 115.665 5.659 17932
1584 1 13 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.797 -0.044 17932
1585 1 13 . 1 1 61 61 ASN H H 756 8.340 8.340 7.365 0.975 17932
1586 1 13 . 1 1 62 62 ILE N N 757 121.251 121.251 117.833 3.418 17932
1587 1 13 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.610 -0.434 17932
1588 1 13 . 1 1 62 62 ILE H H 757 8.076 8.076 8.666 -0.590 17932
1589 1 13 . 1 1 63 63 THR N N 758 118.250 118.250 117.494 0.756 17932
1590 1 13 . 1 1 63 63 THR HA H 758 4.264 4.264 4.407 -0.143 17932
1591 1 13 . 1 1 63 63 THR H H 758 8.140 8.140 7.844 0.296 17932
1592 1 13 . 1 1 64 64 TYR N N 759 123.728 123.728 124.163 -0.435 17932
1593 1 13 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.914 -0.386 17932
1594 1 13 . 1 1 64 64 TYR H H 759 8.233 8.233 7.811 0.422 17932
1595 1 13 . 1 1 65 65 ARG N N 760 124.423 124.423 120.697 3.726 17932
1596 1 13 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.409 -0.168 17932
1597 1 13 . 1 1 65 65 ARG H H 760 8.226 8.226 8.228 -0.002 17932
1598 1 13 . 1 1 66 66 GLY N N 761 109.761 109.761 109.250 0.511 17932
1599 1 13 . 1 1 66 66 GLY H H 761 7.700 7.700 7.816 -0.116 17932
1600 1 14 . 1 1 22 22 LEU N N 717 123.186 123.186 121.096 2.090 17932
1601 1 14 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.191 0.109 17932
1602 1 14 . 1 1 22 22 LEU H H 717 8.121 8.121 8.207 -0.086 17932
1603 1 14 . 1 1 23 23 LEU N N 718 123.575 123.575 115.961 7.614 17932
1604 1 14 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.282 0.069 17932
1605 1 14 . 1 1 23 23 LEU H H 718 8.189 8.189 7.749 0.440 17932
1606 1 14 . 1 1 24 24 ILE N N 719 121.952 121.952 112.302 9.650 17932
1607 1 14 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.172 0.091 17932
1608 1 14 . 1 1 24 24 ILE H H 719 8.079 8.079 7.417 0.662 17932
1609 1 14 . 1 1 25 25 THR N N 720 118.098 118.098 114.290 3.808 17932
1610 1 14 . 1 1 25 25 THR HA H 720 4.359 4.359 4.023 0.336 17932
1611 1 14 . 1 1 25 25 THR H H 720 8.296 8.296 8.035 0.261 17932
1612 1 14 . 1 1 26 26 ILE N N 721 122.588 122.588 112.470 10.118 17932
1613 1 14 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.141 -0.108 17932
1614 1 14 . 1 1 26 26 ILE H H 721 8.156 8.156 7.552 0.604 17932
1615 1 14 . 1 1 27 27 HIS N N 722 122.251 122.251 117.913 4.338 17932
1616 1 14 . 1 1 27 27 HIS HA H 722 4.561 4.561 5.234 -0.673 17932
1617 1 14 . 1 1 27 27 HIS H H 722 8.346 8.346 7.986 0.360 17932
1618 1 14 . 1 1 28 28 ASP N N 723 120.954 120.954 116.905 4.049 17932
1619 1 14 . 1 1 28 28 ASP HA H 723 4.552 4.552 4.813 -0.261 17932
1620 1 14 . 1 1 28 28 ASP H H 723 8.155 8.155 8.093 0.062 17932
1621 1 14 . 1 1 29 29 ARG N N 724 121.468 121.468 120.552 0.916 17932
1622 1 14 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.707 -0.521 17932
1623 1 14 . 1 1 29 29 ARG H H 724 8.322 8.322 8.075 0.247 17932
1624 1 14 . 1 1 30 30 LYS N N 725 121.800 121.800 121.146 0.654 17932
1625 1 14 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.110 0.063 17932
1626 1 14 . 1 1 30 30 LYS H H 725 8.382 8.382 8.597 -0.215 17932
1627 1 14 . 1 1 31 31 GLU N N 726 120.681 120.681 118.901 1.780 17932
1628 1 14 . 1 1 31 31 GLU HA H 726 4.145 4.145 3.839 0.306 17932
1629 1 14 . 1 1 31 31 GLU H H 726 8.323 8.323 8.420 -0.097 17932
1630 1 14 . 1 1 32 32 PHE N N 727 120.355 120.355 116.652 3.703 17932
1631 1 14 . 1 1 32 32 PHE HA H 727 4.486 4.486 3.814 0.672 17932
1632 1 14 . 1 1 32 32 PHE H H 727 8.151 8.151 7.354 0.797 17932
1633 1 14 . 1 1 33 33 ALA N N 728 123.526 123.526 121.377 2.149 17932
1634 1 14 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.301 -0.111 17932
1635 1 14 . 1 1 33 33 ALA H H 728 8.114 8.114 7.491 0.623 17932
1636 1 14 . 1 1 34 34 LYS N N 729 119.476 119.476 116.602 2.874 17932
1637 1 14 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.462 -0.311 17932
1638 1 14 . 1 1 34 34 LYS H H 729 7.957 7.957 7.777 0.180 17932
1639 1 14 . 1 1 35 35 PHE N N 730 120.504 120.504 114.667 5.837 17932
