data_17931
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 17931
_Entry.PDB_ID 2LJE
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 17931
_Entity_delta_chem_shifts.ID 1
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Conformer_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 1 . 1 1 2 2 LEU N N 717 120.100 120.100 122.758 -2.658 17931
2 1 1 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.191 -0.061 17931
3 1 1 . 1 1 2 2 LEU C C 717 177.505 177.505 177.854 -0.349 17931
4 1 1 . 1 1 2 2 LEU CA C 717 56.674 56.674 57.415 -0.741 17931
5 1 1 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.082 0.771 17931
6 1 1 . 1 1 2 2 LEU H H 717 7.866 7.866 8.039 -0.173 17931
7 1 1 . 1 1 3 3 LEU N N 718 118.481 118.481 116.380 2.101 17931
8 1 1 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.026 0.031 17931
9 1 1 . 1 1 3 3 LEU C C 718 177.643 177.643 178.205 -0.562 17931
10 1 1 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.480 -0.537 17931
11 1 1 . 1 1 3 3 LEU CB C 718 41.735 41.735 41.128 0.607 17931
12 1 1 . 1 1 3 3 LEU H H 718 7.746 7.746 7.958 -0.212 17931
13 1 1 . 1 1 4 4 ILE N N 719 116.207 116.207 116.857 -0.650 17931
14 1 1 . 1 1 4 4 ILE HA H 719 3.911 3.911 3.953 -0.042 17931
15 1 1 . 1 1 4 4 ILE C C 719 176.774 176.774 178.679 -1.905 17931
16 1 1 . 1 1 4 4 ILE CA C 719 62.960 62.960 62.539 0.421 17931
17 1 1 . 1 1 4 4 ILE CB C 719 38.219 38.219 37.233 0.986 17931
18 1 1 . 1 1 4 4 ILE H H 719 7.724 7.724 7.133 0.591 17931
19 1 1 . 1 1 5 5 THR N N 720 114.581 114.581 116.213 -1.632 17931
20 1 1 . 1 1 5 5 THR HA H 720 4.161 4.161 4.211 -0.050 17931
21 1 1 . 1 1 5 5 THR C C 720 175.458 175.458 176.942 -1.484 17931
22 1 1 . 1 1 5 5 THR CA C 720 64.390 64.390 65.165 -0.775 17931
23 1 1 . 1 1 5 5 THR CB C 720 69.052 69.052 68.530 0.522 17931
24 1 1 . 1 1 5 5 THR H H 720 7.802 7.802 8.312 -0.510 17931
25 1 1 . 1 1 6 6 ILE N N 721 119.805 119.805 122.094 -2.289 17931
26 1 1 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.511 0.398 17931
27 1 1 . 1 1 6 6 ILE C C 721 176.102 176.102 177.376 -1.274 17931
28 1 1 . 1 1 6 6 ILE CA C 721 63.025 63.025 65.244 -2.219 17931
29 1 1 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.509 0.595 17931
30 1 1 . 1 1 6 6 ILE H H 721 7.751 7.751 7.504 0.247 17931
31 1 1 . 1 1 7 7 HIS N N 722 118.760 118.760 117.600 1.160 17931
32 1 1 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.254 0.361 17931
33 1 1 . 1 1 7 7 HIS C C 722 174.538 174.538 176.089 -1.551 17931
34 1 1 . 1 1 7 7 HIS CA C 722 57.344 57.344 58.172 -0.828 17931
35 1 1 . 1 1 7 7 HIS CB C 722 29.375 29.375 29.794 -0.419 17931
36 1 1 . 1 1 7 7 HIS H H 722 8.097 8.097 7.565 0.532 17931
37 1 1 . 1 1 8 8 ASP N N 723 117.884 117.884 116.646 1.238 17931
38 1 1 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.985 -0.391 17931
39 1 1 . 1 1 8 8 ASP C C 723 176.829 176.829 175.937 0.892 17931
40 1 1 . 1 1 8 8 ASP CA C 723 54.176 54.176 54.684 -0.508 17931
41 1 1 . 1 1 8 8 ASP CB C 723 41.500 41.500 41.554 -0.054 17931
42 1 1 . 1 1 8 8 ASP H H 723 7.969 7.969 8.081 -0.112 17931
43 1 1 . 1 1 9 9 ARG N N 724 121.014 121.014 119.713 1.301 17931
44 1 1 . 1 1 9 9 ARG HA H 724 4.204 4.204 4.142 0.062 17931
45 1 1 . 1 1 9 9 ARG C C 724 177.662 177.662 177.515 0.147 17931
46 1 1 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.135 -2.316 17931
47 1 1 . 1 1 9 9 ARG CB C 724 32.703 32.703 29.893 2.810 17931
48 1 1 . 1 1 9 9 ARG H H 724 8.216 8.216 7.520 0.696 17931
49 1 1 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.079 0.056 17931
50 1 1 . 1 1 10 10 LYS C C 725 178.127 178.127 177.768 0.359 17931
51 1 1 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.811 -1.064 17931
52 1 1 . 1 1 10 10 LYS CB C 725 32.190 32.190 31.735 0.455 17931
53 1 1 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.158 -0.062 17931
54 1 1 . 1 1 11 11 GLU C C 726 177.791 177.791 177.857 -0.066 17931
55 1 1 . 1 1 11 11 GLU CA C 726 58.406 58.406 57.370 1.036 17931
56 1 1 . 1 1 11 11 GLU CB C 726 29.340 29.340 30.114 -0.774 17931
57 1 1 . 1 1 12 12 PHE N N 727 118.859 118.859 119.889 -1.030 17931
58 1 1 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.456 -0.078 17931
59 1 1 . 1 1 12 12 PHE C C 727 176.439 176.439 177.371 -0.932 17931
60 1 1 . 1 1 12 12 PHE CA C 727 59.332 59.332 59.901 -0.569 17931
61 1 1 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.526 -0.366 17931
62 1 1 . 1 1 12 12 PHE H H 727 7.922 7.922 8.482 -0.560 17931
63 1 1 . 1 1 13 13 ALA N N 728 122.111 122.111 122.051 0.060 17931
64 1 1 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.515 0.643 17931
65 1 1 . 1 1 13 13 ALA C C 728 178.542 178.542 178.969 -0.427 17931
66 1 1 . 1 1 13 13 ALA CA C 728 54.083 54.083 54.817 -0.734 17931
67 1 1 . 1 1 13 13 ALA CB C 728 18.409 18.409 17.761 0.648 17931
68 1 1 . 1 1 13 13 ALA H H 728 7.970 7.970 7.708 0.262 17931
69 1 1 . 1 1 14 14 LYS N N 729 117.588 117.588 118.625 -1.037 17931
70 1 1 . 1 1 14 14 LYS HA H 729 4.096 4.096 3.932 0.164 17931
71 1 1 . 1 1 14 14 LYS C C 729 177.664 177.664 178.646 -0.982 17931
72 1 1 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.541 -1.611 17931
73 1 1 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.921 -1.405 17931
74 1 1 . 1 1 14 14 LYS H H 729 7.792 7.792 7.721 0.071 17931
75 1 1 . 1 1 15 15 PHE N N 730 119.916 119.916 116.683 3.233 17931
76 1 1 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.352 0.027 17931
77 1 1 . 1 1 15 15 PHE C C 730 176.732 176.732 178.287 -1.555 17931
78 1 1 . 1 1 15 15 PHE CA C 730 59.753 59.753 59.441 0.312 17931
79 1 1 . 1 1 15 15 PHE CB C 730 39.010 39.010 38.981 0.029 17931
80 1 1 . 1 1 15 15 PHE H H 730 7.874 7.874 7.478 0.396 17931
81 1 1 . 1 1 16 16 GLU N N 731 119.398 119.398 119.227 0.171 17931
82 1 1 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.962 0.103 17931
83 1 1 . 1 1 16 16 GLU C C 731 177.920 177.920 178.668 -0.748 17931
84 1 1 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.271 -1.446 17931
85 1 1 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.761 0.588 17931
86 1 1 . 1 1 16 16 GLU H H 731 8.178 8.178 7.776 0.402 17931
87 1 1 . 1 1 17 17 GLU N N 732 120.386 120.386 120.067 0.319 17931
88 1 1 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.980 0.070 17931
89 1 1 . 1 1 17 17 GLU C C 732 178.097 178.097 179.277 -1.180 17931
90 1 1 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.290 -0.983 17931
91 1 1 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.245 0.143 17931
92 1 1 . 1 1 17 17 GLU H H 732 8.117 8.117 8.631 -0.514 17931
93 1 1 . 1 1 18 18 GLU N N 733 119.473 119.473 118.853 0.620 17931
94 1 1 . 1 1 18 18 GLU HA H 733 4.056 4.056 4.055 0.001 17931
95 1 1 . 1 1 18 18 GLU C C 733 177.228 177.228 178.109 -0.881 17931
96 1 1 . 1 1 18 18 GLU CA C 733 58.298 58.298 58.995 -0.697 17931
97 1 1 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.362 0.085 17931
98 1 1 . 1 1 18 18 GLU H H 733 8.130 8.130 7.661 0.469 17931
99 1 1 . 1 1 19 19 ARG N N 734 118.929 118.929 118.997 -0.068 17931
100 1 1 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.262 -0.233 17931
101 1 1 . 1 1 19 19 ARG C C 734 177.402 177.402 177.932 -0.530 17931
102 1 1 . 1 1 19 19 ARG CA C 734 58.400 58.400 58.151 0.249 17931
103 1 1 . 1 1 19 19 ARG CB C 734 32.170 32.170 30.441 1.730 17931
104 1 1 . 1 1 19 19 ARG H H 734 8.032 8.032 7.725 0.307 17931
105 1 1 . 1 1 20 20 ALA N N 735 121.514 121.514 119.578 1.936 17931
106 1 1 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.347 -0.218 17931
107 1 1 . 1 1 20 20 ALA C C 735 179.108 179.108 179.443 -0.335 17931
108 1 1 . 1 1 20 20 ALA CA C 735 53.559 53.559 54.078 -0.519 17931
109 1 1 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.922 -0.361 17931
110 1 1 . 1 1 20 20 ALA H H 735 7.853 7.853 8.226 -0.373 17931
111 1 1 . 1 1 21 21 ARG N N 736 117.944 117.944 118.731 -0.787 17931
112 1 1 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.405 -0.295 17931
113 1 1 . 1 1 21 21 ARG C C 736 176.643 176.643 177.511 -0.868 17931
114 1 1 . 1 1 21 21 ARG CA C 736 56.737 56.737 56.772 -0.035 17931
115 1 1 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.804 -0.231 17931
116 1 1 . 1 1 21 21 ARG H H 736 7.850 7.850 8.206 -0.356 17931
117 1 1 . 1 1 22 22 ALA N N 737 122.381 122.381 122.244 0.137 17931
118 1 1 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.112 0.039 17931
119 1 1 . 1 1 22 22 ALA C C 737 177.640 177.640 178.918 -1.278 17931
120 1 1 . 1 1 22 22 ALA CA C 737 52.770 52.770 55.115 -2.345 17931
121 1 1 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.330 0.417 17931
122 1 1 . 1 1 22 22 ALA H H 737 7.776 7.776 7.936 -0.160 17931
123 1 1 . 1 1 23 23 LYS N N 738 118.327 118.327 115.515 2.812 17931
124 1 1 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.297 -0.138 17931
125 1 1 . 1 1 23 23 LYS C C 738 176.483 176.483 176.383 0.100 17931
126 1 1 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.599 -0.131 17931
127 1 1 . 1 1 23 23 LYS CB C 738 32.526 32.526 32.821 -0.295 17931
128 1 1 . 1 1 23 23 LYS H H 738 7.838 7.838 8.729 -0.891 17931
129 1 1 . 1 1 24 24 TRP N N 739 120.598 120.598 119.544 1.054 17931
130 1 1 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.905 -0.304 17931
131 1 1 . 1 1 24 24 TRP C C 739 175.904 175.904 175.926 -0.022 17931
132 1 1 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.434 0.513 17931
133 1 1 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.479 0.042 17931
134 1 1 . 1 1 24 24 TRP H H 739 7.958 7.958 7.250 0.708 17931
135 1 1 . 1 1 25 25 ASP N N 740 121.214 121.214 122.367 -1.153 17931
136 1 1 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.282 -0.131 17931
137 1 1 . 1 1 25 25 ASP C C 740 176.626 176.626 177.636 -1.010 17931
138 1 1 . 1 1 25 25 ASP CA C 740 54.173 54.173 58.468 -4.295 17931
139 1 1 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.845 0.126 17931
140 1 1 . 1 1 25 25 ASP H H 740 8.248 8.248 7.964 0.284 17931
141 1 1 . 1 1 26 26 THR N N 741 113.708 113.708 112.702 1.006 17931
142 1 1 . 1 1 26 26 THR HA H 741 4.221 4.221 4.119 0.102 17931
143 1 1 . 1 1 26 26 THR C C 741 174.851 174.851 174.861 -0.010 17931
144 1 1 . 1 1 26 26 THR CA C 741 62.439 62.439 64.398 -1.959 17931
145 1 1 . 1 1 26 26 THR CB C 741 69.255 69.255 68.868 0.387 17931
146 1 1 . 1 1 26 26 THR H H 741 7.945 7.945 8.342 -0.397 17931
147 1 1 . 1 1 27 27 ALA N N 742 124.543 124.543 121.945 2.598 17931
148 1 1 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.387 -0.191 17931
149 1 1 . 1 1 27 27 ALA C C 742 177.509 177.509 179.085 -1.576 17931
150 1 1 . 1 1 27 27 ALA CA C 742 52.953 52.953 54.047 -1.094 17931
151 1 1 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.173 -0.224 17931
152 1 1 . 1 1 27 27 ALA H H 742 8.113 8.113 7.574 0.539 17931
153 1 1 . 1 1 28 28 ASN N N 743 116.039 116.039 115.753 0.286 17931
154 1 1 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.814 -0.215 17931
155 1 1 . 1 1 28 28 ASN C C 743 174.330 174.330 175.658 -1.328 17931
156 1 1 . 1 1 28 28 ASN CA C 743 52.868 52.868 54.569 -1.701 17931
157 1 1 . 1 1 28 28 ASN CB C 743 38.995 38.995 40.468 -1.473 17931
158 1 1 . 1 1 28 28 ASN H H 743 8.055 8.055 8.087 -0.032 17931
159 1 1 . 1 1 29 29 ASN N N 744 119.625 119.625 119.455 0.170 17931
160 1 1 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.171 -0.563 17931
161 1 1 . 1 1 29 29 ASN CA C 744 50.940 50.940 51.157 -0.217 17931
162 1 1 . 1 1 29 29 ASN CB C 744 38.798 38.798 39.941 -1.143 17931
163 1 1 . 1 1 29 29 ASN H H 744 8.015 8.015 8.023 -0.008 17931
164 1 1 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.322 0.050 17931
165 1 1 . 1 1 30 30 PRO C C 745 177.196 177.196 177.152 0.044 17931
166 1 1 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.476 -0.893 17931
167 1 1 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.200 -0.312 17931
168 1 1 . 1 1 34 34 GLU N N 749 121.140 121.140 121.088 0.052 17931
169 1 1 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.184 0.022 17931
170 1 1 . 1 1 34 34 GLU C C 749 176.764 176.764 178.532 -1.768 17931
171 1 1 . 1 1 34 34 GLU CA C 749 56.698 56.698 58.698 -2.000 17931
172 1 1 . 1 1 34 34 GLU CB C 749 29.784 29.784 29.965 -0.181 17931
173 1 1 . 1 1 34 34 GLU H H 749 8.215 8.215 8.896 -0.681 17931
174 1 1 . 1 1 35 35 ALA N N 750 124.506 124.506 120.549 3.957 17931
175 1 1 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.121 0.155 17931
176 1 1 . 1 1 35 35 ALA C C 750 178.054 178.054 178.957 -0.903 17931
177 1 1 . 1 1 35 35 ALA CA C 750 53.011 53.011 54.267 -1.256 17931
178 1 1 . 1 1 35 35 ALA CB C 750 19.021 19.021 17.827 1.194 17931
179 1 1 . 1 1 35 35 ALA H H 750 8.335 8.335 8.355 -0.020 17931
180 1 1 . 1 1 36 36 THR N N 751 111.925 111.925 115.207 -3.282 17931
181 1 1 . 1 1 36 36 THR HA H 751 4.225 4.225 4.103 0.122 17931
182 1 1 . 1 1 36 36 THR C C 751 175.137 175.137 176.789 -1.652 17931
183 1 1 . 1 1 36 36 THR CA C 751 62.508 62.508 66.625 -4.117 17931
184 1 1 . 1 1 36 36 THR CB C 751 69.600 69.600 68.209 1.391 17931
185 1 1 . 1 1 36 36 THR H H 751 8.007 8.007 8.038 -0.031 17931
186 1 1 . 1 1 37 37 SER N N 752 117.676 117.676 114.197 3.479 17931
187 1 1 . 1 1 37 37 SER HA H 752 4.567 4.567 4.267 0.300 17931
188 1 1 . 1 1 37 37 SER C C 752 174.881 174.881 176.033 -1.152 17931
189 1 1 . 1 1 37 37 SER CA C 752 58.856 58.856 60.882 -2.026 17931
190 1 1 . 1 1 37 37 SER CB C 752 63.705 63.705 62.942 0.763 17931
191 1 1 . 1 1 37 37 SER H H 752 8.156 8.156 7.978 0.178 17931
192 1 1 . 1 1 38 38 THR N N 753 116.343 116.343 113.581 2.762 17931
193 1 1 . 1 1 38 38 THR HA H 753 4.126 4.126 4.144 -0.018 17931
194 1 1 . 1 1 38 38 THR C C 753 174.555 174.555 174.970 -0.415 17931
195 1 1 . 1 1 38 38 THR CA C 753 62.889 62.889 64.119 -1.230 17931
196 1 1 . 1 1 38 38 THR CB C 753 69.292 69.292 68.283 1.009 17931
197 1 1 . 1 1 38 38 THR H H 753 8.042 8.042 7.310 0.732 17931
198 1 1 . 1 1 39 39 PHE N N 754 120.983 120.983 120.233 0.750 17931
199 1 1 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.718 -0.151 17931
200 1 1 . 1 1 39 39 PHE C C 754 175.956 175.956 176.026 -0.070 17931
201 1 1 . 1 1 39 39 PHE CA C 754 58.289 58.289 57.504 0.785 17931
202 1 1 . 1 1 39 39 PHE CB C 754 39.222 39.222 40.212 -0.991 17931
203 1 1 . 1 1 39 39 PHE H H 754 8.163 8.163 7.631 0.532 17931
204 1 1 . 1 1 40 40 THR N N 755 114.474 114.474 114.771 -0.297 17931
205 1 1 . 1 1 40 40 THR HA H 755 4.159 4.159 4.355 -0.196 17931
206 1 1 . 1 1 40 40 THR C C 755 174.168 174.168 174.372 -0.204 17931
207 1 1 . 1 1 40 40 THR CA C 755 62.446 62.446 62.821 -0.375 17931
208 1 1 . 1 1 40 40 THR CB C 755 69.403 69.403 68.659 0.744 17931
209 1 1 . 1 1 40 40 THR H H 755 7.943 7.943 8.136 -0.193 17931
210 1 1 . 1 1 41 41 ASN N N 756 120.598 120.598 125.380 -4.782 17931
211 1 1 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.795 -0.196 17931
212 1 1 . 1 1 41 41 ASN C C 756 175.438 175.438 176.291 -0.853 17931
213 1 1 . 1 1 41 41 ASN CA C 756 53.625 53.625 54.331 -0.706 17931
214 1 1 . 1 1 41 41 ASN CB C 756 38.852 38.852 39.373 -0.521 17931
215 1 1 . 1 1 41 41 ASN H H 756 8.254 8.254 8.503 -0.249 17931
216 1 1 . 1 1 42 42 ILE N N 757 119.988 119.988 120.787 -0.799 17931
217 1 1 . 1 1 42 42 ILE HA H 757 4.133 4.133 3.990 0.143 17931
218 1 1 . 1 1 42 42 ILE C C 757 176.180 176.180 176.452 -0.272 17931
219 1 1 . 1 1 42 42 ILE CA C 757 61.607 61.607 63.180 -1.573 17931
220 1 1 . 1 1 42 42 ILE CB C 757 38.526 38.526 38.324 0.202 17931
221 1 1 . 1 1 42 42 ILE H H 757 7.988 7.988 8.518 -0.530 17931
222 1 1 . 1 1 46 46 GLY N N 761 109.795 109.795 109.028 0.767 17931
223 1 1 . 1 1 46 46 GLY C C 761 173.400 173.400 173.511 -0.111 17931
224 1 1 . 1 1 46 46 GLY CA C 761 45.241 45.241 45.198 0.043 17931
225 1 1 . 1 1 46 46 GLY H H 761 8.038 8.038 8.067 -0.029 17931
226 1 2 . 1 1 2 2 LEU N N 717 120.100 120.100 122.237 -2.137 17931
227 1 2 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.377 -0.247 17931
228 1 2 . 1 1 2 2 LEU C C 717 177.505 177.505 177.638 -0.133 17931
229 1 2 . 1 1 2 2 LEU CA C 717 56.674 56.674 56.999 -0.325 17931
230 1 2 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.543 0.310 17931
231 1 2 . 1 1 2 2 LEU H H 717 7.866 7.866 7.928 -0.062 17931
232 1 2 . 1 1 3 3 LEU N N 718 118.481 118.481 118.761 -0.280 17931
233 1 2 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.014 0.043 17931
234 1 2 . 1 1 3 3 LEU C C 718 177.643 177.643 179.036 -1.393 17931
235 1 2 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.995 -1.052 17931
236 1 2 . 1 1 3 3 LEU CB C 718 41.735 41.735 40.804 0.931 17931
237 1 2 . 1 1 3 3 LEU H H 718 7.746 7.746 7.905 -0.159 17931
238 1 2 . 1 1 4 4 ILE N N 719 116.207 116.207 115.752 0.455 17931
239 1 2 . 1 1 4 4 ILE HA H 719 3.911 3.911 3.985 -0.074 17931
240 1 2 . 1 1 4 4 ILE C C 719 176.774 176.774 178.786 -2.012 17931