1640 1 14 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.130 0.321 17932
1641 1 14 . 1 1 35 35 PHE H H 730 8.040 8.040 7.312 0.728 17932
1642 1 14 . 1 1 36 36 GLU N N 731 120.883 120.883 115.945 4.938 17932
1643 1 14 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.685 0.346 17932
1644 1 14 . 1 1 36 36 GLU H H 731 8.281 8.281 8.349 -0.068 17932
1645 1 14 . 1 1 37 37 GLU N N 732 120.686 120.686 119.880 0.806 17932
1646 1 14 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.265 -0.226 17932
1647 1 14 . 1 1 37 37 GLU H H 732 8.222 8.222 7.585 0.637 17932
1648 1 14 . 1 1 38 38 GLU N N 733 121.278 121.278 118.446 2.832 17932
1649 1 14 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.261 -0.181 17932
1650 1 14 . 1 1 38 38 GLU H H 733 8.202 8.202 8.464 -0.262 17932
1651 1 14 . 1 1 39 39 ARG N N 734 120.498 120.498 121.894 -1.396 17932
1652 1 14 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.063 -0.021 17932
1653 1 14 . 1 1 39 39 ARG H H 734 8.102 8.102 8.811 -0.709 17932
1654 1 14 . 1 1 40 40 ALA N N 735 123.267 123.267 118.918 4.349 17932
1655 1 14 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.367 -0.207 17932
1656 1 14 . 1 1 40 40 ALA H H 735 7.934 7.934 8.144 -0.210 17932
1657 1 14 . 1 1 41 41 ARG N N 736 118.979 118.979 116.394 2.585 17932
1658 1 14 . 1 1 41 41 ARG HA H 736 4.111 4.111 4.087 0.024 17932
1659 1 14 . 1 1 41 41 ARG H H 736 7.926 7.926 7.927 -0.001 17932
1660 1 14 . 1 1 42 42 ALA N N 737 122.585 122.585 119.128 3.457 17932
1661 1 14 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.315 -0.155 17932
1662 1 14 . 1 1 42 42 ALA H H 737 7.944 7.944 8.720 -0.776 17932
1663 1 14 . 1 1 43 43 LYS N N 738 118.696 118.696 117.801 0.895 17932
1664 1 14 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.820 0.257 17932
1665 1 14 . 1 1 43 43 LYS H H 738 7.875 7.875 7.867 0.008 17932
1666 1 14 . 1 1 44 44 TRP N N 739 120.356 120.356 114.253 6.103 17932
1667 1 14 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.622 0.009 17932
1668 1 14 . 1 1 44 44 TRP H H 739 7.851 7.851 7.050 0.801 17932
1669 1 14 . 1 1 45 45 ASP N N 740 121.704 121.704 119.265 2.439 17932
1670 1 14 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.884 -0.258 17932
1671 1 14 . 1 1 45 45 ASP H H 740 8.186 8.186 8.503 -0.317 17932
1672 1 14 . 1 1 46 46 THR N N 741 113.983 113.983 118.581 -4.598 17932
1673 1 14 . 1 1 46 46 THR HA H 741 4.579 4.579 4.673 -0.094 17932
1674 1 14 . 1 1 46 46 THR H H 741 7.981 7.981 8.617 -0.636 17932
1675 1 14 . 1 1 47 47 ALA N N 742 124.742 124.742 124.159 0.583 17932
1676 1 14 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.577 -0.386 17932
1677 1 14 . 1 1 47 47 ALA H H 742 8.158 8.158 8.773 -0.615 17932
1678 1 14 . 1 1 48 48 ASN N N 743 116.202 116.202 117.051 -0.849 17932
1679 1 14 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.702 -0.102 17932
1680 1 14 . 1 1 48 48 ASN H H 743 8.103 8.103 9.174 -1.071 17932
1681 1 14 . 1 1 49 49 ASN N N 744 119.857 119.857 116.802 3.055 17932
1682 1 14 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.049 -0.163 17932
1683 1 14 . 1 1 49 49 ASN H H 744 8.095 8.095 8.708 -0.613 17932
1684 1 14 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.438 -0.092 17932
1685 1 14 . 1 1 54 54 GLU N N 749 121.972 121.972 121.106 0.866 17932
1686 1 14 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.413 -0.239 17932
1687 1 14 . 1 1 54 54 GLU H H 749 8.331 8.331 8.419 -0.088 17932
1688 1 14 . 1 1 55 55 ALA N N 750 125.344 125.344 121.557 3.787 17932
1689 1 14 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.629 -0.304 17932
1690 1 14 . 1 1 55 55 ALA H H 750 8.406 8.406 8.080 0.326 17932
1691 1 14 . 1 1 56 56 THR N N 751 112.838 112.838 113.588 -0.750 17932
1692 1 14 . 1 1 56 56 THR HA H 751 4.328 4.328 4.489 -0.161 17932
1693 1 14 . 1 1 56 56 THR H H 751 8.089 8.089 8.379 -0.290 17932
1694 1 14 . 1 1 57 57 SER N N 752 117.970 117.970 116.082 1.888 17932
1695 1 14 . 1 1 57 57 SER HA H 752 4.490 4.490 4.663 -0.173 17932
1696 1 14 . 1 1 57 57 SER H H 752 8.272 8.272 8.566 -0.294 17932
1697 1 14 . 1 1 58 58 THR N N 753 115.676 115.676 116.396 -0.720 17932
1698 1 14 . 1 1 58 58 THR HA H 753 4.333 4.333 4.785 -0.452 17932
1699 1 14 . 1 1 58 58 THR H H 753 8.090 8.090 7.607 0.483 17932
1700 1 14 . 1 1 59 59 PHE N N 754 122.160 122.160 119.144 3.016 17932
1701 1 14 . 1 1 59 59 PHE HA H 754 4.713 4.713 4.835 -0.122 17932
1702 1 14 . 1 1 59 59 PHE H H 754 8.187 8.187 8.442 -0.255 17932
1703 1 14 . 1 1 60 60 THR N N 755 115.583 115.583 115.883 -0.300 17932
1704 1 14 . 1 1 60 60 THR HA H 755 4.265 4.265 3.795 0.470 17932
1705 1 14 . 1 1 60 60 THR H H 755 8.015 8.015 6.850 1.165 17932
1706 1 14 . 1 1 61 61 ASN N N 756 121.324 121.324 113.842 7.482 17932
1707 1 14 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.776 -0.023 17932
1708 1 14 . 1 1 61 61 ASN H H 756 8.340 8.340 7.537 0.803 17932
1709 1 14 . 1 1 62 62 ILE N N 757 121.251 121.251 115.476 5.775 17932
1710 1 14 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.641 -0.465 17932
1711 1 14 . 1 1 62 62 ILE H H 757 8.076 8.076 8.287 -0.211 17932
1712 1 14 . 1 1 63 63 THR N N 758 118.250 118.250 113.384 4.866 17932
1713 1 14 . 1 1 63 63 THR HA H 758 4.264 4.264 4.172 0.092 17932
1714 1 14 . 1 1 63 63 THR H H 758 8.140 8.140 7.842 0.298 17932
1715 1 14 . 1 1 64 64 TYR N N 759 123.728 123.728 119.948 3.780 17932
1716 1 14 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.322 0.206 17932
1717 1 14 . 1 1 64 64 TYR H H 759 8.233 8.233 7.645 0.588 17932
1718 1 14 . 1 1 65 65 ARG N N 760 124.423 124.423 120.818 3.605 17932
1719 1 14 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.365 -0.124 17932
1720 1 14 . 1 1 65 65 ARG H H 760 8.226 8.226 8.408 -0.182 17932
1721 1 14 . 1 1 66 66 GLY N N 761 109.761 109.761 108.315 1.446 17932
1722 1 14 . 1 1 66 66 GLY H H 761 7.700 7.700 7.689 0.011 17932
1723 1 15 . 1 1 22 22 LEU N N 717 123.186 123.186 119.482 3.704 17932
1724 1 15 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.543 -0.243 17932
1725 1 15 . 1 1 22 22 LEU H H 717 8.121 8.121 7.548 0.573 17932
1726 1 15 . 1 1 23 23 LEU N N 718 123.575 123.575 115.622 7.953 17932
1727 1 15 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.527 -0.177 17932
1728 1 15 . 1 1 23 23 LEU H H 718 8.189 8.189 8.524 -0.335 17932
1729 1 15 . 1 1 24 24 ILE N N 719 121.952 121.952 116.310 5.642 17932
1730 1 15 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.197 0.066 17932
1731 1 15 . 1 1 24 24 ILE H H 719 8.079 8.079 8.744 -0.665 17932
1732 1 15 . 1 1 25 25 THR N N 720 118.098 118.098 112.136 5.962 17932
1733 1 15 . 1 1 25 25 THR HA H 720 4.359 4.359 3.854 0.505 17932
1734 1 15 . 1 1 25 25 THR H H 720 8.296 8.296 8.456 -0.160 17932
1735 1 15 . 1 1 26 26 ILE N N 721 122.588 122.588 113.087 9.501 17932
1736 1 15 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.339 -0.306 17932
1737 1 15 . 1 1 26 26 ILE H H 721 8.156 8.156 8.400 -0.244 17932
1738 1 15 . 1 1 27 27 HIS N N 722 122.251 122.251 118.312 3.939 17932
1739 1 15 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.615 -0.054 17932
1740 1 15 . 1 1 27 27 HIS H H 722 8.346 8.346 8.213 0.133 17932
1741 1 15 . 1 1 28 28 ASP N N 723 120.954 120.954 119.810 1.144 17932
1742 1 15 . 1 1 28 28 ASP HA H 723 4.552 4.552 2.583 1.969 17932
1743 1 15 . 1 1 28 28 ASP H H 723 8.155 8.155 8.375 -0.220 17932
1744 1 15 . 1 1 29 29 ARG N N 724 121.468 121.468 115.187 6.281 17932
1745 1 15 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.608 -0.422 17932
1746 1 15 . 1 1 29 29 ARG H H 724 8.322 8.322 7.868 0.454 17932
1747 1 15 . 1 1 30 30 LYS N N 725 121.800 121.800 120.143 1.657 17932
1748 1 15 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.141 0.032 17932
1749 1 15 . 1 1 30 30 LYS H H 725 8.382 8.382 7.851 0.531 17932
1750 1 15 . 1 1 31 31 GLU N N 726 120.681 120.681 118.187 2.494 17932
1751 1 15 . 1 1 31 31 GLU HA H 726 4.145 4.145 4.423 -0.278 17932
1752 1 15 . 1 1 31 31 GLU H H 726 8.323 8.323 7.971 0.352 17932
1753 1 15 . 1 1 32 32 PHE N N 727 120.355 120.355 116.515 3.840 17932