241 1 2 . 1 1 4 4 ILE CA C 719 62.960 62.960 63.359 -0.400 17931
242 1 2 . 1 1 4 4 ILE CB C 719 38.219 38.219 36.864 1.355 17931
243 1 2 . 1 1 4 4 ILE H H 719 7.724 7.724 7.638 0.086 17931
244 1 2 . 1 1 5 5 THR N N 720 114.581 114.581 116.988 -2.407 17931
245 1 2 . 1 1 5 5 THR HA H 720 4.161 4.161 4.173 -0.012 17931
246 1 2 . 1 1 5 5 THR C C 720 175.458 175.458 176.529 -1.071 17931
247 1 2 . 1 1 5 5 THR CA C 720 64.390 64.390 65.344 -0.954 17931
248 1 2 . 1 1 5 5 THR CB C 720 69.052 69.052 68.112 0.940 17931
249 1 2 . 1 1 5 5 THR H H 720 7.802 7.802 7.782 0.020 17931
250 1 2 . 1 1 6 6 ILE N N 721 119.805 119.805 121.511 -1.706 17931
251 1 2 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.514 0.395 17931
252 1 2 . 1 1 6 6 ILE C C 721 176.102 176.102 177.593 -1.491 17931
253 1 2 . 1 1 6 6 ILE CA C 721 63.025 63.025 65.699 -2.674 17931
254 1 2 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.443 0.661 17931
255 1 2 . 1 1 6 6 ILE H H 721 7.751 7.751 7.814 -0.063 17931
256 1 2 . 1 1 7 7 HIS N N 722 118.760 118.760 118.125 0.635 17931
257 1 2 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.209 0.406 17931
258 1 2 . 1 1 7 7 HIS C C 722 174.538 174.538 177.439 -2.901 17931
259 1 2 . 1 1 7 7 HIS CA C 722 57.344 57.344 59.239 -1.895 17931
260 1 2 . 1 1 7 7 HIS CB C 722 29.375 29.375 29.634 -0.259 17931
261 1 2 . 1 1 7 7 HIS H H 722 8.097 8.097 7.564 0.533 17931
262 1 2 . 1 1 8 8 ASP N N 723 117.884 117.884 118.159 -0.275 17931
263 1 2 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.734 -0.140 17931
264 1 2 . 1 1 8 8 ASP C C 723 176.829 176.829 178.007 -1.178 17931
265 1 2 . 1 1 8 8 ASP CA C 723 54.176 54.176 56.222 -2.046 17931
266 1 2 . 1 1 8 8 ASP CB C 723 41.500 41.500 41.226 0.274 17931
267 1 2 . 1 1 8 8 ASP H H 723 7.969 7.969 7.890 0.079 17931
268 1 2 . 1 1 9 9 ARG N N 724 121.014 121.014 121.737 -0.723 17931
269 1 2 . 1 1 9 9 ARG HA H 724 4.204 4.204 4.000 0.204 17931
270 1 2 . 1 1 9 9 ARG C C 724 177.662 177.662 178.359 -0.697 17931
271 1 2 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.666 -2.846 17931
272 1 2 . 1 1 9 9 ARG CB C 724 32.703 32.703 30.238 2.465 17931
273 1 2 . 1 1 9 9 ARG H H 724 8.216 8.216 8.460 -0.244 17931
274 1 2 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.208 -0.073 17931
275 1 2 . 1 1 10 10 LYS C C 725 178.127 178.127 177.681 0.446 17931
276 1 2 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.387 -0.640 17931
277 1 2 . 1 1 10 10 LYS CB C 725 32.190 32.190 32.319 -0.130 17931
278 1 2 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.425 -0.329 17931
279 1 2 . 1 1 11 11 GLU C C 726 177.791 177.791 178.140 -0.349 17931
280 1 2 . 1 1 11 11 GLU CA C 726 58.406 58.406 57.346 1.060 17931
281 1 2 . 1 1 11 11 GLU CB C 726 29.340 29.340 30.328 -0.988 17931
282 1 2 . 1 1 12 12 PHE N N 727 118.859 118.859 121.717 -2.858 17931
283 1 2 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.583 -0.205 17931
284 1 2 . 1 1 12 12 PHE C C 727 176.439 176.439 176.914 -0.475 17931
285 1 2 . 1 1 12 12 PHE CA C 727 59.332 59.332 60.528 -1.196 17931
286 1 2 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.546 -0.386 17931
287 1 2 . 1 1 12 12 PHE H H 727 7.922 7.922 8.278 -0.356 17931
288 1 2 . 1 1 13 13 ALA N N 728 122.111 122.111 121.659 0.452 17931
289 1 2 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.723 0.435 17931
290 1 2 . 1 1 13 13 ALA C C 728 178.542 178.542 179.457 -0.915 17931
291 1 2 . 1 1 13 13 ALA CA C 728 54.083 54.083 55.327 -1.244 17931
292 1 2 . 1 1 13 13 ALA CB C 728 18.409 18.409 18.113 0.296 17931
293 1 2 . 1 1 13 13 ALA H H 728 7.970 7.970 8.329 -0.359 17931
294 1 2 . 1 1 14 14 LYS N N 729 117.588 117.588 117.741 -0.153 17931
295 1 2 . 1 1 14 14 LYS HA H 729 4.096 4.096 3.897 0.199 17931
296 1 2 . 1 1 14 14 LYS C C 729 177.664 177.664 178.968 -1.304 17931
297 1 2 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.394 -1.464 17931
298 1 2 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.595 -1.080 17931
299 1 2 . 1 1 14 14 LYS H H 729 7.792 7.792 7.705 0.087 17931
300 1 2 . 1 1 15 15 PHE N N 730 119.916 119.916 118.786 1.130 17931
301 1 2 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.451 -0.072 17931
302 1 2 . 1 1 15 15 PHE C C 730 176.732 176.732 178.193 -1.461 17931
303 1 2 . 1 1 15 15 PHE CA C 730 59.753 59.753 61.433 -1.680 17931
304 1 2 . 1 1 15 15 PHE CB C 730 39.010 39.010 39.105 -0.096 17931
305 1 2 . 1 1 15 15 PHE H H 730 7.874 7.874 7.736 0.138 17931
306 1 2 . 1 1 16 16 GLU N N 731 119.398 119.398 118.177 1.221 17931
307 1 2 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.891 0.174 17931
308 1 2 . 1 1 16 16 GLU C C 731 177.920 177.920 178.894 -0.974 17931
309 1 2 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.325 -1.500 17931
310 1 2 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.822 0.527 17931
311 1 2 . 1 1 16 16 GLU H H 731 8.178 8.178 7.657 0.521 17931
312 1 2 . 1 1 17 17 GLU N N 732 120.386 120.386 119.688 0.698 17931
313 1 2 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.946 0.104 17931
314 1 2 . 1 1 17 17 GLU C C 732 178.097 178.097 178.944 -0.847 17931
315 1 2 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.096 -0.789 17931
316 1 2 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.386 0.003 17931
317 1 2 . 1 1 17 17 GLU H H 732 8.117 8.117 8.420 -0.303 17931
318 1 2 . 1 1 18 18 GLU N N 733 119.473 119.473 119.370 0.103 17931
319 1 2 . 1 1 18 18 GLU HA H 733 4.056 4.056 3.970 0.086 17931
320 1 2 . 1 1 18 18 GLU C C 733 177.228 177.228 178.815 -1.587 17931
321 1 2 . 1 1 18 18 GLU CA C 733 58.298 58.298 59.103 -0.805 17931
322 1 2 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.330 0.117 17931
323 1 2 . 1 1 18 18 GLU H H 733 8.130 8.130 7.620 0.510 17931
324 1 2 . 1 1 19 19 ARG N N 734 118.929 118.929 119.043 -0.114 17931
325 1 2 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.200 -0.171 17931
326 1 2 . 1 1 19 19 ARG C C 734 177.402 177.402 178.233 -0.831 17931
327 1 2 . 1 1 19 19 ARG CA C 734 58.400 58.400 58.247 0.153 17931
328 1 2 . 1 1 19 19 ARG CB C 734 32.170 32.170 30.154 2.016 17931
329 1 2 . 1 1 19 19 ARG H H 734 8.032 8.032 7.419 0.613 17931
330 1 2 . 1 1 20 20 ALA N N 735 121.514 121.514 121.729 -0.215 17931
331 1 2 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.136 -0.007 17931
332 1 2 . 1 1 20 20 ALA C C 735 179.108 179.108 179.508 -0.400 17931
333 1 2 . 1 1 20 20 ALA CA C 735 53.559 53.559 54.908 -1.349 17931
334 1 2 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.463 0.098 17931
335 1 2 . 1 1 20 20 ALA H H 735 7.853 7.853 8.426 -0.573 17931
336 1 2 . 1 1 21 21 ARG N N 736 117.944 117.944 118.936 -0.992 17931
337 1 2 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.155 -0.045 17931
338 1 2 . 1 1 21 21 ARG C C 736 176.643 176.643 178.388 -1.745 17931
339 1 2 . 1 1 21 21 ARG CA C 736 56.737 56.737 58.512 -1.775 17931
340 1 2 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.217 0.356 17931
341 1 2 . 1 1 21 21 ARG H H 736 7.850 7.850 8.551 -0.701 17931
342 1 2 . 1 1 22 22 ALA N N 737 122.381 122.381 120.708 1.673 17931
343 1 2 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.139 0.012 17931
344 1 2 . 1 1 22 22 ALA C C 737 177.640 177.640 178.332 -0.692 17931
345 1 2 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.495 -1.725 17931
346 1 2 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.721 0.026 17931
347 1 2 . 1 1 22 22 ALA H H 737 7.776 7.776 7.887 -0.111 17931
348 1 2 . 1 1 23 23 LYS N N 738 118.327 118.327 112.881 5.446 17931
349 1 2 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.434 -0.275 17931
350 1 2 . 1 1 23 23 LYS C C 738 176.483 176.483 177.068 -0.585 17931
351 1 2 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.582 -0.114 17931
352 1 2 . 1 1 23 23 LYS CB C 738 32.526 32.526 34.856 -2.330 17931
353 1 2 . 1 1 23 23 LYS H H 738 7.838 7.838 7.633 0.205 17931
354 1 2 . 1 1 24 24 TRP N N 739 120.598 120.598 122.952 -2.354 17931
355 1 2 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.998 -0.397 17931
356 1 2 . 1 1 24 24 TRP C C 739 175.904 175.904 175.527 0.377 17931
357 1 2 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.022 0.925 17931
358 1 2 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.696 -0.175 17931
359 1 2 . 1 1 24 24 TRP H H 739 7.958 7.958 8.726 -0.768 17931
360 1 2 . 1 1 25 25 ASP N N 740 121.214 121.214 120.715 0.499 17931
361 1 2 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.372 -0.221 17931
362 1 2 . 1 1 25 25 ASP C C 740 176.626 176.626 177.613 -0.987 17931
363 1 2 . 1 1 25 25 ASP CA C 740 54.173 54.173 57.239 -3.067 17931
364 1 2 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.308 0.663 17931
365 1 2 . 1 1 25 25 ASP H H 740 8.248 8.248 8.414 -0.166 17931
366 1 2 . 1 1 26 26 THR N N 741 113.708 113.708 112.867 0.841 17931
367 1 2 . 1 1 26 26 THR HA H 741 4.221 4.221 4.139 0.082 17931
368 1 2 . 1 1 26 26 THR C C 741 174.851 174.851 174.401 0.450 17931
369 1 2 . 1 1 26 26 THR CA C 741 62.439 62.439 63.736 -1.297 17931
370 1 2 . 1 1 26 26 THR CB C 741 69.255 69.255 68.599 0.656 17931
371 1 2 . 1 1 26 26 THR H H 741 7.945 7.945 8.168 -0.223 17931
372 1 2 . 1 1 27 27 ALA N N 742 124.543 124.543 122.815 1.728 17931
373 1 2 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.467 -0.271 17931
374 1 2 . 1 1 27 27 ALA C C 742 177.509 177.509 179.000 -1.491 17931
375 1 2 . 1 1 27 27 ALA CA C 742 52.953 52.953 53.975 -1.022 17931
376 1 2 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.385 -0.436 17931
377 1 2 . 1 1 27 27 ALA H H 742 8.113 8.113 7.296 0.817 17931
378 1 2 . 1 1 28 28 ASN N N 743 116.039 116.039 116.153 -0.114 17931
379 1 2 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.599 -0.000 17931
380 1 2 . 1 1 28 28 ASN C C 743 174.330 174.330 175.788 -1.458 17931
381 1 2 . 1 1 28 28 ASN CA C 743 52.868 52.868 55.047 -2.179 17931
382 1 2 . 1 1 28 28 ASN CB C 743 38.995 38.995 39.291 -0.296 17931
383 1 2 . 1 1 28 28 ASN H H 743 8.055 8.055 8.478 -0.423 17931
384 1 2 . 1 1 29 29 ASN N N 744 119.625 119.625 118.025 1.600 17931
385 1 2 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.092 -0.484 17931
386 1 2 . 1 1 29 29 ASN CA C 744 50.940 50.940 51.346 -0.406 17931
387 1 2 . 1 1 29 29 ASN CB C 744 38.798 38.798 40.004 -1.206 17931
388 1 2 . 1 1 29 29 ASN H H 744 8.015 8.015 7.560 0.455 17931
389 1 2 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.287 0.085 17931
390 1 2 . 1 1 30 30 PRO C C 745 177.196 177.196 176.795 0.401 17931
391 1 2 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.646 -1.063 17931
392 1 2 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.319 -0.431 17931
393 1 2 . 1 1 34 34 GLU N N 749 121.140 121.140 118.569 2.571 17931
394 1 2 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.037 0.169 17931
395 1 2 . 1 1 34 34 GLU C C 749 176.764 176.764 176.032 0.732 17931
396 1 2 . 1 1 34 34 GLU CA C 749 56.698 56.698 57.941 -1.243 17931
397 1 2 . 1 1 34 34 GLU CB C 749 29.784 29.784 29.925 -0.141 17931
398 1 2 . 1 1 34 34 GLU H H 749 8.215 8.215 8.267 -0.052 17931
399 1 2 . 1 1 35 35 ALA N N 750 124.506 124.506 121.825 2.681 17931
400 1 2 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.919 -0.643 17931
401 1 2 . 1 1 35 35 ALA C C 750 178.054 178.054 177.266 0.788 17931
402 1 2 . 1 1 35 35 ALA CA C 750 53.011 53.011 51.159 1.852 17931
403 1 2 . 1 1 35 35 ALA CB C 750 19.021 19.021 18.459 0.562 17931
404 1 2 . 1 1 35 35 ALA H H 750 8.335 8.335 7.901 0.434 17931
405 1 2 . 1 1 36 36 THR N N 751 111.925 111.925 117.070 -5.145 17931
406 1 2 . 1 1 36 36 THR HA H 751 4.225 4.225 3.913 0.312 17931
407 1 2 . 1 1 36 36 THR C C 751 175.137 175.137 176.717 -1.580 17931
408 1 2 . 1 1 36 36 THR CA C 751 62.508 62.508 67.125 -4.617 17931
409 1 2 . 1 1 36 36 THR CB C 751 69.600 69.600 68.745 0.855 17931
410 1 2 . 1 1 36 36 THR H H 751 8.007 8.007 8.667 -0.660 17931
411 1 2 . 1 1 37 37 SER N N 752 117.676 117.676 114.149 3.527 17931
412 1 2 . 1 1 37 37 SER HA H 752 4.567 4.567 4.227 0.340 17931
413 1 2 . 1 1 37 37 SER C C 752 174.881 174.881 175.912 -1.031 17931
414 1 2 . 1 1 37 37 SER CA C 752 58.856 58.856 61.364 -2.508 17931
415 1 2 . 1 1 37 37 SER CB C 752 63.705 63.705 63.137 0.568 17931
416 1 2 . 1 1 37 37 SER H H 752 8.156 8.156 8.126 0.030 17931
417 1 2 . 1 1 38 38 THR N N 753 116.343 116.343 114.686 1.657 17931
418 1 2 . 1 1 38 38 THR HA H 753 4.126 4.126 4.269 -0.143 17931
419 1 2 . 1 1 38 38 THR C C 753 174.555 174.555 175.766 -1.211 17931
420 1 2 . 1 1 38 38 THR CA C 753 62.889 62.889 64.065 -1.176 17931
421 1 2 . 1 1 38 38 THR CB C 753 69.292 69.292 68.930 0.362 17931
422 1 2 . 1 1 38 38 THR H H 753 8.042 8.042 7.665 0.377 17931
423 1 2 . 1 1 39 39 PHE N N 754 120.983 120.983 119.839 1.144 17931
424 1 2 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.589 -0.022 17931
425 1 2 . 1 1 39 39 PHE C C 754 175.956 175.956 176.339 -0.383 17931
426 1 2 . 1 1 39 39 PHE CA C 754 58.289 58.289 60.510 -2.221 17931
427 1 2 . 1 1 39 39 PHE CB C 754 39.222 39.222 39.551 -0.329 17931
428 1 2 . 1 1 39 39 PHE H H 754 8.163 8.163 8.427 -0.264 17931
429 1 2 . 1 1 40 40 THR N N 755 114.474 114.474 112.767 1.707 17931
430 1 2 . 1 1 40 40 THR HA H 755 4.159 4.159 4.399 -0.240 17931
431 1 2 . 1 1 40 40 THR C C 755 174.168 174.168 174.903 -0.735 17931
432 1 2 . 1 1 40 40 THR CA C 755 62.446 62.446 61.262 1.184 17931
433 1 2 . 1 1 40 40 THR CB C 755 69.403 69.403 70.008 -0.605 17931
434 1 2 . 1 1 40 40 THR H H 755 7.943 7.943 7.801 0.142 17931
435 1 2 . 1 1 41 41 ASN N N 756 120.598 120.598 117.966 2.632 17931
436 1 2 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.656 -0.057 17931
437 1 2 . 1 1 41 41 ASN C C 756 175.438 175.438 175.878 -0.440 17931
438 1 2 . 1 1 41 41 ASN CA C 756 53.625 53.625 54.839 -1.214 17931
439 1 2 . 1 1 41 41 ASN CB C 756 38.852 38.852 38.246 0.606 17931
440 1 2 . 1 1 41 41 ASN H H 756 8.254 8.254 8.556 -0.301 17931
441 1 2 . 1 1 42 42 ILE N N 757 119.988 119.988 118.139 1.849 17931
442 1 2 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.362 -0.229 17931
443 1 2 . 1 1 42 42 ILE C C 757 176.180 176.180 175.409 0.771 17931
444 1 2 . 1 1 42 42 ILE CA C 757 61.607 61.607 61.127 0.480 17931
445 1 2 . 1 1 42 42 ILE CB C 757 38.526 38.526 37.802 0.724 17931
446 1 2 . 1 1 42 42 ILE H H 757 7.988 7.988 7.758 0.230 17931
447 1 2 . 1 1 46 46 GLY N N 761 109.795 109.795 110.089 -0.294 17931
448 1 2 . 1 1 46 46 GLY C C 761 173.400 173.400 174.200 -0.800 17931
449 1 2 . 1 1 46 46 GLY CA C 761 45.241 45.241 44.865 0.376 17931
450 1 2 . 1 1 46 46 GLY H H 761 8.038 8.038 8.192 -0.154 17931
451 1 3 . 1 1 2 2 LEU N N 717 120.100 120.100 123.501 -3.401 17931
452 1 3 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.194 -0.064 17931
453 1 3 . 1 1 2 2 LEU C C 717 177.505 177.505 177.993 -0.488 17931
454 1 3 . 1 1 2 2 LEU CA C 717 56.674 56.674 57.257 -0.583 17931
455 1 3 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.056 0.797 17931
456 1 3 . 1 1 2 2 LEU H H 717 7.866 7.866 8.092 -0.226 17931
457 1 3 . 1 1 3 3 LEU N N 718 118.481 118.481 116.718 1.763 17931
458 1 3 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.023 0.034 17931
459 1 3 . 1 1 3 3 LEU C C 718 177.643 177.643 179.093 -1.450 17931
460 1 3 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.428 -0.485 17931
461 1 3 . 1 1 3 3 LEU CB C 718 41.735 41.735 41.362 0.373 17931
462 1 3 . 1 1 3 3 LEU H H 718 7.746 7.746 8.020 -0.274 17931
463 1 3 . 1 1 4 4 ILE N N 719 116.207 116.207 117.261 -1.054 17931
464 1 3 . 1 1 4 4 ILE HA H 719 3.911 3.911 4.000 -0.089 17931
465 1 3 . 1 1 4 4 ILE C C 719 176.774 176.774 178.765 -1.991 17931
466 1 3 . 1 1 4 4 ILE CA C 719 62.960 62.960 62.544 0.416 17931
467 1 3 . 1 1 4 4 ILE CB C 719 38.219 38.219 37.199 1.020 17931
468 1 3 . 1 1 4 4 ILE H H 719 7.724 7.724 7.375 0.349 17931
469 1 3 . 1 1 5 5 THR N N 720 114.581 114.581 116.911 -2.330 17931
470 1 3 . 1 1 5 5 THR HA H 720 4.161 4.161 4.149 0.012 17931
471 1 3 . 1 1 5 5 THR C C 720 175.458 175.458 176.826 -1.368 17931
472 1 3 . 1 1 5 5 THR CA C 720 64.390 64.390 65.829 -1.439 17931
473 1 3 . 1 1 5 5 THR CB C 720 69.052 69.052 68.189 0.863 17931
474 1 3 . 1 1 5 5 THR H H 720 7.802 7.802 8.339 -0.537 17931
475 1 3 . 1 1 6 6 ILE N N 721 119.805 119.805 121.712 -1.907 17931
476 1 3 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.571 0.338 17931
477 1 3 . 1 1 6 6 ILE C C 721 176.102 176.102 177.382 -1.280 17931
478 1 3 . 1 1 6 6 ILE CA C 721 63.025 63.025 65.729 -2.704 17931
479 1 3 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.589 0.515 17931
480 1 3 . 1 1 6 6 ILE H H 721 7.751 7.751 7.854 -0.103 17931
481 1 3 . 1 1 7 7 HIS N N 722 118.760 118.760 118.340 0.420 17931
482 1 3 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.270 0.345 17931