1754 1 15 . 1 1 32 32 PHE HA H 727 4.486 4.486 3.858 0.628 17932
1755 1 15 . 1 1 32 32 PHE H H 727 8.151 8.151 7.224 0.927 17932
1756 1 15 . 1 1 33 33 ALA N N 728 123.526 123.526 120.336 3.190 17932
1757 1 15 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.254 -0.064 17932
1758 1 15 . 1 1 33 33 ALA H H 728 8.114 8.114 7.021 1.093 17932
1759 1 15 . 1 1 34 34 LYS N N 729 119.476 119.476 116.139 3.337 17932
1760 1 15 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.500 -0.349 17932
1761 1 15 . 1 1 34 34 LYS H H 729 7.957 7.957 7.469 0.488 17932
1762 1 15 . 1 1 35 35 PHE N N 730 120.504 120.504 113.962 6.542 17932
1763 1 15 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.306 0.145 17932
1764 1 15 . 1 1 35 35 PHE H H 730 8.040 8.040 7.624 0.416 17932
1765 1 15 . 1 1 36 36 GLU N N 731 120.883 120.883 116.412 4.471 17932
1766 1 15 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.284 0.747 17932
1767 1 15 . 1 1 36 36 GLU H H 731 8.281 8.281 8.505 -0.224 17932
1768 1 15 . 1 1 37 37 GLU N N 732 120.686 120.686 119.333 1.353 17932
1769 1 15 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.249 -0.210 17932
1770 1 15 . 1 1 37 37 GLU H H 732 8.222 8.222 8.019 0.203 17932
1771 1 15 . 1 1 38 38 GLU N N 733 121.278 121.278 118.851 2.427 17932
1772 1 15 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.658 -0.578 17932
1773 1 15 . 1 1 38 38 GLU H H 733 8.202 8.202 8.479 -0.277 17932
1774 1 15 . 1 1 39 39 ARG N N 734 120.498 120.498 121.978 -1.480 17932
1775 1 15 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.293 -0.251 17932
1776 1 15 . 1 1 39 39 ARG H H 734 8.102 8.102 8.983 -0.881 17932
1777 1 15 . 1 1 40 40 ALA N N 735 123.267 123.267 119.006 4.261 17932
1778 1 15 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.394 -0.234 17932
1779 1 15 . 1 1 40 40 ALA H H 735 7.934 7.934 7.940 -0.006 17932
1780 1 15 . 1 1 41 41 ARG N N 736 118.979 118.979 116.130 2.849 17932
1781 1 15 . 1 1 41 41 ARG HA H 736 4.111 4.111 3.946 0.165 17932
1782 1 15 . 1 1 41 41 ARG H H 736 7.926 7.926 7.828 0.098 17932
1783 1 15 . 1 1 42 42 ALA N N 737 122.585 122.585 118.971 3.614 17932
1784 1 15 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.103 0.057 17932
1785 1 15 . 1 1 42 42 ALA H H 737 7.944 7.944 9.630 -1.686 17932
1786 1 15 . 1 1 43 43 LYS N N 738 118.696 118.696 118.891 -0.195 17932
1787 1 15 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.829 0.248 17932
1788 1 15 . 1 1 43 43 LYS H H 738 7.875 7.875 7.976 -0.101 17932
1789 1 15 . 1 1 44 44 TRP N N 739 120.356 120.356 115.092 5.264 17932
1790 1 15 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.501 0.130 17932
1791 1 15 . 1 1 44 44 TRP H H 739 7.851 7.851 6.920 0.931 17932
1792 1 15 . 1 1 45 45 ASP N N 740 121.704 121.704 118.745 2.959 17932
1793 1 15 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.866 -0.240 17932
1794 1 15 . 1 1 45 45 ASP H H 740 8.186 8.186 8.915 -0.729 17932
1795 1 15 . 1 1 46 46 THR N N 741 113.983 113.983 114.712 -0.729 17932
1796 1 15 . 1 1 46 46 THR HA H 741 4.579 4.579 4.224 0.355 17932
1797 1 15 . 1 1 46 46 THR H H 741 7.981 7.981 8.740 -0.759 17932
1798 1 15 . 1 1 47 47 ALA N N 742 124.742 124.742 120.557 4.185 17932
1799 1 15 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.380 -0.189 17932
1800 1 15 . 1 1 47 47 ALA H H 742 8.158 8.158 7.618 0.540 17932
1801 1 15 . 1 1 48 48 ASN N N 743 116.202 116.202 118.388 -2.186 17932
1802 1 15 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.790 -0.190 17932
1803 1 15 . 1 1 48 48 ASN H H 743 8.103 8.103 9.535 -1.432 17932
1804 1 15 . 1 1 49 49 ASN N N 744 119.857 119.857 118.301 1.556 17932
1805 1 15 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.069 -0.183 17932
1806 1 15 . 1 1 49 49 ASN H H 744 8.095 8.095 8.545 -0.450 17932
1807 1 15 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.461 -0.115 17932
1808 1 15 . 1 1 54 54 GLU N N 749 121.972 121.972 122.097 -0.125 17932
1809 1 15 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.550 -0.376 17932
1810 1 15 . 1 1 54 54 GLU H H 749 8.331 8.331 8.514 -0.183 17932
1811 1 15 . 1 1 55 55 ALA N N 750 125.344 125.344 123.273 2.071 17932
1812 1 15 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.582 -0.257 17932
1813 1 15 . 1 1 55 55 ALA H H 750 8.406 8.406 7.657 0.749 17932
1814 1 15 . 1 1 56 56 THR N N 751 112.838 112.838 114.819 -1.981 17932
1815 1 15 . 1 1 56 56 THR HA H 751 4.328 4.328 4.724 -0.396 17932
1816 1 15 . 1 1 56 56 THR H H 751 8.089 8.089 8.273 -0.184 17932
1817 1 15 . 1 1 57 57 SER N N 752 117.970 117.970 120.771 -2.801 17932
1818 1 15 . 1 1 57 57 SER HA H 752 4.490 4.490 4.899 -0.409 17932
1819 1 15 . 1 1 57 57 SER H H 752 8.272 8.272 8.724 -0.452 17932
1820 1 15 . 1 1 58 58 THR N N 753 115.676 115.676 116.460 -0.784 17932
1821 1 15 . 1 1 58 58 THR HA H 753 4.333 4.333 5.186 -0.853 17932
1822 1 15 . 1 1 58 58 THR H H 753 8.090 8.090 8.061 0.029 17932
1823 1 15 . 1 1 59 59 PHE N N 754 122.160 122.160 122.205 -0.045 17932
1824 1 15 . 1 1 59 59 PHE HA H 754 4.713 4.713 4.950 -0.237 17932
1825 1 15 . 1 1 59 59 PHE H H 754 8.187 8.187 8.660 -0.473 17932
1826 1 15 . 1 1 60 60 THR N N 755 115.583 115.583 114.899 0.684 17932
1827 1 15 . 1 1 60 60 THR HA H 755 4.265 4.265 3.497 0.768 17932
1828 1 15 . 1 1 60 60 THR H H 755 8.015 8.015 7.691 0.324 17932
1829 1 15 . 1 1 61 61 ASN N N 756 121.324 121.324 118.124 3.200 17932
1830 1 15 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.525 0.228 17932
1831 1 15 . 1 1 61 61 ASN H H 756 8.340 8.340 8.110 0.230 17932
1832 1 15 . 1 1 62 62 ILE N N 757 121.251 121.251 111.117 10.134 17932
1833 1 15 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.733 -0.557 17932
1834 1 15 . 1 1 62 62 ILE H H 757 8.076 8.076 7.754 0.322 17932
1835 1 15 . 1 1 63 63 THR N N 758 118.250 118.250 117.453 0.797 17932
1836 1 15 . 1 1 63 63 THR HA H 758 4.264 4.264 4.318 -0.054 17932
1837 1 15 . 1 1 63 63 THR H H 758 8.140 8.140 8.549 -0.409 17932
1838 1 15 . 1 1 64 64 TYR N N 759 123.728 123.728 119.939 3.789 17932
1839 1 15 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.146 0.382 17932
1840 1 15 . 1 1 64 64 TYR H H 759 8.233 8.233 7.478 0.755 17932
1841 1 15 . 1 1 65 65 ARG N N 760 124.423 124.423 118.258 6.165 17932
1842 1 15 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.513 -0.272 17932
1843 1 15 . 1 1 65 65 ARG H H 760 8.226 8.226 7.774 0.452 17932
1844 1 15 . 1 1 66 66 GLY N N 761 109.761 109.761 110.621 -0.860 17932
1845 1 15 . 1 1 66 66 GLY H H 761 7.700 7.700 7.933 -0.233 17932
stop_
loop_
_SPARTA_output.Data_ID
_SPARTA_output.Entity_delta_chem_shifts_ID
_SPARTA_output.Conformer_ID
_SPARTA_output.Data_type
_SPARTA_output.Data_atom
_SPARTA_output.Data_num_shifts
_SPARTA_output.Data_value
_SPARTA_output.Data_low_range
_SPARTA_output.Data_high_range
_SPARTA_output.Entry_ID
1 1 1 "Average Difference" N 41 3.885 -2.689 2.839 17932
2 1 1 "Average Difference" HA 43 0.452 0.016 0.457 17932
3 1 1 "Average Difference" C 0 0.000 0.000 0.000 17932
4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 17932
5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 17932
6 1 1 "Average Difference" HN 41 0.622 -0.031 0.629 17932
7 1 2 "Average Difference" N 41 4.122 -2.473 3.338 17932
8 1 2 "Average Difference" HA 43 0.389 0.086 0.383 17932
9 1 2 "Average Difference" C 0 0.000 0.000 0.000 17932
10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 17932
11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 17932
12 1 2 "Average Difference" HN 41 0.580 0.016 0.587 17932
13 1 3 "Average Difference" N 41 4.021 -2.762 2.959 17932
14 1 3 "Average Difference" HA 43 0.292 0.038 0.293 17932
15 1 3 "Average Difference" C 0 0.000 0.000 0.000 17932
16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 17932
17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 17932
18 1 3 "Average Difference" HN 41 0.483 -0.018 0.489 17932
19 1 4 "Average Difference" N 41 3.960 -2.791 2.843 17932
20 1 4 "Average Difference" HA 43 0.292 0.046 0.292 17932