483 1 3 . 1 1 7 7 HIS C C 722 174.538 174.538 176.723 -2.185 17931
484 1 3 . 1 1 7 7 HIS CA C 722 57.344 57.344 59.398 -2.054 17931
485 1 3 . 1 1 7 7 HIS CB C 722 29.375 29.375 30.073 -0.698 17931
486 1 3 . 1 1 7 7 HIS H H 722 8.097 8.097 7.827 0.270 17931
487 1 3 . 1 1 8 8 ASP N N 723 117.884 117.884 117.831 0.053 17931
488 1 3 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.667 -0.073 17931
489 1 3 . 1 1 8 8 ASP C C 723 176.829 176.829 177.579 -0.750 17931
490 1 3 . 1 1 8 8 ASP CA C 723 54.176 54.176 56.663 -2.487 17931
491 1 3 . 1 1 8 8 ASP CB C 723 41.500 41.500 41.422 0.078 17931
492 1 3 . 1 1 8 8 ASP H H 723 7.969 7.969 7.669 0.300 17931
493 1 3 . 1 1 9 9 ARG N N 724 121.014 121.014 121.396 -0.382 17931
494 1 3 . 1 1 9 9 ARG HA H 724 4.204 4.204 3.954 0.250 17931
495 1 3 . 1 1 9 9 ARG C C 724 177.662 177.662 178.196 -0.534 17931
496 1 3 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.783 -2.964 17931
497 1 3 . 1 1 9 9 ARG CB C 724 32.703 32.703 30.125 2.578 17931
498 1 3 . 1 1 9 9 ARG H H 724 8.216 8.216 8.218 -0.002 17931
499 1 3 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.131 0.004 17931
500 1 3 . 1 1 10 10 LYS C C 725 178.127 178.127 177.629 0.498 17931
501 1 3 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.458 -0.711 17931
502 1 3 . 1 1 10 10 LYS CB C 725 32.190 32.190 32.066 0.124 17931
503 1 3 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.325 -0.229 17931
504 1 3 . 1 1 11 11 GLU C C 726 177.791 177.791 177.748 0.043 17931
505 1 3 . 1 1 11 11 GLU CA C 726 58.406 58.406 57.736 0.670 17931
506 1 3 . 1 1 11 11 GLU CB C 726 29.340 29.340 30.444 -1.104 17931
507 1 3 . 1 1 12 12 PHE N N 727 118.859 118.859 119.530 -0.671 17931
508 1 3 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.678 -0.300 17931
509 1 3 . 1 1 12 12 PHE C C 727 176.439 176.439 177.457 -1.018 17931
510 1 3 . 1 1 12 12 PHE CA C 727 59.332 59.332 60.113 -0.781 17931
511 1 3 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.873 -0.713 17931
512 1 3 . 1 1 12 12 PHE H H 727 7.922 7.922 8.511 -0.589 17931
513 1 3 . 1 1 13 13 ALA N N 728 122.111 122.111 122.717 -0.606 17931
514 1 3 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.623 0.535 17931
515 1 3 . 1 1 13 13 ALA C C 728 178.542 178.542 179.321 -0.779 17931
516 1 3 . 1 1 13 13 ALA CA C 728 54.083 54.083 55.077 -0.994 17931
517 1 3 . 1 1 13 13 ALA CB C 728 18.409 18.409 18.040 0.369 17931
518 1 3 . 1 1 13 13 ALA H H 728 7.970 7.970 7.832 0.138 17931
519 1 3 . 1 1 14 14 LYS N N 729 117.588 117.588 118.302 -0.714 17931
520 1 3 . 1 1 14 14 LYS HA H 729 4.096 4.096 3.958 0.138 17931
521 1 3 . 1 1 14 14 LYS C C 729 177.664 177.664 179.084 -1.420 17931
522 1 3 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.590 -1.660 17931
523 1 3 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.468 -0.953 17931
524 1 3 . 1 1 14 14 LYS H H 729 7.792 7.792 7.929 -0.137 17931
525 1 3 . 1 1 15 15 PHE N N 730 119.916 119.916 117.967 1.949 17931
526 1 3 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.500 -0.121 17931
527 1 3 . 1 1 15 15 PHE C C 730 176.732 176.732 178.082 -1.350 17931
528 1 3 . 1 1 15 15 PHE CA C 730 59.753 59.753 61.394 -1.641 17931
529 1 3 . 1 1 15 15 PHE CB C 730 39.010 39.010 39.210 -0.200 17931
530 1 3 . 1 1 15 15 PHE H H 730 7.874 7.874 8.023 -0.149 17931
531 1 3 . 1 1 16 16 GLU N N 731 119.398 119.398 118.247 1.151 17931
532 1 3 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.929 0.136 17931
533 1 3 . 1 1 16 16 GLU C C 731 177.920 177.920 178.892 -0.972 17931
534 1 3 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.276 -1.451 17931
535 1 3 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.916 0.433 17931
536 1 3 . 1 1 16 16 GLU H H 731 8.178 8.178 7.733 0.445 17931
537 1 3 . 1 1 17 17 GLU N N 732 120.386 120.386 119.502 0.884 17931
538 1 3 . 1 1 17 17 GLU HA H 732 4.050 4.050 4.010 0.040 17931
539 1 3 . 1 1 17 17 GLU C C 732 178.097 178.097 178.922 -0.825 17931
540 1 3 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.130 -0.823 17931
541 1 3 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.361 0.027 17931
542 1 3 . 1 1 17 17 GLU H H 732 8.117 8.117 8.670 -0.553 17931
543 1 3 . 1 1 18 18 GLU N N 733 119.473 119.473 119.532 -0.059 17931
544 1 3 . 1 1 18 18 GLU HA H 733 4.056 4.056 3.982 0.074 17931
545 1 3 . 1 1 18 18 GLU C C 733 177.228 177.228 178.699 -1.471 17931
546 1 3 . 1 1 18 18 GLU CA C 733 58.298 58.298 59.341 -1.043 17931
547 1 3 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.304 0.143 17931
548 1 3 . 1 1 18 18 GLU H H 733 8.130 8.130 7.649 0.481 17931
549 1 3 . 1 1 19 19 ARG N N 734 118.929 118.929 118.823 0.106 17931
550 1 3 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.221 -0.192 17931
551 1 3 . 1 1 19 19 ARG C C 734 177.402 177.402 178.056 -0.654 17931
552 1 3 . 1 1 19 19 ARG CA C 734 58.400 58.400 58.008 0.392 17931
553 1 3 . 1 1 19 19 ARG CB C 734 32.170 32.170 29.752 2.418 17931
554 1 3 . 1 1 19 19 ARG H H 734 8.032 8.032 7.659 0.373 17931
555 1 3 . 1 1 20 20 ALA N N 735 121.514 121.514 122.127 -0.613 17931
556 1 3 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.149 -0.020 17931
557 1 3 . 1 1 20 20 ALA C C 735 179.108 179.108 179.619 -0.511 17931
558 1 3 . 1 1 20 20 ALA CA C 735 53.559 53.559 55.092 -1.533 17931
559 1 3 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.421 0.140 17931
560 1 3 . 1 1 20 20 ALA H H 735 7.853 7.853 8.448 -0.595 17931
561 1 3 . 1 1 21 21 ARG N N 736 117.944 117.944 118.494 -0.550 17931
562 1 3 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.059 0.051 17931
563 1 3 . 1 1 21 21 ARG C C 736 176.643 176.643 178.230 -1.587 17931
564 1 3 . 1 1 21 21 ARG CA C 736 56.737 56.737 58.492 -1.755 17931
565 1 3 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.304 0.269 17931
566 1 3 . 1 1 21 21 ARG H H 736 7.850 7.850 8.694 -0.844 17931
567 1 3 . 1 1 22 22 ALA N N 737 122.381 122.381 120.903 1.478 17931
568 1 3 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.174 -0.023 17931
569 1 3 . 1 1 22 22 ALA C C 737 177.640 177.640 178.701 -1.061 17931
570 1 3 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.519 -1.748 17931
571 1 3 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.597 0.150 17931
572 1 3 . 1 1 22 22 ALA H H 737 7.776 7.776 7.904 -0.128 17931
573 1 3 . 1 1 23 23 LYS N N 738 118.327 118.327 115.186 3.141 17931
574 1 3 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.320 -0.161 17931
575 1 3 . 1 1 23 23 LYS C C 738 176.483 176.483 176.605 -0.122 17931
576 1 3 . 1 1 23 23 LYS CA C 738 56.468 56.468 57.067 -0.599 17931
577 1 3 . 1 1 23 23 LYS CB C 738 32.526 32.526 34.547 -2.021 17931
578 1 3 . 1 1 23 23 LYS H H 738 7.838 7.838 7.644 0.194 17931
579 1 3 . 1 1 24 24 TRP N N 739 120.598 120.598 120.564 0.034 17931
580 1 3 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.961 -0.360 17931
581 1 3 . 1 1 24 24 TRP C C 739 175.904 175.904 175.486 0.418 17931
582 1 3 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.443 0.504 17931
583 1 3 . 1 1 24 24 TRP CB C 739 29.521 29.521 28.976 0.545 17931
584 1 3 . 1 1 24 24 TRP H H 739 7.958 7.958 8.610 -0.652 17931
585 1 3 . 1 1 25 25 ASP N N 740 121.214 121.214 122.448 -1.234 17931
586 1 3 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.246 -0.095 17931
587 1 3 . 1 1 25 25 ASP C C 740 176.626 176.626 177.794 -1.168 17931
588 1 3 . 1 1 25 25 ASP CA C 740 54.173 54.173 58.651 -4.478 17931
589 1 3 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.898 0.073 17931
590 1 3 . 1 1 25 25 ASP H H 740 8.248 8.248 7.978 0.270 17931
591 1 3 . 1 1 26 26 THR N N 741 113.708 113.708 112.189 1.519 17931
592 1 3 . 1 1 26 26 THR HA H 741 4.221 4.221 4.086 0.135 17931
593 1 3 . 1 1 26 26 THR C C 741 174.851 174.851 174.888 -0.037 17931
594 1 3 . 1 1 26 26 THR CA C 741 62.439 62.439 64.710 -2.271 17931
595 1 3 . 1 1 26 26 THR CB C 741 69.255 69.255 68.346 0.909 17931
596 1 3 . 1 1 26 26 THR H H 741 7.945 7.945 8.497 -0.552 17931
597 1 3 . 1 1 27 27 ALA N N 742 124.543 124.543 122.514 2.029 17931
598 1 3 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.336 -0.140 17931
599 1 3 . 1 1 27 27 ALA C C 742 177.509 177.509 178.974 -1.465 17931
600 1 3 . 1 1 27 27 ALA CA C 742 52.953 52.953 53.903 -0.950 17931
601 1 3 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.500 -0.551 17931
602 1 3 . 1 1 27 27 ALA H H 742 8.113 8.113 7.610 0.503 17931
603 1 3 . 1 1 28 28 ASN N N 743 116.039 116.039 116.501 -0.462 17931
604 1 3 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.772 -0.173 17931
605 1 3 . 1 1 28 28 ASN C C 743 174.330 174.330 175.322 -0.992 17931
606 1 3 . 1 1 28 28 ASN CA C 743 52.868 52.868 55.170 -2.302 17931
607 1 3 . 1 1 28 28 ASN CB C 743 38.995 38.995 40.385 -1.390 17931
608 1 3 . 1 1 28 28 ASN H H 743 8.055 8.055 8.247 -0.192 17931
609 1 3 . 1 1 29 29 ASN N N 744 119.625 119.625 119.682 -0.057 17931
610 1 3 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.094 -0.486 17931
611 1 3 . 1 1 29 29 ASN CA C 744 50.940 50.940 50.989 -0.049 17931
612 1 3 . 1 1 29 29 ASN CB C 744 38.798 38.798 40.364 -1.566 17931
613 1 3 . 1 1 29 29 ASN H H 744 8.015 8.015 8.212 -0.197 17931
614 1 3 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.318 0.054 17931
615 1 3 . 1 1 30 30 PRO C C 745 177.196 177.196 176.972 0.224 17931
616 1 3 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.454 -0.871 17931
617 1 3 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.128 -0.240 17931
618 1 3 . 1 1 34 34 GLU N N 749 121.140 121.140 121.329 -0.189 17931
619 1 3 . 1 1 34 34 GLU HA H 749 4.206 4.206 3.985 0.221 17931
620 1 3 . 1 1 34 34 GLU C C 749 176.764 176.764 177.923 -1.159 17931
621 1 3 . 1 1 34 34 GLU CA C 749 56.698 56.698 58.922 -2.224 17931
622 1 3 . 1 1 34 34 GLU CB C 749 29.784 29.784 29.946 -0.162 17931
623 1 3 . 1 1 34 34 GLU H H 749 8.215 8.215 8.822 -0.607 17931
624 1 3 . 1 1 35 35 ALA N N 750 124.506 124.506 121.639 2.867 17931
625 1 3 . 1 1 35 35 ALA HA H 750 4.276 4.276 3.925 0.351 17931
626 1 3 . 1 1 35 35 ALA C C 750 178.054 178.054 178.602 -0.548 17931
627 1 3 . 1 1 35 35 ALA CA C 750 53.011 53.011 54.100 -1.089 17931
628 1 3 . 1 1 35 35 ALA CB C 750 19.021 19.021 17.806 1.215 17931
629 1 3 . 1 1 35 35 ALA H H 750 8.335 8.335 8.279 0.056 17931
630 1 3 . 1 1 36 36 THR N N 751 111.925 111.925 111.393 0.532 17931
631 1 3 . 1 1 36 36 THR HA H 751 4.225 4.225 4.357 -0.132 17931
632 1 3 . 1 1 36 36 THR C C 751 175.137 175.137 176.116 -0.979 17931
633 1 3 . 1 1 36 36 THR CA C 751 62.508 62.508 63.515 -1.007 17931
634 1 3 . 1 1 36 36 THR CB C 751 69.600 69.600 68.280 1.320 17931
635 1 3 . 1 1 36 36 THR H H 751 8.007 8.007 8.026 -0.019 17931
636 1 3 . 1 1 37 37 SER N N 752 117.676 117.676 116.619 1.057 17931
637 1 3 . 1 1 37 37 SER HA H 752 4.567 4.567 4.295 0.272 17931
638 1 3 . 1 1 37 37 SER C C 752 174.881 174.881 175.596 -0.715 17931
639 1 3 . 1 1 37 37 SER CA C 752 58.856 58.856 61.343 -2.487 17931
640 1 3 . 1 1 37 37 SER CB C 752 63.705 63.705 62.974 0.731 17931
641 1 3 . 1 1 37 37 SER H H 752 8.156 8.156 7.613 0.543 17931
642 1 3 . 1 1 38 38 THR N N 753 116.343 116.343 113.888 2.455 17931
643 1 3 . 1 1 38 38 THR HA H 753 4.126 4.126 4.319 -0.193 17931
644 1 3 . 1 1 38 38 THR C C 753 174.555 174.555 174.555 0.000 17931
645 1 3 . 1 1 38 38 THR CA C 753 62.889 62.889 63.450 -0.561 17931
646 1 3 . 1 1 38 38 THR CB C 753 69.292 69.292 69.867 -0.575 17931
647 1 3 . 1 1 38 38 THR H H 753 8.042 8.042 7.410 0.632 17931
648 1 3 . 1 1 39 39 PHE N N 754 120.983 120.983 119.599 1.384 17931
649 1 3 . 1 1 39 39 PHE HA H 754 4.567 4.567 5.028 -0.461 17931
650 1 3 . 1 1 39 39 PHE C C 754 175.956 175.956 173.614 2.342 17931
651 1 3 . 1 1 39 39 PHE CA C 754 58.289 58.289 55.480 2.809 17931
652 1 3 . 1 1 39 39 PHE CB C 754 39.222 39.222 40.457 -1.235 17931
653 1 3 . 1 1 39 39 PHE H H 754 8.163 8.163 7.773 0.390 17931
654 1 3 . 1 1 40 40 THR N N 755 114.474 114.474 120.220 -5.746 17931
655 1 3 . 1 1 40 40 THR HA H 755 4.159 4.159 4.043 0.116 17931
656 1 3 . 1 1 40 40 THR C C 755 174.168 174.168 174.191 -0.023 17931
657 1 3 . 1 1 40 40 THR CA C 755 62.446 62.446 63.696 -1.250 17931
658 1 3 . 1 1 40 40 THR CB C 755 69.403 69.403 68.405 0.998 17931
659 1 3 . 1 1 40 40 THR H H 755 7.943 7.943 8.494 -0.551 17931
660 1 3 . 1 1 41 41 ASN N N 756 120.598 120.598 126.774 -6.176 17931
661 1 3 . 1 1 41 41 ASN HA H 756 4.599 4.599 5.030 -0.431 17931
662 1 3 . 1 1 41 41 ASN C C 756 175.438 175.438 174.475 0.963 17931
663 1 3 . 1 1 41 41 ASN CA C 756 53.625 53.625 52.602 1.023 17931
664 1 3 . 1 1 41 41 ASN CB C 756 38.852 38.852 39.313 -0.461 17931
665 1 3 . 1 1 41 41 ASN H H 756 8.254 8.254 8.644 -0.390 17931
666 1 3 . 1 1 42 42 ILE N N 757 119.988 119.988 117.769 2.219 17931
667 1 3 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.431 -0.298 17931
668 1 3 . 1 1 42 42 ILE C C 757 176.180 176.180 175.862 0.318 17931
669 1 3 . 1 1 42 42 ILE CA C 757 61.607 61.607 60.888 0.719 17931
670 1 3 . 1 1 42 42 ILE CB C 757 38.526 38.526 38.231 0.295 17931
671 1 3 . 1 1 42 42 ILE H H 757 7.988 7.988 8.306 -0.318 17931
672 1 3 . 1 1 46 46 GLY N N 761 109.795 109.795 111.549 -1.754 17931
673 1 3 . 1 1 46 46 GLY C C 761 173.400 173.400 173.982 -0.582 17931
674 1 3 . 1 1 46 46 GLY CA C 761 45.241 45.241 44.718 0.523 17931
675 1 3 . 1 1 46 46 GLY H H 761 8.038 8.038 8.374 -0.336 17931
676 1 4 . 1 1 2 2 LEU N N 717 120.100 120.100 122.301 -2.201 17931
677 1 4 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.240 -0.110 17931
678 1 4 . 1 1 2 2 LEU C C 717 177.505 177.505 177.647 -0.142 17931
679 1 4 . 1 1 2 2 LEU CA C 717 56.674 56.674 57.372 -0.698 17931
680 1 4 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.364 0.489 17931
681 1 4 . 1 1 2 2 LEU H H 717 7.866 7.866 8.065 -0.199 17931
682 1 4 . 1 1 3 3 LEU N N 718 118.481 118.481 117.057 1.424 17931
683 1 4 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.077 -0.020 17931
684 1 4 . 1 1 3 3 LEU C C 718 177.643 177.643 178.858 -1.215 17931
685 1 4 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.991 -1.048 17931
686 1 4 . 1 1 3 3 LEU CB C 718 41.735 41.735 41.388 0.347 17931
687 1 4 . 1 1 3 3 LEU H H 718 7.746 7.746 8.123 -0.377 17931
688 1 4 . 1 1 4 4 ILE N N 719 116.207 116.207 117.497 -1.290 17931
689 1 4 . 1 1 4 4 ILE HA H 719 3.911 3.911 4.028 -0.117 17931
690 1 4 . 1 1 4 4 ILE C C 719 176.774 176.774 178.842 -2.068 17931
691 1 4 . 1 1 4 4 ILE CA C 719 62.960 62.960 63.979 -1.019 17931
692 1 4 . 1 1 4 4 ILE CB C 719 38.219 38.219 38.240 -0.021 17931
693 1 4 . 1 1 4 4 ILE H H 719 7.724 7.724 7.432 0.292 17931
694 1 4 . 1 1 5 5 THR N N 720 114.581 114.581 116.254 -1.673 17931
695 1 4 . 1 1 5 5 THR HA H 720 4.161 4.161 4.188 -0.027 17931
696 1 4 . 1 1 5 5 THR C C 720 175.458 175.458 176.868 -1.410 17931
697 1 4 . 1 1 5 5 THR CA C 720 64.390 64.390 66.007 -1.617 17931
698 1 4 . 1 1 5 5 THR CB C 720 69.052 69.052 68.730 0.322 17931
699 1 4 . 1 1 5 5 THR H H 720 7.802 7.802 8.263 -0.461 17931
700 1 4 . 1 1 6 6 ILE N N 721 119.805 119.805 121.194 -1.389 17931
701 1 4 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.568 0.341 17931
702 1 4 . 1 1 6 6 ILE C C 721 176.102 176.102 176.911 -0.809 17931
703 1 4 . 1 1 6 6 ILE CA C 721 63.025 63.025 64.988 -1.963 17931
704 1 4 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.724 0.381 17931
705 1 4 . 1 1 6 6 ILE H H 721 7.751 7.751 7.928 -0.177 17931
706 1 4 . 1 1 7 7 HIS N N 722 118.760 118.760 116.340 2.420 17931
707 1 4 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.333 0.282 17931
708 1 4 . 1 1 7 7 HIS C C 722 174.538 174.538 176.788 -2.250 17931
709 1 4 . 1 1 7 7 HIS CA C 722 57.344 57.344 59.438 -2.094 17931
710 1 4 . 1 1 7 7 HIS CB C 722 29.375 29.375 29.939 -0.565 17931
711 1 4 . 1 1 7 7 HIS H H 722 8.097 8.097 7.699 0.398 17931
712 1 4 . 1 1 8 8 ASP N N 723 117.884 117.884 116.818 1.066 17931
713 1 4 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.923 -0.329 17931
714 1 4 . 1 1 8 8 ASP C C 723 176.829 176.829 177.095 -0.266 17931
715 1 4 . 1 1 8 8 ASP CA C 723 54.176 54.176 54.528 -0.352 17931
716 1 4 . 1 1 8 8 ASP CB C 723 41.500 41.500 41.559 -0.059 17931
717 1 4 . 1 1 8 8 ASP H H 723 7.969 7.969 7.986 -0.017 17931
718 1 4 . 1 1 9 9 ARG N N 724 121.014 121.014 121.301 -0.287 17931
719 1 4 . 1 1 9 9 ARG HA H 724 4.204 4.204 4.056 0.148 17931
720 1 4 . 1 1 9 9 ARG C C 724 177.662 177.662 178.014 -0.352 17931
721 1 4 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.496 -2.678 17931
722 1 4 . 1 1 9 9 ARG CB C 724 32.703 32.703 30.082 2.621 17931
723 1 4 . 1 1 9 9 ARG H H 724 8.216 8.216 7.993 0.223 17931
724 1 4 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.228 -0.093 17931
725 1 4 . 1 1 10 10 LYS C C 725 178.127 178.127 177.669 0.458 17931
726 1 4 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.727 -0.980 17931