21 1 4 "Average Difference" C 0 0.000 0.000 0.000 17932
22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 17932
23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 17932
24 1 4 "Average Difference" HN 41 0.652 -0.081 0.655 17932
25 1 5 "Average Difference" N 41 3.891 -2.559 2.967 17932
26 1 5 "Average Difference" HA 43 0.443 -0.018 0.448 17932
27 1 5 "Average Difference" C 0 0.000 0.000 0.000 17932
28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 17932
29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 17932
30 1 5 "Average Difference" HN 41 0.594 -0.026 0.601 17932
31 1 6 "Average Difference" N 41 3.847 -2.640 2.833 17932
32 1 6 "Average Difference" HA 43 0.348 0.058 0.348 17932
33 1 6 "Average Difference" C 0 0.000 0.000 0.000 17932
34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 17932
35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 17932
36 1 6 "Average Difference" HN 41 0.622 -0.044 0.628 17932
37 1 7 "Average Difference" N 41 3.876 -2.217 3.219 17932
38 1 7 "Average Difference" HA 43 0.421 0.039 0.425 17932
39 1 7 "Average Difference" C 0 0.000 0.000 0.000 17932
40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 17932
41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 17932
42 1 7 "Average Difference" HN 41 0.587 -0.060 0.591 17932
43 1 8 "Average Difference" N 41 3.950 -3.068 2.519 17932
44 1 8 "Average Difference" HA 43 0.337 0.012 0.340 17932
45 1 8 "Average Difference" C 0 0.000 0.000 0.000 17932
46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 17932
47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 17932
48 1 8 "Average Difference" HN 41 0.664 -0.042 0.671 17932
49 1 9 "Average Difference" N 41 3.940 -3.004 2.582 17932
50 1 9 "Average Difference" HA 43 0.449 -0.007 0.454 17932
51 1 9 "Average Difference" C 0 0.000 0.000 0.000 17932
52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 17932
53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 17932
54 1 9 "Average Difference" HN 41 0.530 -0.107 0.525 17932
55 1 10 "Average Difference" N 41 3.936 -3.010 2.567 17932
56 1 10 "Average Difference" HA 43 0.466 -0.003 0.472 17932
57 1 10 "Average Difference" C 0 0.000 0.000 0.000 17932
58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 17932
59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 17932
60 1 10 "Average Difference" HN 41 0.614 -0.140 0.605 17932
61 1 11 "Average Difference" N 41 3.962 -2.732 2.904 17932
62 1 11 "Average Difference" HA 43 0.370 -0.020 0.374 17932
63 1 11 "Average Difference" C 0 0.000 0.000 0.000 17932
64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 17932
65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 17932
66 1 11 "Average Difference" HN 41 0.645 -0.069 0.650 17932
67 1 12 "Average Difference" N 41 3.986 -2.937 2.729 17932
68 1 12 "Average Difference" HA 43 0.464 0.020 0.469 17932
69 1 12 "Average Difference" C 0 0.000 0.000 0.000 17932
70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 17932
71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 17932
72 1 12 "Average Difference" HN 41 0.518 -0.048 0.522 17932
73 1 13 "Average Difference" N 41 3.732 -3.028 2.207 17932
74 1 13 "Average Difference" HA 43 0.447 -0.014 0.452 17932
75 1 13 "Average Difference" C 0 0.000 0.000 0.000 17932
76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 17932
77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 17932
78 1 13 "Average Difference" HN 41 0.500 -0.066 0.502 17932
79 1 14 "Average Difference" N 41 4.108 -2.915 2.931 17932
80 1 14 "Average Difference" HA 43 0.283 0.045 0.282 17932
81 1 14 "Average Difference" C 0 0.000 0.000 0.000 17932
82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 17932
83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 17932
84 1 14 "Average Difference" HN 41 0.510 -0.075 0.511 17932
85 1 15 "Average Difference" N 41 4.113 -2.775 3.073 17932
86 1 15 "Average Difference" HA 43 0.461 0.018 0.466 17932