727 1 4 . 1 1 10 10 LYS CB C 725 32.190 32.190 31.976 0.214 17931
728 1 4 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.436 -0.340 17931
729 1 4 . 1 1 11 11 GLU C C 726 177.791 177.791 178.431 -0.640 17931
730 1 4 . 1 1 11 11 GLU CA C 726 58.406 58.406 56.944 1.462 17931
731 1 4 . 1 1 11 11 GLU CB C 726 29.340 29.340 30.778 -1.438 17931
732 1 4 . 1 1 12 12 PHE N N 727 118.859 118.859 121.350 -2.491 17931
733 1 4 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.380 -0.002 17931
734 1 4 . 1 1 12 12 PHE C C 727 176.439 176.439 176.602 -0.163 17931
735 1 4 . 1 1 12 12 PHE CA C 727 59.332 59.332 60.184 -0.852 17931
736 1 4 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.696 -0.536 17931
737 1 4 . 1 1 12 12 PHE H H 727 7.922 7.922 8.682 -0.760 17931
738 1 4 . 1 1 13 13 ALA N N 728 122.111 122.111 121.395 0.716 17931
739 1 4 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.962 0.196 17931
740 1 4 . 1 1 13 13 ALA C C 728 178.542 178.542 179.354 -0.812 17931
741 1 4 . 1 1 13 13 ALA CA C 728 54.083 54.083 54.643 -0.560 17931
742 1 4 . 1 1 13 13 ALA CB C 728 18.409 18.409 17.924 0.485 17931
743 1 4 . 1 1 13 13 ALA H H 728 7.970 7.970 7.916 0.054 17931
744 1 4 . 1 1 14 14 LYS N N 729 117.588 117.588 119.514 -1.926 17931
745 1 4 . 1 1 14 14 LYS HA H 729 4.096 4.096 4.036 0.060 17931
746 1 4 . 1 1 14 14 LYS C C 729 177.664 177.664 178.526 -0.862 17931
747 1 4 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.942 -2.012 17931
748 1 4 . 1 1 14 14 LYS CB C 729 30.515 30.515 32.156 -1.641 17931
749 1 4 . 1 1 14 14 LYS H H 729 7.792 7.792 7.998 -0.206 17931
750 1 4 . 1 1 15 15 PHE N N 730 119.916 119.916 119.603 0.313 17931
751 1 4 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.579 -0.200 17931
752 1 4 . 1 1 15 15 PHE C C 730 176.732 176.732 177.315 -0.583 17931
753 1 4 . 1 1 15 15 PHE CA C 730 59.753 59.753 60.856 -1.103 17931
754 1 4 . 1 1 15 15 PHE CB C 730 39.010 39.010 39.829 -0.819 17931
755 1 4 . 1 1 15 15 PHE H H 730 7.874 7.874 7.755 0.119 17931
756 1 4 . 1 1 16 16 GLU N N 731 119.398 119.398 118.563 0.835 17931
757 1 4 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.919 0.146 17931
758 1 4 . 1 1 16 16 GLU C C 731 177.920 177.920 178.756 -0.836 17931
759 1 4 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.318 -1.493 17931
760 1 4 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.939 0.410 17931
761 1 4 . 1 1 16 16 GLU H H 731 8.178 8.178 8.090 0.088 17931
762 1 4 . 1 1 17 17 GLU N N 732 120.386 120.386 119.760 0.626 17931
763 1 4 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.888 0.162 17931
764 1 4 . 1 1 17 17 GLU C C 732 178.097 178.097 178.911 -0.814 17931
765 1 4 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.331 -1.024 17931
766 1 4 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.388 0.000 17931
767 1 4 . 1 1 17 17 GLU H H 732 8.117 8.117 8.691 -0.574 17931
768 1 4 . 1 1 18 18 GLU N N 733 119.473 119.473 119.193 0.280 17931
769 1 4 . 1 1 18 18 GLU HA H 733 4.056 4.056 3.920 0.136 17931
770 1 4 . 1 1 18 18 GLU C C 733 177.228 177.228 178.638 -1.410 17931
771 1 4 . 1 1 18 18 GLU CA C 733 58.298 58.298 58.976 -0.678 17931
772 1 4 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.218 0.230 17931
773 1 4 . 1 1 18 18 GLU H H 733 8.130 8.130 7.477 0.653 17931
774 1 4 . 1 1 19 19 ARG N N 734 118.929 118.929 118.612 0.317 17931
775 1 4 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.149 -0.120 17931
776 1 4 . 1 1 19 19 ARG C C 734 177.402 177.402 178.291 -0.889 17931
777 1 4 . 1 1 19 19 ARG CA C 734 58.400 58.400 58.019 0.381 17931
778 1 4 . 1 1 19 19 ARG CB C 734 32.170 32.170 29.987 2.183 17931
779 1 4 . 1 1 19 19 ARG H H 734 8.032 8.032 7.361 0.671 17931
780 1 4 . 1 1 20 20 ALA N N 735 121.514 121.514 121.015 0.499 17931
781 1 4 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.202 -0.073 17931
782 1 4 . 1 1 20 20 ALA C C 735 179.108 179.108 179.761 -0.653 17931
783 1 4 . 1 1 20 20 ALA CA C 735 53.559 53.559 54.754 -1.195 17931
784 1 4 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.605 -0.044 17931
785 1 4 . 1 1 20 20 ALA H H 735 7.853 7.853 8.428 -0.575 17931
786 1 4 . 1 1 21 21 ARG N N 736 117.944 117.944 117.338 0.606 17931
787 1 4 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.173 -0.063 17931
788 1 4 . 1 1 21 21 ARG C C 736 176.643 176.643 177.779 -1.136 17931
789 1 4 . 1 1 21 21 ARG CA C 736 56.737 56.737 57.427 -0.690 17931
790 1 4 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.530 0.042 17931
791 1 4 . 1 1 21 21 ARG H H 736 7.850 7.850 8.501 -0.651 17931
792 1 4 . 1 1 22 22 ALA N N 737 122.381 122.381 122.463 -0.082 17931
793 1 4 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.092 0.059 17931
794 1 4 . 1 1 22 22 ALA C C 737 177.640 177.640 178.880 -1.240 17931
795 1 4 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.710 -1.940 17931
796 1 4 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.609 0.138 17931
797 1 4 . 1 1 22 22 ALA H H 737 7.776 7.776 7.477 0.299 17931
798 1 4 . 1 1 23 23 LYS N N 738 118.327 118.327 113.118 5.209 17931
799 1 4 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.402 -0.243 17931
800 1 4 . 1 1 23 23 LYS C C 738 176.483 176.483 176.573 -0.090 17931
801 1 4 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.179 0.289 17931
802 1 4 . 1 1 23 23 LYS CB C 738 32.526 32.526 34.001 -1.475 17931
803 1 4 . 1 1 23 23 LYS H H 738 7.838 7.838 8.224 -0.386 17931
804 1 4 . 1 1 24 24 TRP N N 739 120.598 120.598 121.236 -0.638 17931
805 1 4 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.931 -0.330 17931
806 1 4 . 1 1 24 24 TRP C C 739 175.904 175.904 175.408 0.496 17931
807 1 4 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.214 0.733 17931
808 1 4 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.320 0.201 17931
809 1 4 . 1 1 24 24 TRP H H 739 7.958 7.958 7.710 0.248 17931
810 1 4 . 1 1 25 25 ASP N N 740 121.214 121.214 120.671 0.543 17931
811 1 4 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.288 -0.137 17931
812 1 4 . 1 1 25 25 ASP C C 740 176.626 176.626 177.682 -1.056 17931
813 1 4 . 1 1 25 25 ASP CA C 740 54.173 54.173 57.341 -3.168 17931
814 1 4 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.073 0.898 17931
815 1 4 . 1 1 25 25 ASP H H 740 8.248 8.248 7.922 0.326 17931
816 1 4 . 1 1 26 26 THR N N 741 113.708 113.708 113.309 0.399 17931
817 1 4 . 1 1 26 26 THR HA H 741 4.221 4.221 4.100 0.121 17931
818 1 4 . 1 1 26 26 THR C C 741 174.851 174.851 174.815 0.036 17931
819 1 4 . 1 1 26 26 THR CA C 741 62.439 62.439 64.470 -2.031 17931
820 1 4 . 1 1 26 26 THR CB C 741 69.255 69.255 68.407 0.848 17931
821 1 4 . 1 1 26 26 THR H H 741 7.945 7.945 8.344 -0.399 17931
822 1 4 . 1 1 27 27 ALA N N 742 124.543 124.543 121.913 2.630 17931
823 1 4 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.447 -0.251 17931
824 1 4 . 1 1 27 27 ALA C C 742 177.509 177.509 178.659 -1.150 17931
825 1 4 . 1 1 27 27 ALA CA C 742 52.953 52.953 53.564 -0.611 17931
826 1 4 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.880 -0.931 17931
827 1 4 . 1 1 27 27 ALA H H 742 8.113 8.113 7.744 0.369 17931
828 1 4 . 1 1 28 28 ASN N N 743 116.039 116.039 115.113 0.926 17931
829 1 4 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.869 -0.270 17931
830 1 4 . 1 1 28 28 ASN C C 743 174.330 174.330 175.741 -1.411 17931
831 1 4 . 1 1 28 28 ASN CA C 743 52.868 52.868 53.863 -0.995 17931
832 1 4 . 1 1 28 28 ASN CB C 743 38.995 38.995 41.178 -2.183 17931
833 1 4 . 1 1 28 28 ASN H H 743 8.055 8.055 8.069 -0.014 17931
834 1 4 . 1 1 29 29 ASN N N 744 119.625 119.625 119.798 -0.173 17931
835 1 4 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.032 -0.424 17931
836 1 4 . 1 1 29 29 ASN CA C 744 50.940 50.940 51.479 -0.539 17931
837 1 4 . 1 1 29 29 ASN CB C 744 38.798 38.798 39.624 -0.826 17931
838 1 4 . 1 1 29 29 ASN H H 744 8.015 8.015 7.902 0.113 17931
839 1 4 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.272 0.100 17931
840 1 4 . 1 1 30 30 PRO C C 745 177.196 177.196 176.827 0.369 17931
841 1 4 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.697 -1.114 17931
842 1 4 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.200 -0.312 17931
843 1 4 . 1 1 34 34 GLU N N 749 121.140 121.140 119.589 1.551 17931
844 1 4 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.085 0.121 17931
845 1 4 . 1 1 34 34 GLU C C 749 176.764 176.764 176.341 0.423 17931
846 1 4 . 1 1 34 34 GLU CA C 749 56.698 56.698 58.131 -1.433 17931
847 1 4 . 1 1 34 34 GLU CB C 749 29.784 29.784 30.050 -0.266 17931
848 1 4 . 1 1 34 34 GLU H H 749 8.215 8.215 8.334 -0.119 17931
849 1 4 . 1 1 35 35 ALA N N 750 124.506 124.506 123.121 1.385 17931
850 1 4 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.885 -0.609 17931
851 1 4 . 1 1 35 35 ALA C C 750 178.054 178.054 177.511 0.543 17931
852 1 4 . 1 1 35 35 ALA CA C 750 53.011 53.011 51.177 1.834 17931
853 1 4 . 1 1 35 35 ALA CB C 750 19.021 19.021 18.839 0.182 17931
854 1 4 . 1 1 35 35 ALA H H 750 8.335 8.335 7.978 0.357 17931
855 1 4 . 1 1 36 36 THR N N 751 111.925 111.925 116.891 -4.966 17931
856 1 4 . 1 1 36 36 THR HA H 751 4.225 4.225 3.942 0.283 17931
857 1 4 . 1 1 36 36 THR C C 751 175.137 175.137 176.472 -1.335 17931
858 1 4 . 1 1 36 36 THR CA C 751 62.508 62.508 67.514 -5.006 17931
859 1 4 . 1 1 36 36 THR CB C 751 69.600 69.600 68.838 0.762 17931
860 1 4 . 1 1 36 36 THR H H 751 8.007 8.007 8.525 -0.518 17931
861 1 4 . 1 1 37 37 SER N N 752 117.676 117.676 116.563 1.113 17931
862 1 4 . 1 1 37 37 SER HA H 752 4.567 4.567 4.181 0.386 17931
863 1 4 . 1 1 37 37 SER C C 752 174.881 174.881 176.308 -1.427 17931
864 1 4 . 1 1 37 37 SER CA C 752 58.856 58.856 62.108 -3.252 17931
865 1 4 . 1 1 37 37 SER CB C 752 63.705 63.705 62.523 1.181 17931
866 1 4 . 1 1 37 37 SER H H 752 8.156 8.156 8.727 -0.571 17931
867 1 4 . 1 1 38 38 THR N N 753 116.343 116.343 119.385 -3.042 17931
868 1 4 . 1 1 38 38 THR HA H 753 4.126 4.126 4.035 0.091 17931
869 1 4 . 1 1 38 38 THR C C 753 174.555 174.555 176.336 -1.781 17931
870 1 4 . 1 1 38 38 THR CA C 753 62.889 62.889 66.325 -3.436 17931
871 1 4 . 1 1 38 38 THR CB C 753 69.292 69.292 68.915 0.377 17931
872 1 4 . 1 1 38 38 THR H H 753 8.042 8.042 7.644 0.398 17931
873 1 4 . 1 1 39 39 PHE N N 754 120.983 120.983 117.552 3.431 17931
874 1 4 . 1 1 39 39 PHE HA H 754 4.567 4.567 5.024 -0.457 17931
875 1 4 . 1 1 39 39 PHE C C 754 175.956 175.956 176.791 -0.835 17931
876 1 4 . 1 1 39 39 PHE CA C 754 58.289 58.289 59.242 -0.953 17931
877 1 4 . 1 1 39 39 PHE CB C 754 39.222 39.222 38.742 0.480 17931
878 1 4 . 1 1 39 39 PHE H H 754 8.163 8.163 8.569 -0.406 17931
879 1 4 . 1 1 40 40 THR N N 755 114.474 114.474 113.836 0.638 17931
880 1 4 . 1 1 40 40 THR HA H 755 4.159 4.159 4.246 -0.087 17931
881 1 4 . 1 1 40 40 THR C C 755 174.168 174.168 175.182 -1.014 17931
882 1 4 . 1 1 40 40 THR CA C 755 62.446 62.446 64.769 -2.322 17931
883 1 4 . 1 1 40 40 THR CB C 755 69.403 69.403 69.067 0.336 17931
884 1 4 . 1 1 40 40 THR H H 755 7.943 7.943 8.171 -0.228 17931
885 1 4 . 1 1 41 41 ASN N N 756 120.598 120.598 118.468 2.130 17931
886 1 4 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.739 -0.140 17931
887 1 4 . 1 1 41 41 ASN C C 756 175.438 175.438 175.587 -0.149 17931
888 1 4 . 1 1 41 41 ASN CA C 756 53.625 53.625 54.518 -0.893 17931
889 1 4 . 1 1 41 41 ASN CB C 756 38.852 38.852 40.026 -1.175 17931
890 1 4 . 1 1 41 41 ASN H H 756 8.254 8.254 7.715 0.539 17931
891 1 4 . 1 1 42 42 ILE N N 757 119.988 119.988 121.282 -1.294 17931
892 1 4 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.389 -0.256 17931
893 1 4 . 1 1 42 42 ILE C C 757 176.180 176.180 174.847 1.333 17931
894 1 4 . 1 1 42 42 ILE CA C 757 61.607 61.607 59.705 1.902 17931
895 1 4 . 1 1 42 42 ILE CB C 757 38.526 38.526 37.242 1.284 17931
896 1 4 . 1 1 42 42 ILE H H 757 7.988 7.988 8.064 -0.076 17931
897 1 4 . 1 1 46 46 GLY N N 761 109.795 109.795 110.976 -1.181 17931
898 1 4 . 1 1 46 46 GLY C C 761 173.400 173.400 174.002 -0.602 17931
899 1 4 . 1 1 46 46 GLY CA C 761 45.241 45.241 44.455 0.787 17931
900 1 4 . 1 1 46 46 GLY H H 761 8.038 8.038 8.632 -0.594 17931
901 1 5 . 1 1 2 2 LEU N N 717 120.100 120.100 123.108 -3.008 17931
902 1 5 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.311 -0.181 17931
903 1 5 . 1 1 2 2 LEU C C 717 177.505 177.505 177.864 -0.359 17931
904 1 5 . 1 1 2 2 LEU CA C 717 56.674 56.674 57.108 -0.434 17931
905 1 5 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.398 0.455 17931
906 1 5 . 1 1 2 2 LEU H H 717 7.866 7.866 7.962 -0.096 17931
907 1 5 . 1 1 3 3 LEU N N 718 118.481 118.481 117.946 0.535 17931
908 1 5 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.105 -0.048 17931
909 1 5 . 1 1 3 3 LEU C C 718 177.643 177.643 178.670 -1.027 17931
910 1 5 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.656 -0.713 17931
911 1 5 . 1 1 3 3 LEU CB C 718 41.735 41.735 41.056 0.679 17931
912 1 5 . 1 1 3 3 LEU H H 718 7.746 7.746 7.953 -0.207 17931
913 1 5 . 1 1 4 4 ILE N N 719 116.207 116.207 116.350 -0.143 17931
914 1 5 . 1 1 4 4 ILE HA H 719 3.911 3.911 3.951 -0.040 17931
915 1 5 . 1 1 4 4 ILE C C 719 176.774 176.774 178.778 -2.004 17931
916 1 5 . 1 1 4 4 ILE CA C 719 62.960 62.960 63.048 -0.088 17931
917 1 5 . 1 1 4 4 ILE CB C 719 38.219 38.219 36.969 1.250 17931
918 1 5 . 1 1 4 4 ILE H H 719 7.724 7.724 7.529 0.195 17931
919 1 5 . 1 1 5 5 THR N N 720 114.581 114.581 116.652 -2.071 17931
920 1 5 . 1 1 5 5 THR HA H 720 4.161 4.161 4.192 -0.031 17931
921 1 5 . 1 1 5 5 THR C C 720 175.458 175.458 176.604 -1.146 17931
922 1 5 . 1 1 5 5 THR CA C 720 64.390 64.390 65.880 -1.490 17931
923 1 5 . 1 1 5 5 THR CB C 720 69.052 69.052 68.482 0.570 17931
924 1 5 . 1 1 5 5 THR H H 720 7.802 7.802 8.227 -0.425 17931
925 1 5 . 1 1 6 6 ILE N N 721 119.805 119.805 120.270 -0.465 17931
926 1 5 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.510 0.399 17931
927 1 5 . 1 1 6 6 ILE C C 721 176.102 176.102 177.037 -0.935 17931
928 1 5 . 1 1 6 6 ILE CA C 721 63.025 63.025 64.940 -1.915 17931
929 1 5 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.565 0.539 17931
930 1 5 . 1 1 6 6 ILE H H 721 7.751 7.751 7.941 -0.190 17931
931 1 5 . 1 1 7 7 HIS N N 722 118.760 118.760 116.277 2.483 17931
932 1 5 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.396 0.219 17931
933 1 5 . 1 1 7 7 HIS C C 722 174.538 174.538 176.705 -2.167 17931
934 1 5 . 1 1 7 7 HIS CA C 722 57.344 57.344 58.812 -1.468 17931
935 1 5 . 1 1 7 7 HIS CB C 722 29.375 29.375 30.070 -0.695 17931
936 1 5 . 1 1 7 7 HIS H H 722 8.097 8.097 7.758 0.339 17931
937 1 5 . 1 1 8 8 ASP N N 723 117.884 117.884 117.234 0.650 17931
938 1 5 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.956 -0.362 17931
939 1 5 . 1 1 8 8 ASP C C 723 176.829 176.829 177.180 -0.351 17931
940 1 5 . 1 1 8 8 ASP CA C 723 54.176 54.176 54.544 -0.368 17931
941 1 5 . 1 1 8 8 ASP CB C 723 41.500 41.500 42.240 -0.740 17931
942 1 5 . 1 1 8 8 ASP H H 723 7.969 7.969 7.838 0.131 17931
943 1 5 . 1 1 9 9 ARG N N 724 121.014 121.014 119.812 1.202 17931
944 1 5 . 1 1 9 9 ARG HA H 724 4.204 4.204 4.019 0.185 17931
945 1 5 . 1 1 9 9 ARG C C 724 177.662 177.662 177.056 0.606 17931
946 1 5 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.336 -2.517 17931
947 1 5 . 1 1 9 9 ARG CB C 724 32.703 32.703 29.626 3.077 17931
948 1 5 . 1 1 9 9 ARG H H 724 8.216 8.216 7.880 0.336 17931
949 1 5 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.084 0.051 17931
950 1 5 . 1 1 10 10 LYS C C 725 178.127 178.127 177.497 0.630 17931
951 1 5 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.633 -0.885 17931
952 1 5 . 1 1 10 10 LYS CB C 725 32.190 32.190 32.042 0.148 17931
953 1 5 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.161 -0.065 17931
954 1 5 . 1 1 11 11 GLU C C 726 177.791 177.791 177.404 0.387 17931
955 1 5 . 1 1 11 11 GLU CA C 726 58.406 58.406 56.934 1.472 17931
956 1 5 . 1 1 11 11 GLU CB C 726 29.340 29.340 30.088 -0.748 17931
957 1 5 . 1 1 12 12 PHE N N 727 118.859 118.859 120.504 -1.645 17931
958 1 5 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.461 -0.083 17931
959 1 5 . 1 1 12 12 PHE C C 727 176.439 176.439 177.201 -0.762 17931
960 1 5 . 1 1 12 12 PHE CA C 727 59.332 59.332 59.844 -0.512 17931
961 1 5 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.958 -0.798 17931
962 1 5 . 1 1 12 12 PHE H H 727 7.922 7.922 8.302 -0.380 17931
963 1 5 . 1 1 13 13 ALA N N 728 122.111 122.111 122.121 -0.010 17931
964 1 5 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.507 0.651 17931
965 1 5 . 1 1 13 13 ALA C C 728 178.542 178.542 178.842 -0.300 17931
966 1 5 . 1 1 13 13 ALA CA C 728 54.083 54.083 54.895 -0.812 17931
967 1 5 . 1 1 13 13 ALA CB C 728 18.409 18.409 17.661 0.748 17931