87 1 15 "Average Difference" C 0 0.000 0.000 0.000 17932
88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 17932
89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 17932
90 1 15 "Average Difference" HN 41 0.600 0.012 0.607 17932
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 17932
_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 22 22 LEU N N 717 123.186 123.186 120.607 2.579 17932
2 1 . 1 1 22 22 LEU HA H 717 4.300 4.300 4.433 -0.133 17932
3 1 . 1 1 22 22 LEU H H 717 8.121 8.121 8.118 0.003 17932
4 1 . 1 1 23 23 LEU N N 718 123.575 123.575 115.832 7.743 17932
5 1 . 1 1 23 23 LEU HA H 718 4.350 4.350 4.472 -0.122 17932
6 1 . 1 1 23 23 LEU H H 718 8.189 8.189 8.196 -0.007 17932
7 1 . 1 1 24 24 ILE N N 719 121.952 121.952 114.579 7.373 17932
8 1 . 1 1 24 24 ILE HA H 719 4.263 4.263 4.160 0.103 17932
9 1 . 1 1 24 24 ILE H H 719 8.079 8.079 8.053 0.026 17932
10 1 . 1 1 25 25 THR N N 720 118.098 118.098 113.811 4.287 17932
11 1 . 1 1 25 25 THR HA H 720 4.359 4.359 3.872 0.487 17932
12 1 . 1 1 25 25 THR H H 720 8.296 8.296 8.192 0.104 17932
13 1 . 1 1 26 26 ILE N N 721 122.588 122.588 113.287 9.301 17932
14 1 . 1 1 26 26 ILE HA H 721 4.033 4.033 4.259 -0.226 17932
15 1 . 1 1 26 26 ILE H H 721 8.156 8.156 7.881 0.275 17932
16 1 . 1 1 27 27 HIS N N 722 122.251 122.251 118.026 4.225 17932
17 1 . 1 1 27 27 HIS HA H 722 4.561 4.561 4.686 -0.125 17932
18 1 . 1 1 27 27 HIS H H 722 8.346 8.346 8.010 0.336 17932
19 1 . 1 1 28 28 ASP N N 723 120.954 120.954 119.812 1.142 17932
20 1 . 1 1 28 28 ASP HA H 723 4.552 4.552 3.177 1.375 17932
21 1 . 1 1 28 28 ASP H H 723 8.155 8.155 8.344 -0.189 17932
22 1 . 1 1 29 29 ARG N N 724 121.468 121.468 117.056 4.412 17932
23 1 . 1 1 29 29 ARG HA H 724 4.186 4.186 4.534 -0.348 17932
24 1 . 1 1 29 29 ARG H H 724 8.322 8.322 7.967 0.355 17932
25 1 . 1 1 30 30 LYS N N 725 121.800 121.800 119.843 1.957 17932
26 1 . 1 1 30 30 LYS HA H 725 4.173 4.173 4.123 0.050 17932
27 1 . 1 1 30 30 LYS H H 725 8.382 8.382 7.753 0.629 17932
28 1 . 1 1 31 31 GLU N N 726 120.681 120.681 118.387 2.294 17932
29 1 . 1 1 31 31 GLU HA H 726 4.145 4.145 4.206 -0.061 17932
30 1 . 1 1 31 31 GLU H H 726 8.323 8.323 7.806 0.517 17932
31 1 . 1 1 32 32 PHE N N 727 120.355 120.355 116.415 3.940 17932
32 1 . 1 1 32 32 PHE HA H 727 4.486 4.486 3.971 0.515 17932
33 1 . 1 1 32 32 PHE H H 727 8.151 8.151 7.138 1.013 17932
34 1 . 1 1 33 33 ALA N N 728 123.526 123.526 121.153 2.373 17932
35 1 . 1 1 33 33 ALA HA H 728 4.190 4.190 4.249 -0.059 17932
36 1 . 1 1 33 33 ALA H H 728 8.114 8.114 7.316 0.798 17932
37 1 . 1 1 34 34 LYS N N 729 119.476 119.476 116.497 2.979 17932
38 1 . 1 1 34 34 LYS HA H 729 4.151 4.151 4.460 -0.309 17932
39 1 . 1 1 34 34 LYS H H 729 7.957 7.957 7.519 0.438 17932
40 1 . 1 1 35 35 PHE N N 730 120.504 120.504 114.321 6.183 17932
41 1 . 1 1 35 35 PHE HA H 730 4.451 4.451 4.288 0.163 17932
42 1 . 1 1 35 35 PHE H H 730 8.040 8.040 7.560 0.480 17932
43 1 . 1 1 36 36 GLU N N 731 120.883 120.883 116.068 4.815 17932
44 1 . 1 1 36 36 GLU HA H 731 4.031 4.031 3.485 0.546 17932
45 1 . 1 1 36 36 GLU H H 731 8.281 8.281 8.424 -0.143 17932
46 1 . 1 1 37 37 GLU N N 732 120.686 120.686 119.433 1.253 17932
47 1 . 1 1 37 37 GLU HA H 732 4.039 4.039 4.224 -0.185 17932
48 1 . 1 1 37 37 GLU H H 732 8.222 8.222 8.000 0.222 17932
49 1 . 1 1 38 38 GLU N N 733 121.278 121.278 118.547 2.731 17932
50 1 . 1 1 38 38 GLU HA H 733 4.080 4.080 4.587 -0.507 17932
51 1 . 1 1 38 38 GLU H H 733 8.202 8.202 8.472 -0.270 17932
52 1 . 1 1 39 39 ARG N N 734 120.498 120.498 121.021 -0.523 17932
53 1 . 1 1 39 39 ARG HA H 734 4.042 4.042 4.219 -0.177 17932
54 1 . 1 1 39 39 ARG H H 734 8.102 8.102 8.972 -0.870 17932
55 1 . 1 1 40 40 ALA N N 735 123.267 123.267 119.115 4.152 17932
56 1 . 1 1 40 40 ALA HA H 735 4.160 4.160 4.367 -0.207 17932
57 1 . 1 1 40 40 ALA H H 735 7.934 7.934 7.909 0.025 17932
58 1 . 1 1 41 41 ARG N N 736 118.979 118.979 116.155 2.824 17932
59 1 . 1 1 41 41 ARG HA H 736 4.111 4.111 3.968 0.143 17932