968 1 5 . 1 1 13 13 ALA H H 728 7.970 7.970 8.136 -0.166 17931
969 1 5 . 1 1 14 14 LYS N N 729 117.588 117.588 118.467 -0.879 17931
970 1 5 . 1 1 14 14 LYS HA H 729 4.096 4.096 4.061 0.035 17931
971 1 5 . 1 1 14 14 LYS C C 729 177.664 177.664 178.478 -0.814 17931
972 1 5 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.475 -1.545 17931
973 1 5 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.786 -1.271 17931
974 1 5 . 1 1 14 14 LYS H H 729 7.792 7.792 7.680 0.112 17931
975 1 5 . 1 1 15 15 PHE N N 730 119.916 119.916 117.165 2.751 17931
976 1 5 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.348 0.031 17931
977 1 5 . 1 1 15 15 PHE C C 730 176.732 176.732 178.401 -1.669 17931
978 1 5 . 1 1 15 15 PHE CA C 730 59.753 59.753 59.621 0.132 17931
979 1 5 . 1 1 15 15 PHE CB C 730 39.010 39.010 38.913 0.097 17931
980 1 5 . 1 1 15 15 PHE H H 730 7.874 7.874 7.720 0.154 17931
981 1 5 . 1 1 16 16 GLU N N 731 119.398 119.398 119.381 0.017 17931
982 1 5 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.947 0.118 17931
983 1 5 . 1 1 16 16 GLU C C 731 177.920 177.920 178.689 -0.769 17931
984 1 5 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.321 -1.496 17931
985 1 5 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.724 0.625 17931
986 1 5 . 1 1 16 16 GLU H H 731 8.178 8.178 7.872 0.306 17931
987 1 5 . 1 1 17 17 GLU N N 732 120.386 120.386 120.064 0.322 17931
988 1 5 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.963 0.087 17931
989 1 5 . 1 1 17 17 GLU C C 732 178.097 178.097 179.048 -0.951 17931
990 1 5 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.338 -1.031 17931
991 1 5 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.203 0.184 17931
992 1 5 . 1 1 17 17 GLU H H 732 8.117 8.117 8.660 -0.543 17931
993 1 5 . 1 1 18 18 GLU N N 733 119.473 119.473 118.946 0.527 17931
994 1 5 . 1 1 18 18 GLU HA H 733 4.056 4.056 4.040 0.016 17931
995 1 5 . 1 1 18 18 GLU C C 733 177.228 177.228 178.495 -1.267 17931
996 1 5 . 1 1 18 18 GLU CA C 733 58.298 58.298 59.034 -0.736 17931
997 1 5 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.415 0.032 17931
998 1 5 . 1 1 18 18 GLU H H 733 8.130 8.130 7.812 0.318 17931
999 1 5 . 1 1 19 19 ARG N N 734 118.929 118.929 118.938 -0.009 17931
1000 1 5 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.239 -0.210 17931
1001 1 5 . 1 1 19 19 ARG C C 734 177.402 177.402 178.029 -0.627 17931
1002 1 5 . 1 1 19 19 ARG CA C 734 58.400 58.400 58.008 0.392 17931
1003 1 5 . 1 1 19 19 ARG CB C 734 32.170 32.170 30.018 2.152 17931
1004 1 5 . 1 1 19 19 ARG H H 734 8.032 8.032 7.670 0.362 17931
1005 1 5 . 1 1 20 20 ALA N N 735 121.514 121.514 121.631 -0.117 17931
1006 1 5 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.145 -0.016 17931
1007 1 5 . 1 1 20 20 ALA C C 735 179.108 179.108 179.738 -0.630 17931
1008 1 5 . 1 1 20 20 ALA CA C 735 53.559 53.559 54.749 -1.190 17931
1009 1 5 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.569 -0.008 17931
1010 1 5 . 1 1 20 20 ALA H H 735 7.853 7.853 8.247 -0.394 17931
1011 1 5 . 1 1 21 21 ARG N N 736 117.944 117.944 118.707 -0.763 17931
1012 1 5 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.128 -0.018 17931
1013 1 5 . 1 1 21 21 ARG C C 736 176.643 176.643 178.206 -1.563 17931
1014 1 5 . 1 1 21 21 ARG CA C 736 56.737 56.737 58.437 -1.700 17931
1015 1 5 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.393 0.180 17931
1016 1 5 . 1 1 21 21 ARG H H 736 7.850 7.850 8.580 -0.730 17931
1017 1 5 . 1 1 22 22 ALA N N 737 122.381 122.381 121.518 0.863 17931
1018 1 5 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.159 -0.008 17931
1019 1 5 . 1 1 22 22 ALA C C 737 177.640 177.640 178.762 -1.122 17931
1020 1 5 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.654 -1.884 17931
1021 1 5 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.468 0.279 17931
1022 1 5 . 1 1 22 22 ALA H H 737 7.776 7.776 8.177 -0.401 17931
1023 1 5 . 1 1 23 23 LYS N N 738 118.327 118.327 112.954 5.373 17931
1024 1 5 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.439 -0.280 17931
1025 1 5 . 1 1 23 23 LYS C C 738 176.483 176.483 176.189 0.294 17931
1026 1 5 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.420 0.048 17931
1027 1 5 . 1 1 23 23 LYS CB C 738 32.526 32.526 34.241 -1.715 17931
1028 1 5 . 1 1 23 23 LYS H H 738 7.838 7.838 7.967 -0.129 17931
1029 1 5 . 1 1 24 24 TRP N N 739 120.598 120.598 120.403 0.195 17931
1030 1 5 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.974 -0.373 17931
1031 1 5 . 1 1 24 24 TRP C C 739 175.904 175.904 175.605 0.299 17931
1032 1 5 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.237 0.710 17931
1033 1 5 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.399 0.121 17931
1034 1 5 . 1 1 24 24 TRP H H 739 7.958 7.958 7.711 0.247 17931
1035 1 5 . 1 1 25 25 ASP N N 740 121.214 121.214 120.855 0.359 17931
1036 1 5 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.394 -0.243 17931
1037 1 5 . 1 1 25 25 ASP C C 740 176.626 176.626 177.667 -1.041 17931
1038 1 5 . 1 1 25 25 ASP CA C 740 54.173 54.173 57.408 -3.235 17931
1039 1 5 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.155 0.816 17931
1040 1 5 . 1 1 25 25 ASP H H 740 8.248 8.248 7.968 0.280 17931
1041 1 5 . 1 1 26 26 THR N N 741 113.708 113.708 112.821 0.887 17931
1042 1 5 . 1 1 26 26 THR HA H 741 4.221 4.221 4.133 0.088 17931
1043 1 5 . 1 1 26 26 THR C C 741 174.851 174.851 174.545 0.306 17931
1044 1 5 . 1 1 26 26 THR CA C 741 62.439 62.439 63.795 -1.356 17931
1045 1 5 . 1 1 26 26 THR CB C 741 69.255 69.255 68.926 0.329 17931
1046 1 5 . 1 1 26 26 THR H H 741 7.945 7.945 8.189 -0.244 17931
1047 1 5 . 1 1 27 27 ALA N N 742 124.543 124.543 122.616 1.927 17931
1048 1 5 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.341 -0.145 17931
1049 1 5 . 1 1 27 27 ALA C C 742 177.509 177.509 178.864 -1.355 17931
1050 1 5 . 1 1 27 27 ALA CA C 742 52.953 52.953 54.100 -1.147 17931
1051 1 5 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.500 -0.551 17931
1052 1 5 . 1 1 27 27 ALA H H 742 8.113 8.113 7.534 0.579 17931
1053 1 5 . 1 1 28 28 ASN N N 743 116.039 116.039 116.760 -0.721 17931
1054 1 5 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.685 -0.086 17931
1055 1 5 . 1 1 28 28 ASN C C 743 174.330 174.330 175.715 -1.385 17931
1056 1 5 . 1 1 28 28 ASN CA C 743 52.868 52.868 54.814 -1.946 17931
1057 1 5 . 1 1 28 28 ASN CB C 743 38.995 38.995 39.372 -0.377 17931
1058 1 5 . 1 1 28 28 ASN H H 743 8.055 8.055 8.643 -0.588 17931
1059 1 5 . 1 1 29 29 ASN N N 744 119.625 119.625 118.964 0.661 17931
1060 1 5 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.098 -0.490 17931
1061 1 5 . 1 1 29 29 ASN CA C 744 50.940 50.940 50.976 -0.036 17931
1062 1 5 . 1 1 29 29 ASN CB C 744 38.798 38.798 39.639 -0.841 17931
1063 1 5 . 1 1 29 29 ASN H H 744 8.015 8.015 7.698 0.317 17931
1064 1 5 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.308 0.064 17931
1065 1 5 . 1 1 30 30 PRO C C 745 177.196 177.196 176.628 0.568 17931
1066 1 5 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.585 -1.002 17931
1067 1 5 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.277 -0.389 17931
1068 1 5 . 1 1 34 34 GLU N N 749 121.140 121.140 121.109 0.031 17931
1069 1 5 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.202 0.004 17931
1070 1 5 . 1 1 34 34 GLU C C 749 176.764 176.764 177.583 -0.819 17931
1071 1 5 . 1 1 34 34 GLU CA C 749 56.698 56.698 58.620 -1.923 17931
1072 1 5 . 1 1 34 34 GLU CB C 749 29.784 29.784 29.510 0.274 17931
1073 1 5 . 1 1 34 34 GLU H H 749 8.215 8.215 8.870 -0.655 17931
1074 1 5 . 1 1 35 35 ALA N N 750 124.506 124.506 122.958 1.548 17931
1075 1 5 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.414 -0.138 17931
1076 1 5 . 1 1 35 35 ALA C C 750 178.054 178.054 179.571 -1.517 17931
1077 1 5 . 1 1 35 35 ALA CA C 750 53.011 53.011 55.026 -2.015 17931
1078 1 5 . 1 1 35 35 ALA CB C 750 19.021 19.021 18.259 0.762 17931
1079 1 5 . 1 1 35 35 ALA H H 750 8.335 8.335 8.341 -0.006 17931
1080 1 5 . 1 1 36 36 THR N N 751 111.925 111.925 113.015 -1.090 17931
1081 1 5 . 1 1 36 36 THR HA H 751 4.225 4.225 4.605 -0.380 17931
1082 1 5 . 1 1 36 36 THR C C 751 175.137 175.137 176.166 -1.029 17931
1083 1 5 . 1 1 36 36 THR CA C 751 62.508 62.508 64.651 -2.143 17931
1084 1 5 . 1 1 36 36 THR CB C 751 69.600 69.600 68.261 1.339 17931
1085 1 5 . 1 1 36 36 THR H H 751 8.007 8.007 7.754 0.253 17931
1086 1 5 . 1 1 37 37 SER N N 752 117.676 117.676 116.794 0.882 17931
1087 1 5 . 1 1 37 37 SER HA H 752 4.567 4.567 4.373 0.194 17931
1088 1 5 . 1 1 37 37 SER C C 752 174.881 174.881 176.018 -1.137 17931
1089 1 5 . 1 1 37 37 SER CA C 752 58.856 58.856 61.639 -2.783 17931
1090 1 5 . 1 1 37 37 SER CB C 752 63.705 63.705 63.490 0.215 17931
1091 1 5 . 1 1 37 37 SER H H 752 8.156 8.156 7.827 0.329 17931
1092 1 5 . 1 1 38 38 THR N N 753 116.343 116.343 115.908 0.435 17931
1093 1 5 . 1 1 38 38 THR HA H 753 4.126 4.126 4.033 0.093 17931
1094 1 5 . 1 1 38 38 THR C C 753 174.555 174.555 175.219 -0.664 17931
1095 1 5 . 1 1 38 38 THR CA C 753 62.889 62.889 64.345 -1.456 17931
1096 1 5 . 1 1 38 38 THR CB C 753 69.292 69.292 69.169 0.123 17931
1097 1 5 . 1 1 38 38 THR H H 753 8.042 8.042 7.561 0.481 17931
1098 1 5 . 1 1 39 39 PHE N N 754 120.983 120.983 123.352 -2.369 17931
1099 1 5 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.772 -0.205 17931
1100 1 5 . 1 1 39 39 PHE C C 754 175.956 175.956 174.350 1.606 17931
1101 1 5 . 1 1 39 39 PHE CA C 754 58.289 58.289 56.597 1.692 17931
1102 1 5 . 1 1 39 39 PHE CB C 754 39.222 39.222 39.070 0.152 17931
1103 1 5 . 1 1 39 39 PHE H H 754 8.163 8.163 8.376 -0.213 17931
1104 1 5 . 1 1 40 40 THR N N 755 114.474 114.474 120.671 -6.197 17931
1105 1 5 . 1 1 40 40 THR HA H 755 4.159 4.159 4.668 -0.509 17931
1106 1 5 . 1 1 40 40 THR C C 755 174.168 174.168 174.704 -0.536 17931
1107 1 5 . 1 1 40 40 THR CA C 755 62.446 62.446 62.577 -0.131 17931
1108 1 5 . 1 1 40 40 THR CB C 755 69.403 69.403 69.384 0.019 17931
1109 1 5 . 1 1 40 40 THR H H 755 7.943 7.943 8.367 -0.424 17931
1110 1 5 . 1 1 41 41 ASN N N 756 120.598 120.598 125.880 -5.282 17931
1111 1 5 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.789 -0.190 17931
1112 1 5 . 1 1 41 41 ASN C C 756 175.438 175.438 174.841 0.597 17931
1113 1 5 . 1 1 41 41 ASN CA C 756 53.625 53.625 54.044 -0.419 17931
1114 1 5 . 1 1 41 41 ASN CB C 756 38.852 38.852 39.415 -0.563 17931
1115 1 5 . 1 1 41 41 ASN H H 756 8.254 8.254 9.081 -0.827 17931
1116 1 5 . 1 1 42 42 ILE N N 757 119.988 119.988 117.010 2.978 17931
1117 1 5 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.581 -0.448 17931
1118 1 5 . 1 1 42 42 ILE C C 757 176.180 176.180 175.473 0.707 17931
1119 1 5 . 1 1 42 42 ILE CA C 757 61.607 61.607 59.325 2.282 17931
1120 1 5 . 1 1 42 42 ILE CB C 757 38.526 38.526 39.256 -0.730 17931
1121 1 5 . 1 1 42 42 ILE H H 757 7.988 7.988 7.633 0.355 17931
1122 1 5 . 1 1 46 46 GLY N N 761 109.795 109.795 113.147 -3.352 17931
1123 1 5 . 1 1 46 46 GLY C C 761 173.400 173.400 174.361 -0.961 17931
1124 1 5 . 1 1 46 46 GLY CA C 761 45.241 45.241 44.834 0.407 17931
1125 1 5 . 1 1 46 46 GLY H H 761 8.038 8.038 8.399 -0.361 17931
1126 1 6 . 1 1 2 2 LEU N N 717 120.100 120.100 122.715 -2.615 17931
1127 1 6 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.406 -0.276 17931
1128 1 6 . 1 1 2 2 LEU C C 717 177.505 177.505 177.794 -0.289 17931
1129 1 6 . 1 1 2 2 LEU CA C 717 56.674 56.674 56.903 -0.229 17931
1130 1 6 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.571 0.282 17931
1131 1 6 . 1 1 2 2 LEU H H 717 7.866 7.866 7.952 -0.086 17931
1132 1 6 . 1 1 3 3 LEU N N 718 118.481 118.481 118.117 0.364 17931
1133 1 6 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.114 -0.057 17931
1134 1 6 . 1 1 3 3 LEU C C 718 177.643 177.643 178.497 -0.854 17931
1135 1 6 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.614 -0.670 17931
1136 1 6 . 1 1 3 3 LEU CB C 718 41.735 41.735 41.153 0.582 17931
1137 1 6 . 1 1 3 3 LEU H H 718 7.746 7.746 7.933 -0.187 17931
1138 1 6 . 1 1 4 4 ILE N N 719 116.207 116.207 116.652 -0.445 17931
1139 1 6 . 1 1 4 4 ILE HA H 719 3.911 3.911 4.117 -0.206 17931
1140 1 6 . 1 1 4 4 ILE C C 719 176.774 176.774 178.717 -1.943 17931
1141 1 6 . 1 1 4 4 ILE CA C 719 62.960 62.960 62.128 0.832 17931
1142 1 6 . 1 1 4 4 ILE CB C 719 38.219 38.219 37.456 0.763 17931
1143 1 6 . 1 1 4 4 ILE H H 719 7.724 7.724 7.668 0.056 17931
1144 1 6 . 1 1 5 5 THR N N 720 114.581 114.581 117.005 -2.424 17931
1145 1 6 . 1 1 5 5 THR HA H 720 4.161 4.161 4.085 0.076 17931
1146 1 6 . 1 1 5 5 THR C C 720 175.458 175.458 176.475 -1.017 17931
1147 1 6 . 1 1 5 5 THR CA C 720 64.390 64.390 65.994 -1.604 17931
1148 1 6 . 1 1 5 5 THR CB C 720 69.052 69.052 68.434 0.618 17931
1149 1 6 . 1 1 5 5 THR H H 720 7.802 7.802 8.067 -0.265 17931
1150 1 6 . 1 1 6 6 ILE N N 721 119.805 119.805 121.187 -1.382 17931
1151 1 6 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.571 0.338 17931
1152 1 6 . 1 1 6 6 ILE C C 721 176.102 176.102 177.738 -1.636 17931
1153 1 6 . 1 1 6 6 ILE CA C 721 63.025 63.025 65.094 -2.069 17931
1154 1 6 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.554 0.549 17931
1155 1 6 . 1 1 6 6 ILE H H 721 7.751 7.751 7.561 0.190 17931
1156 1 6 . 1 1 7 7 HIS N N 722 118.760 118.760 116.943 1.817 17931
1157 1 6 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.349 0.266 17931
1158 1 6 . 1 1 7 7 HIS C C 722 174.538 174.538 177.043 -2.505 17931
1159 1 6 . 1 1 7 7 HIS CA C 722 57.344 57.344 59.394 -2.050 17931
1160 1 6 . 1 1 7 7 HIS CB C 722 29.375 29.375 29.838 -0.463 17931
1161 1 6 . 1 1 7 7 HIS H H 722 8.097 8.097 8.005 0.092 17931
1162 1 6 . 1 1 8 8 ASP N N 723 117.884 117.884 117.777 0.107 17931
1163 1 6 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.894 -0.300 17931
1164 1 6 . 1 1 8 8 ASP C C 723 176.829 176.829 176.955 -0.126 17931
1165 1 6 . 1 1 8 8 ASP CA C 723 54.176 54.176 54.967 -0.791 17931
1166 1 6 . 1 1 8 8 ASP CB C 723 41.500 41.500 41.576 -0.076 17931
1167 1 6 . 1 1 8 8 ASP H H 723 7.969 7.969 7.849 0.120 17931
1168 1 6 . 1 1 9 9 ARG N N 724 121.014 121.014 121.134 -0.120 17931
1169 1 6 . 1 1 9 9 ARG HA H 724 4.204 4.204 3.953 0.251 17931
1170 1 6 . 1 1 9 9 ARG C C 724 177.662 177.662 177.826 -0.164 17931
1171 1 6 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.652 -2.833 17931
1172 1 6 . 1 1 9 9 ARG CB C 724 32.703 32.703 30.176 2.527 17931
1173 1 6 . 1 1 9 9 ARG H H 724 8.216 8.216 8.065 0.151 17931
1174 1 6 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.043 0.092 17931
1175 1 6 . 1 1 10 10 LYS C C 725 178.127 178.127 177.790 0.337 17931
1176 1 6 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.660 -0.913 17931
1177 1 6 . 1 1 10 10 LYS CB C 725 32.190 32.190 31.940 0.250 17931
1178 1 6 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.368 -0.272 17931
1179 1 6 . 1 1 11 11 GLU C C 726 177.791 177.791 178.445 -0.654 17931
1180 1 6 . 1 1 11 11 GLU CA C 726 58.406 58.406 57.842 0.564 17931
1181 1 6 . 1 1 11 11 GLU CB C 726 29.340 29.340 30.461 -1.121 17931
1182 1 6 . 1 1 12 12 PHE N N 727 118.859 118.859 120.664 -1.805 17931
1183 1 6 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.770 -0.392 17931
1184 1 6 . 1 1 12 12 PHE C C 727 176.439 176.439 177.769 -1.330 17931
1185 1 6 . 1 1 12 12 PHE CA C 727 59.332 59.332 60.202 -0.870 17931
1186 1 6 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.563 -0.403 17931
1187 1 6 . 1 1 12 12 PHE H H 727 7.922 7.922 8.509 -0.587 17931
1188 1 6 . 1 1 13 13 ALA N N 728 122.111 122.111 122.232 -0.121 17931
1189 1 6 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.563 0.595 17931
1190 1 6 . 1 1 13 13 ALA C C 728 178.542 178.542 179.003 -0.461 17931
1191 1 6 . 1 1 13 13 ALA CA C 728 54.083 54.083 54.911 -0.828 17931
1192 1 6 . 1 1 13 13 ALA CB C 728 18.409 18.409 17.754 0.655 17931
1193 1 6 . 1 1 13 13 ALA H H 728 7.970 7.970 7.872 0.098 17931
1194 1 6 . 1 1 14 14 LYS N N 729 117.588 117.588 119.414 -1.826 17931
1195 1 6 . 1 1 14 14 LYS HA H 729 4.096 4.096 3.947 0.149 17931
1196 1 6 . 1 1 14 14 LYS C C 729 177.664 177.664 178.520 -0.856 17931
1197 1 6 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.279 -1.349 17931
1198 1 6 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.567 -1.052 17931
1199 1 6 . 1 1 14 14 LYS H H 729 7.792 7.792 7.973 -0.181 17931
1200 1 6 . 1 1 15 15 PHE N N 730 119.916 119.916 117.684 2.232 17931
1201 1 6 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.458 -0.079 17931
1202 1 6 . 1 1 15 15 PHE C C 730 176.732 176.732 178.156 -1.424 17931
1203 1 6 . 1 1 15 15 PHE CA C 730 59.753 59.753 61.613 -1.860 17931
1204 1 6 . 1 1 15 15 PHE CB C 730 39.010 39.010 38.925 0.085 17931
1205 1 6 . 1 1 15 15 PHE H H 730 7.874 7.874 7.895 -0.021 17931
1206 1 6 . 1 1 16 16 GLU N N 731 119.398 119.398 117.812 1.586 17931
1207 1 6 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.940 0.125 17931
1208 1 6 . 1 1 16 16 GLU C C 731 177.920 177.920 178.873 -0.953 17931
1209 1 6 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.260 -1.435 17931
1210 1 6 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.881 0.468 17931
1211 1 6 . 1 1 16 16 GLU H H 731 8.178 8.178 7.697 0.481 17931
1212 1 6 . 1 1 17 17 GLU N N 732 120.386 120.386 120.127 0.259 17931
1213 1 6 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.925 0.125 17931
1214 1 6 . 1 1 17 17 GLU C C 732 178.097 178.097 179.087 -0.990 17931
1215 1 6 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.297 -0.990 17931
1216 1 6 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.331 0.057 17931
1217 1 6 . 1 1 17 17 GLU H H 732 8.117 8.117 8.439 -0.322 17931
1218 1 6 . 1 1 18 18 GLU N N 733 119.473 119.473 119.741 -0.268 17931
1219 1 6 . 1 1 18 18 GLU HA H 733 4.056 4.056 3.956 0.100 17931
1220 1 6 . 1 1 18 18 GLU C C 733 177.228 177.228 178.868 -1.640 17931
1221 1 6 . 1 1 18 18 GLU CA C 733 58.298 58.298 59.276 -0.978 17931
1222 1 6 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.419 0.028 17931
1223 1 6 . 1 1 18 18 GLU H H 733 8.130 8.130 7.994 0.136 17931
1224 1 6 . 1 1 19 19 ARG N N 734 118.929 118.929 118.726 0.203 17931
1225 1 6 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.212 -0.183 17931
1226 1 6 . 1 1 19 19 ARG C C 734 177.402 177.402 178.360 -0.958 17931
1227 1 6 . 1 1 19 19 ARG CA C 734 58.400 58.400 57.985 0.415 17931
1228 1 6 . 1 1 19 19 ARG CB C 734 32.170 32.170 29.958 2.212 17931
1229 1 6 . 1 1 19 19 ARG H H 734 8.032 8.032 7.488 0.544 17931
1230 1 6 . 1 1 20 20 ALA N N 735 121.514 121.514 121.992 -0.478 17931
1231 1 6 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.179 -0.050 17931
1232 1 6 . 1 1 20 20 ALA C C 735 179.108 179.108 179.658 -0.550 17931
1233 1 6 . 1 1 20 20 ALA CA C 735 53.559 53.559 55.049 -1.490 17931
1234 1 6 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.507 0.054 17931
1235 1 6 . 1 1 20 20 ALA H H 735 7.853 7.853 8.521 -0.668 17931
1236 1 6 . 1 1 21 21 ARG N N 736 117.944 117.944 118.460 -0.516 17931
1237 1 6 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.168 -0.058 17931
1238 1 6 . 1 1 21 21 ARG C C 736 176.643 176.643 178.153 -1.510 17931
1239 1 6 . 1 1 21 21 ARG CA C 736 56.737 56.737 58.157 -1.420 17931
1240 1 6 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.357 0.216 17931
1241 1 6 . 1 1 21 21 ARG H H 736 7.850 7.850 8.560 -0.710 17931
1242 1 6 . 1 1 22 22 ALA N N 737 122.381 122.381 121.742 0.639 17931
1243 1 6 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.179 -0.028 17931
1244 1 6 . 1 1 22 22 ALA C C 737 177.640 177.640 178.712 -1.072 17931
1245 1 6 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.577 -1.807 17931
1246 1 6 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.658 0.089 17931
1247 1 6 . 1 1 22 22 ALA H H 737 7.776 7.776 7.841 -0.065 17931
1248 1 6 . 1 1 23 23 LYS N N 738 118.327 118.327 114.260 4.067 17931
1249 1 6 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.342 -0.183 17931
1250 1 6 . 1 1 23 23 LYS C C 738 176.483 176.483 176.758 -0.275 17931
1251 1 6 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.353 0.115 17931
1252 1 6 . 1 1 23 23 LYS CB C 738 32.526 32.526 34.501 -1.975 17931
1253 1 6 . 1 1 23 23 LYS H H 738 7.838 7.838 7.757 0.081 17931
1254 1 6 . 1 1 24 24 TRP N N 739 120.598 120.598 120.930 -0.332 17931
1255 1 6 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.979 -0.378 17931
1256 1 6 . 1 1 24 24 TRP C C 739 175.904 175.904 175.254 0.650 17931
1257 1 6 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.434 0.513 17931
1258 1 6 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.281 0.240 17931
1259 1 6 . 1 1 24 24 TRP H H 739 7.958 7.958 8.439 -0.481 17931
1260 1 6 . 1 1 25 25 ASP N N 740 121.214 121.214 122.131 -0.917 17931
1261 1 6 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.303 -0.152 17931
1262 1 6 . 1 1 25 25 ASP C C 740 176.626 176.626 177.812 -1.186 17931
1263 1 6 . 1 1 25 25 ASP CA C 740 54.173 54.173 58.161 -3.989 17931
1264 1 6 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.977 -0.006 17931
1265 1 6 . 1 1 25 25 ASP H H 740 8.248 8.248 8.122 0.126 17931
1266 1 6 . 1 1 26 26 THR N N 741 113.708 113.708 111.249 2.459 17931
1267 1 6 . 1 1 26 26 THR HA H 741 4.221 4.221 4.168 0.053 17931
1268 1 6 . 1 1 26 26 THR C C 741 174.851 174.851 174.914 -0.063 17931
1269 1 6 . 1 1 26 26 THR CA C 741 62.439 62.439 64.097 -1.658 17931
1270 1 6 . 1 1 26 26 THR CB C 741 69.255 69.255 68.870 0.385 17931
1271 1 6 . 1 1 26 26 THR H H 741 7.945 7.945 8.462 -0.517 17931
1272 1 6 . 1 1 27 27 ALA N N 742 124.543 124.543 122.171 2.372 17931
1273 1 6 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.361 -0.165 17931
1274 1 6 . 1 1 27 27 ALA C C 742 177.509 177.509 178.767 -1.258 17931
1275 1 6 . 1 1 27 27 ALA CA C 742 52.953 52.953 53.904 -0.951 17931
1276 1 6 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.713 -0.764 17931
1277 1 6 . 1 1 27 27 ALA H H 742 8.113 8.113 7.306 0.807 17931
1278 1 6 . 1 1 28 28 ASN N N 743 116.039 116.039 116.010 0.029 17931
1279 1 6 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.591 0.008 17931
1280 1 6 . 1 1 28 28 ASN C C 743 174.330 174.330 175.862 -1.532 17931
1281 1 6 . 1 1 28 28 ASN CA C 743 52.868 52.868 55.267 -2.398 17931
1282 1 6 . 1 1 28 28 ASN CB C 743 38.995 38.995 39.176 -0.181 17931
1283 1 6 . 1 1 28 28 ASN H H 743 8.055 8.055 8.580 -0.525 17931
1284 1 6 . 1 1 29 29 ASN N N 744 119.625 119.625 119.166 0.459 17931
1285 1 6 . 1 1 29 29 ASN HA H 744 4.608 4.608 4.926 -0.318 17931
1286 1 6 . 1 1 29 29 ASN CA C 744 50.940 50.940 51.898 -0.958 17931
1287 1 6 . 1 1 29 29 ASN CB C 744 38.798 38.798 39.278 -0.480 17931
1288 1 6 . 1 1 29 29 ASN H H 744 8.015 8.015 7.454 0.561 17931
1289 1 6 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.312 0.060 17931
1290 1 6 . 1 1 30 30 PRO C C 745 177.196 177.196 176.754 0.442 17931
1291 1 6 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.555 -0.971 17931
1292 1 6 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.257 -0.369 17931
1293 1 6 . 1 1 34 34 GLU N N 749 121.140 121.140 119.346 1.794 17931
1294 1 6 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.141 0.065 17931
1295 1 6 . 1 1 34 34 GLU C C 749 176.764 176.764 176.074 0.690 17931
1296 1 6 . 1 1 34 34 GLU CA C 749 56.698 56.698 58.055 -1.357 17931
1297 1 6 . 1 1 34 34 GLU CB C 749 29.784 29.784 29.852 -0.068 17931
1298 1 6 . 1 1 34 34 GLU H H 749 8.215 8.215 8.643 -0.428 17931
1299 1 6 . 1 1 35 35 ALA N N 750 124.506 124.506 123.567 0.939 17931
1300 1 6 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.830 -0.554 17931
1301 1 6 . 1 1 35 35 ALA C C 750 178.054 178.054 177.994 0.060 17931
1302 1 6 . 1 1 35 35 ALA CA C 750 53.011 53.011 51.278 1.733 17931
1303 1 6 . 1 1 35 35 ALA CB C 750 19.021 19.021 19.523 -0.502 17931
1304 1 6 . 1 1 35 35 ALA H H 750 8.335 8.335 8.080 0.255 17931
1305 1 6 . 1 1 36 36 THR N N 751 111.925 111.925 116.843 -4.918 17931
1306 1 6 . 1 1 36 36 THR HA H 751 4.225 4.225 4.219 0.006 17931
1307 1 6 . 1 1 36 36 THR C C 751 175.137 175.137 175.713 -0.576 17931
1308 1 6 . 1 1 36 36 THR CA C 751 62.508 62.508 65.609 -3.101 17931
1309 1 6 . 1 1 36 36 THR CB C 751 69.600 69.600 68.413 1.187 17931
1310 1 6 . 1 1 36 36 THR H H 751 8.007 8.007 8.782 -0.775 17931
1311 1 6 . 1 1 37 37 SER N N 752 117.676 117.676 114.936 2.740 17931
1312 1 6 . 1 1 37 37 SER HA H 752 4.567 4.567 4.262 0.305 17931
1313 1 6 . 1 1 37 37 SER C C 752 174.881 174.881 175.688 -0.807 17931
1314 1 6 . 1 1 37 37 SER CA C 752 58.856 58.856 60.571 -1.715 17931
1315 1 6 . 1 1 37 37 SER CB C 752 63.705 63.705 63.078 0.627 17931
1316 1 6 . 1 1 37 37 SER H H 752 8.156 8.156 7.986 0.170 17931
1317 1 6 . 1 1 38 38 THR N N 753 116.343 116.343 115.558 0.785 17931
1318 1 6 . 1 1 38 38 THR HA H 753 4.126 4.126 4.204 -0.078 17931
1319 1 6 . 1 1 38 38 THR C C 753 174.555 174.555 175.164 -0.609 17931
1320 1 6 . 1 1 38 38 THR CA C 753 62.889 62.889 63.783 -0.894 17931
1321 1 6 . 1 1 38 38 THR CB C 753 69.292 69.292 69.579 -0.287 17931
1322 1 6 . 1 1 38 38 THR H H 753 8.042 8.042 7.485 0.557 17931
1323 1 6 . 1 1 39 39 PHE N N 754 120.983 120.983 122.966 -1.983 17931
1324 1 6 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.869 -0.302 17931
1325 1 6 . 1 1 39 39 PHE C C 754 175.956 175.956 175.114 0.842 17931
1326 1 6 . 1 1 39 39 PHE CA C 754 58.289 58.289 56.374 1.915 17931
1327 1 6 . 1 1 39 39 PHE CB C 754 39.222 39.222 37.308 1.914 17931
1328 1 6 . 1 1 39 39 PHE H H 754 8.163 8.163 8.671 -0.508 17931
1329 1 6 . 1 1 40 40 THR N N 755 114.474 114.474 116.562 -2.088 17931
1330 1 6 . 1 1 40 40 THR HA H 755 4.159 4.159 4.394 -0.235 17931
1331 1 6 . 1 1 40 40 THR C C 755 174.168 174.168 174.462 -0.294 17931
1332 1 6 . 1 1 40 40 THR CA C 755 62.446 62.446 61.666 0.779 17931
1333 1 6 . 1 1 40 40 THR CB C 755 69.403 69.403 69.006 0.397 17931
1334 1 6 . 1 1 40 40 THR H H 755 7.943 7.943 7.724 0.219 17931
1335 1 6 . 1 1 41 41 ASN N N 756 120.598 120.598 119.784 0.814 17931
1336 1 6 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.533 0.066 17931
1337 1 6 . 1 1 41 41 ASN C C 756 175.438 175.438 173.976 1.462 17931
1338 1 6 . 1 1 41 41 ASN CA C 756 53.625 53.625 54.266 -0.641 17931
1339 1 6 . 1 1 41 41 ASN CB C 756 38.852 38.852 37.907 0.945 17931
1340 1 6 . 1 1 41 41 ASN H H 756 8.254 8.254 8.548 -0.294 17931
1341 1 6 . 1 1 42 42 ILE N N 757 119.988 119.988 122.548 -2.560 17931
1342 1 6 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.464 -0.331 17931
1343 1 6 . 1 1 42 42 ILE C C 757 176.180 176.180 176.320 -0.140 17931
1344 1 6 . 1 1 42 42 ILE CA C 757 61.607 61.607 61.264 0.343 17931
1345 1 6 . 1 1 42 42 ILE CB C 757 38.526 38.526 37.490 1.036 17931
1346 1 6 . 1 1 42 42 ILE H H 757 7.988 7.988 8.333 -0.345 17931
1347 1 6 . 1 1 46 46 GLY N N 761 109.795 109.795 110.633 -0.838 17931
1348 1 6 . 1 1 46 46 GLY C C 761 173.400 173.400 173.747 -0.347 17931
1349 1 6 . 1 1 46 46 GLY CA C 761 45.241 45.241 44.470 0.771 17931
1350 1 6 . 1 1 46 46 GLY H H 761 8.038 8.038 8.642 -0.604 17931
1351 1 7 . 1 1 2 2 LEU N N 717 120.100 120.100 122.483 -2.383 17931
1352 1 7 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.379 -0.249 17931
1353 1 7 . 1 1 2 2 LEU C C 717 177.505 177.505 178.018 -0.513 17931
1354 1 7 . 1 1 2 2 LEU CA C 717 56.674 56.674 57.151 -0.477 17931
1355 1 7 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.442 0.411 17931
1356 1 7 . 1 1 2 2 LEU H H 717 7.866 7.866 7.996 -0.130 17931
1357 1 7 . 1 1 3 3 LEU N N 718 118.481 118.481 119.510 -1.029 17931
1358 1 7 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.162 -0.105 17931
1359 1 7 . 1 1 3 3 LEU C C 718 177.643 177.643 178.355 -0.712 17931
1360 1 7 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.631 -0.688 17931
1361 1 7 . 1 1 3 3 LEU CB C 718 41.735 41.735 41.261 0.474 17931
1362 1 7 . 1 1 3 3 LEU H H 718 7.746 7.746 7.885 -0.139 17931
1363 1 7 . 1 1 4 4 ILE N N 719 116.207 116.207 116.588 -0.381 17931
1364 1 7 . 1 1 4 4 ILE HA H 719 3.911 3.911 4.021 -0.110 17931
1365 1 7 . 1 1 4 4 ILE C C 719 176.774 176.774 178.684 -1.910 17931
1366 1 7 . 1 1 4 4 ILE CA C 719 62.960 62.960 63.218 -0.258 17931
1367 1 7 . 1 1 4 4 ILE CB C 719 38.219 38.219 37.033 1.186 17931
1368 1 7 . 1 1 4 4 ILE H H 719 7.724 7.724 7.563 0.161 17931
1369 1 7 . 1 1 5 5 THR N N 720 114.581 114.581 117.048 -2.467 17931
1370 1 7 . 1 1 5 5 THR HA H 720 4.161 4.161 4.104 0.057 17931
1371 1 7 . 1 1 5 5 THR C C 720 175.458 175.458 176.655 -1.197 17931
1372 1 7 . 1 1 5 5 THR CA C 720 64.390 64.390 65.873 -1.483 17931
1373 1 7 . 1 1 5 5 THR CB C 720 69.052 69.052 68.342 0.710 17931
1374 1 7 . 1 1 5 5 THR H H 720 7.802 7.802 8.317 -0.515 17931
1375 1 7 . 1 1 6 6 ILE N N 721 119.805 119.805 121.737 -1.932 17931
1376 1 7 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.584 0.325 17931
1377 1 7 . 1 1 6 6 ILE C C 721 176.102 176.102 177.236 -1.134 17931
1378 1 7 . 1 1 6 6 ILE CA C 721 63.025 63.025 65.962 -2.937 17931
1379 1 7 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.648 0.456 17931
1380 1 7 . 1 1 6 6 ILE H H 721 7.751 7.751 7.658 0.093 17931
1381 1 7 . 1 1 7 7 HIS N N 722 118.760 118.760 118.909 -0.149 17931
1382 1 7 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.278 0.337 17931
1383 1 7 . 1 1 7 7 HIS C C 722 174.538 174.538 177.727 -3.189 17931
1384 1 7 . 1 1 7 7 HIS CA C 722 57.344 57.344 59.777 -2.433 17931
1385 1 7 . 1 1 7 7 HIS CB C 722 29.375 29.375 30.145 -0.770 17931
1386 1 7 . 1 1 7 7 HIS H H 722 8.097 8.097 8.039 0.058 17931
1387 1 7 . 1 1 8 8 ASP N N 723 117.884 117.884 119.097 -1.213 17931
1388 1 7 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.600 -0.006 17931
1389 1 7 . 1 1 8 8 ASP C C 723 176.829 176.829 178.137 -1.308 17931
1390 1 7 . 1 1 8 8 ASP CA C 723 54.176 54.176 57.330 -3.154 17931
1391 1 7 . 1 1 8 8 ASP CB C 723 41.500 41.500 40.889 0.612 17931
1392 1 7 . 1 1 8 8 ASP H H 723 7.969 7.969 7.667 0.302 17931
1393 1 7 . 1 1 9 9 ARG N N 724 121.014 121.014 121.431 -0.417 17931
1394 1 7 . 1 1 9 9 ARG HA H 724 4.204 4.204 4.025 0.179 17931
1395 1 7 . 1 1 9 9 ARG C C 724 177.662 177.662 178.351 -0.689 17931
1396 1 7 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.595 -2.776 17931
1397 1 7 . 1 1 9 9 ARG CB C 724 32.703 32.703 30.317 2.386 17931
1398 1 7 . 1 1 9 9 ARG H H 724 8.216 8.216 8.360 -0.144 17931
1399 1 7 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.077 0.058 17931
1400 1 7 . 1 1 10 10 LYS C C 725 178.127 178.127 178.040 0.087 17931
1401 1 7 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.989 -1.242 17931
1402 1 7 . 1 1 10 10 LYS CB C 725 32.190 32.190 32.154 0.036 17931
1403 1 7 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.319 -0.223 17931
1404 1 7 . 1 1 11 11 GLU C C 726 177.791 177.791 178.146 -0.355 17931
1405 1 7 . 1 1 11 11 GLU CA C 726 58.406 58.406 58.207 0.199 17931
1406 1 7 . 1 1 11 11 GLU CB C 726 29.340 29.340 30.091 -0.751 17931
1407 1 7 . 1 1 12 12 PHE N N 727 118.859 118.859 119.969 -1.110 17931
1408 1 7 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.639 -0.261 17931
1409 1 7 . 1 1 12 12 PHE C C 727 176.439 176.439 177.668 -1.229 17931
1410 1 7 . 1 1 12 12 PHE CA C 727 59.332 59.332 60.494 -1.162 17931
1411 1 7 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.871 -0.711 17931
1412 1 7 . 1 1 12 12 PHE H H 727 7.922 7.922 8.106 -0.184 17931
1413 1 7 . 1 1 13 13 ALA N N 728 122.111 122.111 122.606 -0.495 17931
1414 1 7 . 1 1 13 13 ALA HA H 728 4.158 4.158 4.084 0.074 17931
1415 1 7 . 1 1 13 13 ALA C C 728 178.542 178.542 178.946 -0.404 17931
1416 1 7 . 1 1 13 13 ALA CA C 728 54.083 54.083 54.815 -0.732 17931
1417 1 7 . 1 1 13 13 ALA CB C 728 18.409 18.409 17.971 0.438 17931
1418 1 7 . 1 1 13 13 ALA H H 728 7.970 7.970 8.417 -0.447 17931
1419 1 7 . 1 1 14 14 LYS N N 729 117.588 117.588 119.637 -2.049 17931
1420 1 7 . 1 1 14 14 LYS HA H 729 4.096 4.096 4.220 -0.124 17931
1421 1 7 . 1 1 14 14 LYS C C 729 177.664 177.664 178.520 -0.856 17931
1422 1 7 . 1 1 14 14 LYS CA C 729 56.930 56.930 57.971 -1.041 17931
1423 1 7 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.554 -1.039 17931
1424 1 7 . 1 1 14 14 LYS H H 729 7.792 7.792 7.792 0.000 17931
1425 1 7 . 1 1 15 15 PHE N N 730 119.916 119.916 117.401 2.515 17931
1426 1 7 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.127 0.252 17931
1427 1 7 . 1 1 15 15 PHE C C 730 176.732 176.732 177.952 -1.220 17931
1428 1 7 . 1 1 15 15 PHE CA C 730 59.753 59.753 61.603 -1.851 17931
1429 1 7 . 1 1 15 15 PHE CB C 730 39.010 39.010 38.773 0.237 17931
1430 1 7 . 1 1 15 15 PHE H H 730 7.874 7.874 8.043 -0.169 17931
1431 1 7 . 1 1 16 16 GLU N N 731 119.398 119.398 117.653 1.745 17931
1432 1 7 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.949 0.116 17931
1433 1 7 . 1 1 16 16 GLU C C 731 177.920 177.920 178.771 -0.851 17931
1434 1 7 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.075 -1.250 17931
1435 1 7 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.963 0.386 17931
1436 1 7 . 1 1 16 16 GLU H H 731 8.178 8.178 7.599 0.579 17931
1437 1 7 . 1 1 17 17 GLU N N 732 120.386 120.386 120.375 0.011 17931
1438 1 7 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.921 0.129 17931
1439 1 7 . 1 1 17 17 GLU C C 732 178.097 178.097 179.079 -0.982 17931
1440 1 7 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.421 -1.114 17931
1441 1 7 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.356 0.032 17931
1442 1 7 . 1 1 17 17 GLU H H 732 8.117 8.117 8.400 -0.283 17931
1443 1 7 . 1 1 18 18 GLU N N 733 119.473 119.473 119.114 0.359 17931
1444 1 7 . 1 1 18 18 GLU HA H 733 4.056 4.056 3.987 0.069 17931
1445 1 7 . 1 1 18 18 GLU C C 733 177.228 177.228 178.520 -1.292 17931