60 1 . 1 1 41 41 ARG H H 736 7.926 7.926 7.755 0.171 17932
61 1 . 1 1 42 42 ALA N N 737 122.585 122.585 118.617 3.968 17932
62 1 . 1 1 42 42 ALA HA H 737 4.160 4.160 4.127 0.033 17932
63 1 . 1 1 42 42 ALA H H 737 7.944 7.944 9.348 -1.404 17932
64 1 . 1 1 43 43 LYS N N 738 118.696 118.696 118.138 0.558 17932
65 1 . 1 1 43 43 LYS HA H 738 4.077 4.077 3.774 0.303 17932
66 1 . 1 1 43 43 LYS H H 738 7.875 7.875 7.810 0.065 17932
67 1 . 1 1 44 44 TRP N N 739 120.356 120.356 115.430 4.926 17932
68 1 . 1 1 44 44 TRP HA H 739 4.631 4.631 4.562 0.069 17932
69 1 . 1 1 44 44 TRP H H 739 7.851 7.851 6.988 0.863 17932
70 1 . 1 1 45 45 ASP N N 740 121.704 121.704 117.646 4.058 17932
71 1 . 1 1 45 45 ASP HA H 740 4.626 4.626 4.734 -0.108 17932
72 1 . 1 1 45 45 ASP H H 740 8.186 8.186 8.970 -0.784 17932
73 1 . 1 1 46 46 THR N N 741 113.983 113.983 114.422 -0.439 17932
74 1 . 1 1 46 46 THR HA H 741 4.579 4.579 4.355 0.224 17932
75 1 . 1 1 46 46 THR H H 741 7.981 7.981 8.652 -0.671 17932
76 1 . 1 1 47 47 ALA N N 742 124.742 124.742 121.557 3.185 17932
77 1 . 1 1 47 47 ALA HA H 742 4.191 4.191 4.395 -0.204 17932
78 1 . 1 1 47 47 ALA H H 742 8.158 8.158 8.106 0.052 17932
79 1 . 1 1 48 48 ASN N N 743 116.202 116.202 116.653 -0.451 17932
80 1 . 1 1 48 48 ASN HA H 743 4.600 4.600 4.790 -0.190 17932
81 1 . 1 1 48 48 ASN H H 743 8.103 8.103 8.582 -0.479 17932
82 1 . 1 1 49 49 ASN N N 744 119.857 119.857 118.278 1.579 17932
83 1 . 1 1 49 49 ASN HA H 744 4.886 4.886 5.135 -0.249 17932
84 1 . 1 1 49 49 ASN H H 744 8.095 8.095 8.451 -0.356 17932
85 1 . 1 1 50 50 PRO HA H 745 4.346 4.346 4.392 -0.046 17932
86 1 . 1 1 54 54 GLU N N 749 121.972 121.972 121.002 0.970 17932
87 1 . 1 1 54 54 GLU HA H 749 4.174 4.174 4.454 -0.280 17932
88 1 . 1 1 54 54 GLU H H 749 8.331 8.331 8.563 -0.232 17932
89 1 . 1 1 55 55 ALA N N 750 125.344 125.344 122.616 2.728 17932
90 1 . 1 1 55 55 ALA HA H 750 4.325 4.325 4.641 -0.316 17932
91 1 . 1 1 55 55 ALA H H 750 8.406 8.406 7.918 0.488 17932
92 1 . 1 1 56 56 THR N N 751 112.838 112.838 115.023 -2.185 17932
93 1 . 1 1 56 56 THR HA H 751 4.328 4.328 4.634 -0.306 17932
94 1 . 1 1 56 56 THR H H 751 8.089 8.089 8.175 -0.086 17932
95 1 . 1 1 57 57 SER N N 752 117.970 117.970 118.683 -0.713 17932
96 1 . 1 1 57 57 SER HA H 752 4.490 4.490 4.793 -0.303 17932
97 1 . 1 1 57 57 SER H H 752 8.272 8.272 8.672 -0.400 17932
98 1 . 1 1 58 58 THR N N 753 115.676 115.676 115.341 0.335 17932
99 1 . 1 1 58 58 THR HA H 753 4.333 4.333 5.067 -0.734 17932
100 1 . 1 1 58 58 THR H H 753 8.090 8.090 8.094 -0.004 17932
101 1 . 1 1 59 59 PHE N N 754 122.160 122.160 121.014 1.146 17932
102 1 . 1 1 59 59 PHE HA H 754 4.713 4.713 4.953 -0.240 17932
103 1 . 1 1 59 59 PHE H H 754 8.187 8.187 8.701 -0.514 17932
104 1 . 1 1 60 60 THR N N 755 115.583 115.583 114.459 1.124 17932
105 1 . 1 1 60 60 THR HA H 755 4.265 4.265 3.782 0.483 17932
106 1 . 1 1 60 60 THR H H 755 8.015 8.015 7.474 0.541 17932
107 1 . 1 1 61 61 ASN N N 756 121.324 121.324 117.399 3.925 17932
108 1 . 1 1 61 61 ASN HA H 756 4.753 4.753 4.653 0.100 17932
109 1 . 1 1 61 61 ASN H H 756 8.340 8.340 7.931 0.409 17932
110 1 . 1 1 62 62 ILE N N 757 121.251 121.251 114.734 6.517 17932
111 1 . 1 1 62 62 ILE HA H 757 4.176 4.176 4.489 -0.313 17932
112 1 . 1 1 62 62 ILE H H 757 8.076 8.076 7.987 0.089 17932
113 1 . 1 1 63 63 THR N N 758 118.250 118.250 117.451 0.799 17932
114 1 . 1 1 63 63 THR HA H 758 4.264 4.264 4.295 -0.031 17932
115 1 . 1 1 63 63 THR H H 758 8.140 8.140 8.166 -0.026 17932
116 1 . 1 1 64 64 TYR N N 759 123.728 123.728 122.768 0.960 17932
117 1 . 1 1 64 64 TYR HA H 759 4.528 4.528 4.530 -0.002 17932
118 1 . 1 1 64 64 TYR H H 759 8.233 8.233 7.435 0.798 17932
119 1 . 1 1 65 65 ARG N N 760 124.423 124.423 119.583 4.840 17932
120 1 . 1 1 65 65 ARG HA H 760 4.241 4.241 4.465 -0.224 17932
121 1 . 1 1 65 65 ARG H H 760 8.226 8.226 8.080 0.146 17932
122 1 . 1 1 66 66 GLY N N 761 109.761 109.761 109.920 -0.159 17932
123 1 . 1 1 66 66 GLY H H 761 7.700 7.700 7.981 -0.281 17932
stop_
save_