1446 1 7 . 1 1 18 18 GLU CA C 733 58.298 58.298 59.303 -1.005 17931
1447 1 7 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.350 0.097 17931
1448 1 7 . 1 1 18 18 GLU H H 733 8.130 8.130 7.757 0.373 17931
1449 1 7 . 1 1 19 19 ARG N N 734 118.929 118.929 118.984 -0.055 17931
1450 1 7 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.232 -0.203 17931
1451 1 7 . 1 1 19 19 ARG C C 734 177.402 177.402 178.008 -0.606 17931
1452 1 7 . 1 1 19 19 ARG CA C 734 58.400 58.400 57.973 0.427 17931
1453 1 7 . 1 1 19 19 ARG CB C 734 32.170 32.170 29.776 2.394 17931
1454 1 7 . 1 1 19 19 ARG H H 734 8.032 8.032 7.637 0.395 17931
1455 1 7 . 1 1 20 20 ALA N N 735 121.514 121.514 122.001 -0.487 17931
1456 1 7 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.171 -0.042 17931
1457 1 7 . 1 1 20 20 ALA C C 735 179.108 179.108 179.701 -0.593 17931
1458 1 7 . 1 1 20 20 ALA CA C 735 53.559 53.559 55.096 -1.537 17931
1459 1 7 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.477 0.084 17931
1460 1 7 . 1 1 20 20 ALA H H 735 7.853 7.853 8.472 -0.619 17931
1461 1 7 . 1 1 21 21 ARG N N 736 117.944 117.944 118.588 -0.644 17931
1462 1 7 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.266 -0.156 17931
1463 1 7 . 1 1 21 21 ARG C C 736 176.643 176.643 178.216 -1.573 17931
1464 1 7 . 1 1 21 21 ARG CA C 736 56.737 56.737 58.032 -1.295 17931
1465 1 7 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.394 0.179 17931
1466 1 7 . 1 1 21 21 ARG H H 736 7.850 7.850 8.612 -0.762 17931
1467 1 7 . 1 1 22 22 ALA N N 737 122.381 122.381 121.477 0.904 17931
1468 1 7 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.176 -0.025 17931
1469 1 7 . 1 1 22 22 ALA C C 737 177.640 177.640 178.625 -0.985 17931
1470 1 7 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.484 -1.714 17931
1471 1 7 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.726 0.021 17931
1472 1 7 . 1 1 22 22 ALA H H 737 7.776 7.776 7.520 0.256 17931
1473 1 7 . 1 1 23 23 LYS N N 738 118.327 118.327 113.786 4.541 17931
1474 1 7 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.358 -0.199 17931
1475 1 7 . 1 1 23 23 LYS C C 738 176.483 176.483 176.706 -0.223 17931
1476 1 7 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.335 0.133 17931
1477 1 7 . 1 1 23 23 LYS CB C 738 32.526 32.526 34.788 -2.262 17931
1478 1 7 . 1 1 23 23 LYS H H 738 7.838 7.838 7.690 0.148 17931
1479 1 7 . 1 1 24 24 TRP N N 739 120.598 120.598 121.295 -0.697 17931
1480 1 7 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.964 -0.363 17931
1481 1 7 . 1 1 24 24 TRP C C 739 175.904 175.904 175.396 0.508 17931
1482 1 7 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.146 0.801 17931
1483 1 7 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.333 0.188 17931
1484 1 7 . 1 1 24 24 TRP H H 739 7.958 7.958 8.587 -0.629 17931
1485 1 7 . 1 1 25 25 ASP N N 740 121.214 121.214 121.136 0.078 17931
1486 1 7 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.302 -0.151 17931
1487 1 7 . 1 1 25 25 ASP C C 740 176.626 176.626 177.615 -0.989 17931
1488 1 7 . 1 1 25 25 ASP CA C 740 54.173 54.173 57.615 -3.442 17931
1489 1 7 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.098 0.873 17931
1490 1 7 . 1 1 25 25 ASP H H 740 8.248 8.248 8.226 0.022 17931
1491 1 7 . 1 1 26 26 THR N N 741 113.708 113.708 113.799 -0.091 17931
1492 1 7 . 1 1 26 26 THR HA H 741 4.221 4.221 4.098 0.123 17931
1493 1 7 . 1 1 26 26 THR C C 741 174.851 174.851 174.695 0.156 17931
1494 1 7 . 1 1 26 26 THR CA C 741 62.439 62.439 64.661 -2.222 17931
1495 1 7 . 1 1 26 26 THR CB C 741 69.255 69.255 68.424 0.831 17931
1496 1 7 . 1 1 26 26 THR H H 741 7.945 7.945 8.350 -0.405 17931
1497 1 7 . 1 1 27 27 ALA N N 742 124.543 124.543 122.408 2.135 17931
1498 1 7 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.384 -0.188 17931
1499 1 7 . 1 1 27 27 ALA C C 742 177.509 177.509 179.202 -1.693 17931
1500 1 7 . 1 1 27 27 ALA CA C 742 52.953 52.953 53.964 -1.011 17931
1501 1 7 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.462 -0.513 17931
1502 1 7 . 1 1 27 27 ALA H H 742 8.113 8.113 7.666 0.447 17931
1503 1 7 . 1 1 28 28 ASN N N 743 116.039 116.039 116.177 -0.138 17931
1504 1 7 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.744 -0.145 17931
1505 1 7 . 1 1 28 28 ASN C C 743 174.330 174.330 175.850 -1.520 17931
1506 1 7 . 1 1 28 28 ASN CA C 743 52.868 52.868 54.130 -1.262 17931
1507 1 7 . 1 1 28 28 ASN CB C 743 38.995 38.995 39.876 -0.881 17931
1508 1 7 . 1 1 28 28 ASN H H 743 8.055 8.055 8.422 -0.367 17931
1509 1 7 . 1 1 29 29 ASN N N 744 119.625 119.625 119.097 0.528 17931
1510 1 7 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.181 -0.573 17931
1511 1 7 . 1 1 29 29 ASN CA C 744 50.940 50.940 51.007 -0.067 17931
1512 1 7 . 1 1 29 29 ASN CB C 744 38.798 38.798 39.639 -0.841 17931
1513 1 7 . 1 1 29 29 ASN H H 744 8.015 8.015 8.110 -0.095 17931
1514 1 7 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.290 0.082 17931
1515 1 7 . 1 1 30 30 PRO C C 745 177.196 177.196 176.807 0.389 17931
1516 1 7 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.603 -1.020 17931
1517 1 7 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.286 -0.398 17931
1518 1 7 . 1 1 34 34 GLU N N 749 121.140 121.140 120.669 0.471 17931
1519 1 7 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.104 0.102 17931
1520 1 7 . 1 1 34 34 GLU C C 749 176.764 176.764 177.753 -0.989 17931
1521 1 7 . 1 1 34 34 GLU CA C 749 56.698 56.698 58.565 -1.867 17931
1522 1 7 . 1 1 34 34 GLU CB C 749 29.784 29.784 29.915 -0.131 17931
1523 1 7 . 1 1 34 34 GLU H H 749 8.215 8.215 8.778 -0.563 17931
1524 1 7 . 1 1 35 35 ALA N N 750 124.506 124.506 122.444 2.062 17931
1525 1 7 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.141 0.135 17931
1526 1 7 . 1 1 35 35 ALA C C 750 178.054 178.054 179.132 -1.078 17931
1527 1 7 . 1 1 35 35 ALA CA C 750 53.011 53.011 54.726 -1.715 17931
1528 1 7 . 1 1 35 35 ALA CB C 750 19.021 19.021 17.960 1.061 17931
1529 1 7 . 1 1 35 35 ALA H H 750 8.335 8.335 8.254 0.081 17931
1530 1 7 . 1 1 36 36 THR N N 751 111.925 111.925 111.386 0.539 17931
1531 1 7 . 1 1 36 36 THR HA H 751 4.225 4.225 4.049 0.176 17931
1532 1 7 . 1 1 36 36 THR C C 751 175.137 175.137 175.230 -0.093 17931
1533 1 7 . 1 1 36 36 THR CA C 751 62.508 62.508 64.463 -1.956 17931
1534 1 7 . 1 1 36 36 THR CB C 751 69.600 69.600 68.575 1.025 17931
1535 1 7 . 1 1 36 36 THR H H 751 8.007 8.007 8.015 -0.008 17931
1536 1 7 . 1 1 37 37 SER N N 752 117.676 117.676 115.866 1.810 17931
1537 1 7 . 1 1 37 37 SER HA H 752 4.567 4.567 4.351 0.216 17931
1538 1 7 . 1 1 37 37 SER C C 752 174.881 174.881 175.757 -0.876 17931
1539 1 7 . 1 1 37 37 SER CA C 752 58.856 58.856 60.831 -1.975 17931
1540 1 7 . 1 1 37 37 SER CB C 752 63.705 63.705 63.333 0.372 17931
1541 1 7 . 1 1 37 37 SER H H 752 8.156 8.156 7.731 0.425 17931
1542 1 7 . 1 1 38 38 THR N N 753 116.343 116.343 113.193 3.150 17931
1543 1 7 . 1 1 38 38 THR HA H 753 4.126 4.126 4.365 -0.239 17931
1544 1 7 . 1 1 38 38 THR C C 753 174.555 174.555 174.318 0.237 17931
1545 1 7 . 1 1 38 38 THR CA C 753 62.889 62.889 63.380 -0.491 17931
1546 1 7 . 1 1 38 38 THR CB C 753 69.292 69.292 69.857 -0.565 17931
1547 1 7 . 1 1 38 38 THR H H 753 8.042 8.042 7.512 0.530 17931
1548 1 7 . 1 1 39 39 PHE N N 754 120.983 120.983 118.378 2.605 17931
1549 1 7 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.979 -0.412 17931
1550 1 7 . 1 1 39 39 PHE C C 754 175.956 175.956 173.660 2.296 17931
1551 1 7 . 1 1 39 39 PHE CA C 754 58.289 58.289 55.581 2.708 17931
1552 1 7 . 1 1 39 39 PHE CB C 754 39.222 39.222 41.057 -1.835 17931
1553 1 7 . 1 1 39 39 PHE H H 754 8.163 8.163 7.980 0.183 17931
1554 1 7 . 1 1 40 40 THR N N 755 114.474 114.474 115.687 -1.213 17931
1555 1 7 . 1 1 40 40 THR HA H 755 4.159 4.159 4.275 -0.116 17931
1556 1 7 . 1 1 40 40 THR C C 755 174.168 174.168 174.045 0.123 17931
1557 1 7 . 1 1 40 40 THR CA C 755 62.446 62.446 61.974 0.472 17931
1558 1 7 . 1 1 40 40 THR CB C 755 69.403 69.403 68.335 1.068 17931
1559 1 7 . 1 1 40 40 THR H H 755 7.943 7.943 8.416 -0.473 17931
1560 1 7 . 1 1 41 41 ASN N N 756 120.598 120.598 123.540 -2.942 17931
1561 1 7 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.837 -0.238 17931
1562 1 7 . 1 1 41 41 ASN C C 756 175.438 175.438 174.850 0.588 17931
1563 1 7 . 1 1 41 41 ASN CA C 756 53.625 53.625 54.019 -0.394 17931
1564 1 7 . 1 1 41 41 ASN CB C 756 38.852 38.852 40.143 -1.291 17931
1565 1 7 . 1 1 41 41 ASN H H 756 8.254 8.254 8.207 0.047 17931
1566 1 7 . 1 1 42 42 ILE N N 757 119.988 119.988 122.386 -2.398 17931
1567 1 7 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.391 -0.258 17931
1568 1 7 . 1 1 42 42 ILE C C 757 176.180 176.180 174.721 1.459 17931
1569 1 7 . 1 1 42 42 ILE CA C 757 61.607 61.607 60.353 1.254 17931
1570 1 7 . 1 1 42 42 ILE CB C 757 38.526 38.526 36.847 1.679 17931
1571 1 7 . 1 1 42 42 ILE H H 757 7.988 7.988 8.243 -0.255 17931
1572 1 7 . 1 1 46 46 GLY N N 761 109.795 109.795 110.884 -1.089 17931
1573 1 7 . 1 1 46 46 GLY C C 761 173.400 173.400 174.993 -1.593 17931
1574 1 7 . 1 1 46 46 GLY CA C 761 45.241 45.241 45.303 -0.062 17931
1575 1 7 . 1 1 46 46 GLY H H 761 8.038 8.038 8.592 -0.554 17931
1576 1 8 . 1 1 2 2 LEU N N 717 120.100 120.100 121.779 -1.679 17931
1577 1 8 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.280 -0.150 17931
1578 1 8 . 1 1 2 2 LEU C C 717 177.505 177.505 177.663 -0.158 17931
1579 1 8 . 1 1 2 2 LEU CA C 717 56.674 56.674 57.099 -0.425 17931
1580 1 8 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.525 0.328 17931
1581 1 8 . 1 1 2 2 LEU H H 717 7.866 7.866 8.102 -0.236 17931
1582 1 8 . 1 1 3 3 LEU N N 718 118.481 118.481 117.562 0.919 17931
1583 1 8 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.154 -0.097 17931
1584 1 8 . 1 1 3 3 LEU C C 718 177.643 177.643 178.535 -0.892 17931
1585 1 8 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.339 -0.396 17931
1586 1 8 . 1 1 3 3 LEU CB C 718 41.735 41.735 41.376 0.359 17931
1587 1 8 . 1 1 3 3 LEU H H 718 7.746 7.746 7.940 -0.194 17931
1588 1 8 . 1 1 4 4 ILE N N 719 116.207 116.207 118.084 -1.877 17931
1589 1 8 . 1 1 4 4 ILE HA H 719 3.911 3.911 3.970 -0.059 17931
1590 1 8 . 1 1 4 4 ILE C C 719 176.774 176.774 178.569 -1.795 17931
1591 1 8 . 1 1 4 4 ILE CA C 719 62.960 62.960 62.713 0.247 17931
1592 1 8 . 1 1 4 4 ILE CB C 719 38.219 38.219 37.344 0.875 17931
1593 1 8 . 1 1 4 4 ILE H H 719 7.724 7.724 7.205 0.519 17931
1594 1 8 . 1 1 5 5 THR N N 720 114.581 114.581 116.390 -1.809 17931
1595 1 8 . 1 1 5 5 THR HA H 720 4.161 4.161 4.112 0.049 17931
1596 1 8 . 1 1 5 5 THR C C 720 175.458 175.458 176.541 -1.083 17931
1597 1 8 . 1 1 5 5 THR CA C 720 64.390 64.390 65.448 -1.058 17931
1598 1 8 . 1 1 5 5 THR CB C 720 69.052 69.052 68.349 0.703 17931
1599 1 8 . 1 1 5 5 THR H H 720 7.802 7.802 8.463 -0.661 17931
1600 1 8 . 1 1 6 6 ILE N N 721 119.805 119.805 121.959 -2.154 17931
1601 1 8 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.572 0.337 17931
1602 1 8 . 1 1 6 6 ILE C C 721 176.102 176.102 177.222 -1.120 17931
1603 1 8 . 1 1 6 6 ILE CA C 721 63.025 63.025 65.890 -2.865 17931
1604 1 8 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.607 0.497 17931
1605 1 8 . 1 1 6 6 ILE H H 721 7.751 7.751 7.740 0.011 17931
1606 1 8 . 1 1 7 7 HIS N N 722 118.760 118.760 118.269 0.491 17931
1607 1 8 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.260 0.355 17931
1608 1 8 . 1 1 7 7 HIS C C 722 174.538 174.538 177.141 -2.603 17931
1609 1 8 . 1 1 7 7 HIS CA C 722 57.344 57.344 59.495 -2.151 17931
1610 1 8 . 1 1 7 7 HIS CB C 722 29.375 29.375 29.969 -0.594 17931
1611 1 8 . 1 1 7 7 HIS H H 722 8.097 8.097 7.829 0.268 17931
1612 1 8 . 1 1 8 8 ASP N N 723 117.884 117.884 118.444 -0.560 17931
1613 1 8 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.626 -0.032 17931
1614 1 8 . 1 1 8 8 ASP C C 723 176.829 176.829 177.846 -1.017 17931
1615 1 8 . 1 1 8 8 ASP CA C 723 54.176 54.176 56.944 -2.768 17931
1616 1 8 . 1 1 8 8 ASP CB C 723 41.500 41.500 41.325 0.174 17931
1617 1 8 . 1 1 8 8 ASP H H 723 7.969 7.969 7.700 0.269 17931
1618 1 8 . 1 1 9 9 ARG N N 724 121.014 121.014 121.592 -0.578 17931
1619 1 8 . 1 1 9 9 ARG HA H 724 4.204 4.204 4.001 0.203 17931
1620 1 8 . 1 1 9 9 ARG C C 724 177.662 177.662 178.279 -0.617 17931
1621 1 8 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.921 -3.102 17931
1622 1 8 . 1 1 9 9 ARG CB C 724 32.703 32.703 30.345 2.358 17931
1623 1 8 . 1 1 9 9 ARG H H 724 8.216 8.216 8.349 -0.133 17931
1624 1 8 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.172 -0.037 17931
1625 1 8 . 1 1 10 10 LYS C C 725 178.127 178.127 178.169 -0.042 17931
1626 1 8 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.697 -0.950 17931
1627 1 8 . 1 1 10 10 LYS CB C 725 32.190 32.190 31.918 0.272 17931
1628 1 8 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.294 -0.198 17931
1629 1 8 . 1 1 11 11 GLU C C 726 177.791 177.791 177.767 0.024 17931
1630 1 8 . 1 1 11 11 GLU CA C 726 58.406 58.406 58.039 0.367 17931
1631 1 8 . 1 1 11 11 GLU CB C 726 29.340 29.340 29.692 -0.352 17931
1632 1 8 . 1 1 12 12 PHE N N 727 118.859 118.859 119.515 -0.656 17931
1633 1 8 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.460 -0.082 17931
1634 1 8 . 1 1 12 12 PHE C C 727 176.439 176.439 177.401 -0.962 17931
1635 1 8 . 1 1 12 12 PHE CA C 727 59.332 59.332 60.041 -0.709 17931
1636 1 8 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.831 -0.671 17931
1637 1 8 . 1 1 12 12 PHE H H 727 7.922 7.922 8.180 -0.258 17931
1638 1 8 . 1 1 13 13 ALA N N 728 122.111 122.111 122.955 -0.844 17931
1639 1 8 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.901 0.257 17931
1640 1 8 . 1 1 13 13 ALA C C 728 178.542 178.542 179.262 -0.720 17931
1641 1 8 . 1 1 13 13 ALA CA C 728 54.083 54.083 54.916 -0.833 17931
1642 1 8 . 1 1 13 13 ALA CB C 728 18.409 18.409 18.158 0.251 17931
1643 1 8 . 1 1 13 13 ALA H H 728 7.970 7.970 7.971 -0.001 17931
1644 1 8 . 1 1 14 14 LYS N N 729 117.588 117.588 118.230 -0.642 17931
1645 1 8 . 1 1 14 14 LYS HA H 729 4.096 4.096 3.974 0.122 17931
1646 1 8 . 1 1 14 14 LYS C C 729 177.664 177.664 179.224 -1.560 17931
1647 1 8 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.532 -1.602 17931
1648 1 8 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.788 -1.273 17931
1649 1 8 . 1 1 14 14 LYS H H 729 7.792 7.792 7.959 -0.167 17931
1650 1 8 . 1 1 15 15 PHE N N 730 119.916 119.916 117.887 2.029 17931
1651 1 8 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.241 0.138 17931
1652 1 8 . 1 1 15 15 PHE C C 730 176.732 176.732 177.683 -0.951 17931
1653 1 8 . 1 1 15 15 PHE CA C 730 59.753 59.753 61.358 -1.605 17931
1654 1 8 . 1 1 15 15 PHE CB C 730 39.010 39.010 39.138 -0.128 17931
1655 1 8 . 1 1 15 15 PHE H H 730 7.874 7.874 8.322 -0.448 17931
1656 1 8 . 1 1 16 16 GLU N N 731 119.398 119.398 118.501 0.897 17931
1657 1 8 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.916 0.149 17931
1658 1 8 . 1 1 16 16 GLU C C 731 177.920 177.920 178.715 -0.795 17931
1659 1 8 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.182 -1.357 17931
1660 1 8 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.932 0.417 17931
1661 1 8 . 1 1 16 16 GLU H H 731 8.178 8.178 7.518 0.660 17931
1662 1 8 . 1 1 17 17 GLU N N 732 120.386 120.386 119.492 0.894 17931
1663 1 8 . 1 1 17 17 GLU HA H 732 4.050 4.050 4.033 0.017 17931
1664 1 8 . 1 1 17 17 GLU C C 732 178.097 178.097 178.692 -0.595 17931
1665 1 8 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.153 -0.846 17931
1666 1 8 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.362 0.026 17931
1667 1 8 . 1 1 17 17 GLU H H 732 8.117 8.117 8.610 -0.493 17931
1668 1 8 . 1 1 18 18 GLU N N 733 119.473 119.473 118.477 0.996 17931
1669 1 8 . 1 1 18 18 GLU HA H 733 4.056 4.056 4.022 0.034 17931
1670 1 8 . 1 1 18 18 GLU C C 733 177.228 177.228 177.774 -0.546 17931
1671 1 8 . 1 1 18 18 GLU CA C 733 58.298 58.298 58.660 -0.362 17931
1672 1 8 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.404 0.043 17931
1673 1 8 . 1 1 18 18 GLU H H 733 8.130 8.130 7.600 0.530 17931
1674 1 8 . 1 1 19 19 ARG N N 734 118.929 118.929 119.540 -0.611 17931
1675 1 8 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.257 -0.228 17931
1676 1 8 . 1 1 19 19 ARG C C 734 177.402 177.402 177.276 0.126 17931
1677 1 8 . 1 1 19 19 ARG CA C 734 58.400 58.400 57.985 0.415 17931
1678 1 8 . 1 1 19 19 ARG CB C 734 32.170 32.170 30.330 1.840 17931
1679 1 8 . 1 1 19 19 ARG H H 734 8.032 8.032 7.649 0.383 17931
1680 1 8 . 1 1 20 20 ALA N N 735 121.514 121.514 120.789 0.725 17931
1681 1 8 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.339 -0.210 17931
1682 1 8 . 1 1 20 20 ALA C C 735 179.108 179.108 179.828 -0.720 17931
1683 1 8 . 1 1 20 20 ALA CA C 735 53.559 53.559 54.438 -0.879 17931
1684 1 8 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.534 0.027 17931
1685 1 8 . 1 1 20 20 ALA H H 735 7.853 7.853 8.548 -0.695 17931
1686 1 8 . 1 1 21 21 ARG N N 736 117.944 117.944 119.669 -1.725 17931
1687 1 8 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.116 -0.006 17931
1688 1 8 . 1 1 21 21 ARG C C 736 176.643 176.643 178.029 -1.386 17931
1689 1 8 . 1 1 21 21 ARG CA C 736 56.737 56.737 58.685 -1.948 17931
1690 1 8 . 1 1 21 21 ARG CB C 736 30.573 30.573 29.967 0.606 17931
1691 1 8 . 1 1 21 21 ARG H H 736 7.850 7.850 8.290 -0.440 17931
1692 1 8 . 1 1 22 22 ALA N N 737 122.381 122.381 120.210 2.171 17931
1693 1 8 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.180 -0.029 17931
1694 1 8 . 1 1 22 22 ALA C C 737 177.640 177.640 178.645 -1.005 17931
1695 1 8 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.475 -1.705 17931
1696 1 8 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.573 0.174 17931
1697 1 8 . 1 1 22 22 ALA H H 737 7.776 7.776 7.737 0.039 17931
1698 1 8 . 1 1 23 23 LYS N N 738 118.327 118.327 114.866 3.461 17931
1699 1 8 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.339 -0.180 17931
1700 1 8 . 1 1 23 23 LYS C C 738 176.483 176.483 176.450 0.033 17931
1701 1 8 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.856 -0.388 17931
1702 1 8 . 1 1 23 23 LYS CB C 738 32.526 32.526 34.161 -1.635 17931
1703 1 8 . 1 1 23 23 LYS H H 738 7.838 7.838 7.873 -0.035 17931
1704 1 8 . 1 1 24 24 TRP N N 739 120.598 120.598 120.582 0.016 17931
1705 1 8 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.994 -0.393 17931
1706 1 8 . 1 1 24 24 TRP C C 739 175.904 175.904 176.017 -0.113 17931
1707 1 8 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.078 0.869 17931
1708 1 8 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.433 0.088 17931
1709 1 8 . 1 1 24 24 TRP H H 739 7.958 7.958 8.030 -0.072 17931
1710 1 8 . 1 1 25 25 ASP N N 740 121.214 121.214 121.126 0.088 17931
1711 1 8 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.502 -0.351 17931
1712 1 8 . 1 1 25 25 ASP C C 740 176.626 176.626 178.243 -1.617 17931
1713 1 8 . 1 1 25 25 ASP CA C 740 54.173 54.173 56.836 -2.663 17931
1714 1 8 . 1 1 25 25 ASP CB C 740 40.971 40.971 39.758 1.213 17931
1715 1 8 . 1 1 25 25 ASP H H 740 8.248 8.248 7.838 0.410 17931
1716 1 8 . 1 1 26 26 THR N N 741 113.708 113.708 112.357 1.351 17931
1717 1 8 . 1 1 26 26 THR HA H 741 4.221 4.221 4.128 0.093 17931
1718 1 8 . 1 1 26 26 THR C C 741 174.851 174.851 175.396 -0.545 17931
1719 1 8 . 1 1 26 26 THR CA C 741 62.439 62.439 64.334 -1.895 17931
1720 1 8 . 1 1 26 26 THR CB C 741 69.255 69.255 68.272 0.983 17931
1721 1 8 . 1 1 26 26 THR H H 741 7.945 7.945 8.279 -0.334 17931
1722 1 8 . 1 1 27 27 ALA N N 742 124.543 124.543 121.456 3.087 17931
1723 1 8 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.383 -0.187 17931
1724 1 8 . 1 1 27 27 ALA C C 742 177.509 177.509 178.266 -0.757 17931
1725 1 8 . 1 1 27 27 ALA CA C 742 52.953 52.953 53.885 -0.932 17931
1726 1 8 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.897 -0.948 17931
1727 1 8 . 1 1 27 27 ALA H H 742 8.113 8.113 7.641 0.472 17931
1728 1 8 . 1 1 28 28 ASN N N 743 116.039 116.039 115.215 0.824 17931
1729 1 8 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.860 -0.261 17931
1730 1 8 . 1 1 28 28 ASN C C 743 174.330 174.330 175.945 -1.615 17931
1731 1 8 . 1 1 28 28 ASN CA C 743 52.868 52.868 53.674 -0.806 17931
1732 1 8 . 1 1 28 28 ASN CB C 743 38.995 38.995 40.909 -1.914 17931
1733 1 8 . 1 1 28 28 ASN H H 743 8.055 8.055 7.959 0.096 17931
1734 1 8 . 1 1 29 29 ASN N N 744 119.625 119.625 120.420 -0.795 17931
1735 1 8 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.006 -0.398 17931
1736 1 8 . 1 1 29 29 ASN CA C 744 50.940 50.940 52.181 -1.241 17931
1737 1 8 . 1 1 29 29 ASN CB C 744 38.798 38.798 39.075 -0.277 17931
1738 1 8 . 1 1 29 29 ASN H H 744 8.015 8.015 8.066 -0.051 17931
1739 1 8 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.341 0.031 17931
1740 1 8 . 1 1 30 30 PRO C C 745 177.196 177.196 176.852 0.344 17931
1741 1 8 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.766 -1.183 17931
1742 1 8 . 1 1 30 30 PRO CB C 745 31.888 31.888 31.957 -0.069 17931
1743 1 8 . 1 1 34 34 GLU N N 749 121.140 121.140 122.658 -1.518 17931
1744 1 8 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.038 0.168 17931
1745 1 8 . 1 1 34 34 GLU C C 749 176.764 176.764 176.577 0.187 17931
1746 1 8 . 1 1 34 34 GLU CA C 749 56.698 56.698 59.015 -2.317 17931
1747 1 8 . 1 1 34 34 GLU CB C 749 29.784 29.784 30.059 -0.275 17931
1748 1 8 . 1 1 34 34 GLU H H 749 8.215 8.215 8.924 -0.709 17931
1749 1 8 . 1 1 35 35 ALA N N 750 124.506 124.506 120.101 4.405 17931
1750 1 8 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.465 -0.189 17931
1751 1 8 . 1 1 35 35 ALA C C 750 178.054 178.054 177.814 0.240 17931
1752 1 8 . 1 1 35 35 ALA CA C 750 53.011 53.011 51.846 1.165 17931
1753 1 8 . 1 1 35 35 ALA CB C 750 19.021 19.021 17.725 1.296 17931
1754 1 8 . 1 1 35 35 ALA H H 750 8.335 8.335 8.251 0.084 17931
1755 1 8 . 1 1 36 36 THR N N 751 111.925 111.925 114.979 -3.054 17931
1756 1 8 . 1 1 36 36 THR HA H 751 4.225 4.225 4.431 -0.206 17931
1757 1 8 . 1 1 36 36 THR C C 751 175.137 175.137 175.968 -0.831 17931
1758 1 8 . 1 1 36 36 THR CA C 751 62.508 62.508 64.888 -2.380 17931
1759 1 8 . 1 1 36 36 THR CB C 751 69.600 69.600 68.691 0.909 17931
1760 1 8 . 1 1 36 36 THR H H 751 8.007 8.007 7.969 0.038 17931
1761 1 8 . 1 1 37 37 SER N N 752 117.676 117.676 115.260 2.416 17931
1762 1 8 . 1 1 37 37 SER HA H 752 4.567 4.567 4.357 0.210 17931
1763 1 8 . 1 1 37 37 SER C C 752 174.881 174.881 175.757 -0.876 17931
1764 1 8 . 1 1 37 37 SER CA C 752 58.856 58.856 61.598 -2.742 17931
1765 1 8 . 1 1 37 37 SER CB C 752 63.705 63.705 63.044 0.661 17931
1766 1 8 . 1 1 37 37 SER H H 752 8.156 8.156 8.213 -0.057 17931
1767 1 8 . 1 1 38 38 THR N N 753 116.343 116.343 116.429 -0.086 17931
1768 1 8 . 1 1 38 38 THR HA H 753 4.126 4.126 4.038 0.088 17931
1769 1 8 . 1 1 38 38 THR C C 753 174.555 174.555 174.677 -0.122 17931
1770 1 8 . 1 1 38 38 THR CA C 753 62.889 62.889 64.054 -1.165 17931
1771 1 8 . 1 1 38 38 THR CB C 753 69.292 69.292 69.049 0.243 17931
1772 1 8 . 1 1 38 38 THR H H 753 8.042 8.042 8.007 0.035 17931
1773 1 8 . 1 1 39 39 PHE N N 754 120.983 120.983 121.320 -0.337 17931
1774 1 8 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.878 -0.311 17931
1775 1 8 . 1 1 39 39 PHE C C 754 175.956 175.956 175.418 0.538 17931
1776 1 8 . 1 1 39 39 PHE CA C 754 58.289 58.289 56.669 1.620 17931
1777 1 8 . 1 1 39 39 PHE CB C 754 39.222 39.222 39.633 -0.411 17931
1778 1 8 . 1 1 39 39 PHE H H 754 8.163 8.163 8.219 -0.056 17931
1779 1 8 . 1 1 40 40 THR N N 755 114.474 114.474 119.304 -4.830 17931
1780 1 8 . 1 1 40 40 THR HA H 755 4.159 4.159 4.412 -0.253 17931
1781 1 8 . 1 1 40 40 THR C C 755 174.168 174.168 174.495 -0.327 17931
1782 1 8 . 1 1 40 40 THR CA C 755 62.446 62.446 64.411 -1.965 17931
1783 1 8 . 1 1 40 40 THR CB C 755 69.403 69.403 69.470 -0.067 17931
1784 1 8 . 1 1 40 40 THR H H 755 7.943 7.943 8.478 -0.535 17931
1785 1 8 . 1 1 41 41 ASN N N 756 120.598 120.598 117.071 3.527 17931
1786 1 8 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.845 -0.246 17931
1787 1 8 . 1 1 41 41 ASN C C 756 175.438 175.438 174.422 1.016 17931
1788 1 8 . 1 1 41 41 ASN CA C 756 53.625 53.625 53.517 0.109 17931
1789 1 8 . 1 1 41 41 ASN CB C 756 38.852 38.852 38.959 -0.107 17931
1790 1 8 . 1 1 41 41 ASN H H 756 8.254 8.254 7.773 0.481 17931
1791 1 8 . 1 1 42 42 ILE N N 757 119.988 119.988 117.999 1.989 17931
1792 1 8 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.609 -0.476 17931
1793 1 8 . 1 1 42 42 ILE C C 757 176.180 176.180 175.791 0.389 17931
1794 1 8 . 1 1 42 42 ILE CA C 757 61.607 61.607 61.711 -0.104 17931
1795 1 8 . 1 1 42 42 ILE CB C 757 38.526 38.526 38.876 -0.350 17931
1796 1 8 . 1 1 42 42 ILE H H 757 7.988 7.988 8.305 -0.317 17931
1797 1 8 . 1 1 46 46 GLY N N 761 109.795 109.795 114.200 -4.405 17931
1798 1 8 . 1 1 46 46 GLY C C 761 173.400 173.400 173.972 -0.572 17931
1799 1 8 . 1 1 46 46 GLY CA C 761 45.241 45.241 45.214 0.028 17931
1800 1 8 . 1 1 46 46 GLY H H 761 8.038 8.038 8.787 -0.749 17931
1801 1 9 . 1 1 2 2 LEU N N 717 120.100 120.100 121.709 -1.609 17931
1802 1 9 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.280 -0.150 17931
1803 1 9 . 1 1 2 2 LEU C C 717 177.505 177.505 177.590 -0.085 17931
1804 1 9 . 1 1 2 2 LEU CA C 717 56.674 56.674 57.107 -0.433 17931
1805 1 9 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.489 0.364 17931
1806 1 9 . 1 1 2 2 LEU H H 717 7.866 7.866 8.099 -0.233 17931
1807 1 9 . 1 1 3 3 LEU N N 718 118.481 118.481 117.740 0.741 17931
1808 1 9 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.145 -0.088 17931
1809 1 9 . 1 1 3 3 LEU C C 718 177.643 177.643 178.410 -0.767 17931
1810 1 9 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.362 -0.419 17931
1811 1 9 . 1 1 3 3 LEU CB C 718 41.735 41.735 41.363 0.372 17931
1812 1 9 . 1 1 3 3 LEU H H 718 7.746 7.746 7.935 -0.189 17931
1813 1 9 . 1 1 4 4 ILE N N 719 116.207 116.207 117.410 -1.203 17931
1814 1 9 . 1 1 4 4 ILE HA H 719 3.911 3.911 4.012 -0.101 17931
1815 1 9 . 1 1 4 4 ILE C C 719 176.774 176.774 178.641 -1.867 17931
1816 1 9 . 1 1 4 4 ILE CA C 719 62.960 62.960 62.772 0.188 17931
1817 1 9 . 1 1 4 4 ILE CB C 719 38.219 38.219 37.241 0.978 17931
1818 1 9 . 1 1 4 4 ILE H H 719 7.724 7.724 7.189 0.535 17931
1819 1 9 . 1 1 5 5 THR N N 720 114.581 114.581 116.597 -2.016 17931
1820 1 9 . 1 1 5 5 THR HA H 720 4.161 4.161 4.162 -0.001 17931
1821 1 9 . 1 1 5 5 THR C C 720 175.458 175.458 176.507 -1.049 17931
1822 1 9 . 1 1 5 5 THR CA C 720 64.390 64.390 65.564 -1.174 17931
1823 1 9 . 1 1 5 5 THR CB C 720 69.052 69.052 68.100 0.952 17931
1824 1 9 . 1 1 5 5 THR H H 720 7.802 7.802 8.504 -0.702 17931
1825 1 9 . 1 1 6 6 ILE N N 721 119.805 119.805 121.907 -2.102 17931
1826 1 9 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.604 0.305 17931
1827 1 9 . 1 1 6 6 ILE C C 721 176.102 176.102 177.005 -0.903 17931
1828 1 9 . 1 1 6 6 ILE CA C 721 63.025 63.025 65.369 -2.344 17931
1829 1 9 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.416 0.688 17931
1830 1 9 . 1 1 6 6 ILE H H 721 7.751 7.751 7.705 0.046 17931
1831 1 9 . 1 1 7 7 HIS N N 722 118.760 118.760 118.497 0.263 17931
1832 1 9 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.226 0.389 17931
1833 1 9 . 1 1 7 7 HIS C C 722 174.538 174.538 177.043 -2.505 17931
1834 1 9 . 1 1 7 7 HIS CA C 722 57.344 57.344 59.901 -2.557 17931
1835 1 9 . 1 1 7 7 HIS CB C 722 29.375 29.375 30.015 -0.640 17931
1836 1 9 . 1 1 7 7 HIS H H 722 8.097 8.097 7.921 0.176 17931
1837 1 9 . 1 1 8 8 ASP N N 723 117.884 117.884 118.689 -0.805 17931
1838 1 9 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.682 -0.088 17931
1839 1 9 . 1 1 8 8 ASP C C 723 176.829 176.829 177.639 -0.810 17931
1840 1 9 . 1 1 8 8 ASP CA C 723 54.176 54.176 56.905 -2.729 17931
1841 1 9 . 1 1 8 8 ASP CB C 723 41.500 41.500 41.212 0.288 17931
1842 1 9 . 1 1 8 8 ASP H H 723 7.969 7.969 7.822 0.147 17931
1843 1 9 . 1 1 9 9 ARG N N 724 121.014 121.014 121.016 -0.002 17931
1844 1 9 . 1 1 9 9 ARG HA H 724 4.204 4.204 3.942 0.262 17931
1845 1 9 . 1 1 9 9 ARG C C 724 177.662 177.662 178.054 -0.392 17931
1846 1 9 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.382 -2.563 17931
1847 1 9 . 1 1 9 9 ARG CB C 724 32.703 32.703 30.282 2.421 17931
1848 1 9 . 1 1 9 9 ARG H H 724 8.216 8.216 8.414 -0.198 17931
1849 1 9 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.128 0.007 17931
1850 1 9 . 1 1 10 10 LYS C C 725 178.127 178.127 178.076 0.051 17931
1851 1 9 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.170 -0.423 17931
1852 1 9 . 1 1 10 10 LYS CB C 725 32.190 32.190 31.938 0.252 17931
1853 1 9 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.249 -0.153 17931
1854 1 9 . 1 1 11 11 GLU C C 726 177.791 177.791 177.936 -0.145 17931
1855 1 9 . 1 1 11 11 GLU CA C 726 58.406 58.406 58.172 0.234 17931
1856 1 9 . 1 1 11 11 GLU CB C 726 29.340 29.340 29.960 -0.620 17931
1857 1 9 . 1 1 12 12 PHE N N 727 118.859 118.859 119.878 -1.019 17931
1858 1 9 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.728 -0.350 17931
1859 1 9 . 1 1 12 12 PHE C C 727 176.439 176.439 177.689 -1.250 17931
1860 1 9 . 1 1 12 12 PHE CA C 727 59.332 59.332 60.367 -1.035 17931
1861 1 9 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.768 -0.608 17931
1862 1 9 . 1 1 12 12 PHE H H 727 7.922 7.922 8.384 -0.462 17931
1863 1 9 . 1 1 13 13 ALA N N 728 122.111 122.111 122.350 -0.239 17931
1864 1 9 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.812 0.346 17931
1865 1 9 . 1 1 13 13 ALA C C 728 178.542 178.542 178.961 -0.419 17931
1866 1 9 . 1 1 13 13 ALA CA C 728 54.083 54.083 54.832 -0.749 17931
1867 1 9 . 1 1 13 13 ALA CB C 728 18.409 18.409 17.839 0.570 17931
1868 1 9 . 1 1 13 13 ALA H H 728 7.970 7.970 7.935 0.035 17931
1869 1 9 . 1 1 14 14 LYS N N 729 117.588 117.588 118.826 -1.238 17931
1870 1 9 . 1 1 14 14 LYS HA H 729 4.096 4.096 3.975 0.121 17931
1871 1 9 . 1 1 14 14 LYS C C 729 177.664 177.664 178.395 -0.731 17931
1872 1 9 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.026 -1.096 17931
1873 1 9 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.635 -1.120 17931
1874 1 9 . 1 1 14 14 LYS H H 729 7.792 7.792 7.780 0.012 17931
1875 1 9 . 1 1 15 15 PHE N N 730 119.916 119.916 117.759 2.157 17931
1876 1 9 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.201 0.178 17931
1877 1 9 . 1 1 15 15 PHE C C 730 176.732 176.732 178.411 -1.679 17931
1878 1 9 . 1 1 15 15 PHE CA C 730 59.753 59.753 61.405 -1.652 17931
1879 1 9 . 1 1 15 15 PHE CB C 730 39.010 39.010 39.045 -0.035 17931
1880 1 9 . 1 1 15 15 PHE H H 730 7.874 7.874 7.912 -0.038 17931
1881 1 9 . 1 1 16 16 GLU N N 731 119.398 119.398 118.575 0.823 17931
1882 1 9 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.928 0.137 17931
1883 1 9 . 1 1 16 16 GLU C C 731 177.920 177.920 178.573 -0.653 17931
1884 1 9 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.176 -1.351 17931
1885 1 9 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.710 0.639 17931
1886 1 9 . 1 1 16 16 GLU H H 731 8.178 8.178 7.698 0.480 17931
1887 1 9 . 1 1 17 17 GLU N N 732 120.386 120.386 119.870 0.516 17931
1888 1 9 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.990 0.060 17931
1889 1 9 . 1 1 17 17 GLU C C 732 178.097 178.097 179.076 -0.979 17931
1890 1 9 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.339 -1.032 17931
1891 1 9 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.303 0.085 17931
1892 1 9 . 1 1 17 17 GLU H H 732 8.117 8.117 8.312 -0.195 17931
1893 1 9 . 1 1 18 18 GLU N N 733 119.473 119.473 119.104 0.369 17931
1894 1 9 . 1 1 18 18 GLU HA H 733 4.056 4.056 3.996 0.060 17931
1895 1 9 . 1 1 18 18 GLU C C 733 177.228 177.228 178.909 -1.681 17931
1896 1 9 . 1 1 18 18 GLU CA C 733 58.298 58.298 59.245 -0.947 17931
1897 1 9 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.353 0.094 17931
1898 1 9 . 1 1 18 18 GLU H H 733 8.130 8.130 7.627 0.503 17931
1899 1 9 . 1 1 19 19 ARG N N 734 118.929 118.929 119.304 -0.375 17931
1900 1 9 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.225 -0.196 17931
1901 1 9 . 1 1 19 19 ARG C C 734 177.402 177.402 178.150 -0.748 17931
1902 1 9 . 1 1 19 19 ARG CA C 734 58.400 58.400 58.089 0.311 17931
1903 1 9 . 1 1 19 19 ARG CB C 734 32.170 32.170 29.702 2.468 17931
1904 1 9 . 1 1 19 19 ARG H H 734 8.032 8.032 7.714 0.318 17931
1905 1 9 . 1 1 20 20 ALA N N 735 121.514 121.514 122.046 -0.532 17931
1906 1 9 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.132 -0.003 17931
1907 1 9 . 1 1 20 20 ALA C C 735 179.108 179.108 179.678 -0.570 17931
1908 1 9 . 1 1 20 20 ALA CA C 735 53.559 53.559 55.021 -1.462 17931
1909 1 9 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.444 0.117 17931
1910 1 9 . 1 1 20 20 ALA H H 735 7.853 7.853 8.552 -0.699 17931
1911 1 9 . 1 1 21 21 ARG N N 736 117.944 117.944 119.103 -1.159 17931
1912 1 9 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.238 -0.128 17931
1913 1 9 . 1 1 21 21 ARG C C 736 176.643 176.643 178.483 -1.840 17931
1914 1 9 . 1 1 21 21 ARG CA C 736 56.737 56.737 58.542 -1.805 17931
1915 1 9 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.260 0.313 17931
1916 1 9 . 1 1 21 21 ARG H H 736 7.850 7.850 8.536 -0.686 17931
1917 1 9 . 1 1 22 22 ALA N N 737 122.381 122.381 121.646 0.735 17931
1918 1 9 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.184 -0.033 17931
1919 1 9 . 1 1 22 22 ALA C C 737 177.640 177.640 178.785 -1.145 17931
1920 1 9 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.647 -1.877 17931
1921 1 9 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.773 -0.026 17931
1922 1 9 . 1 1 22 22 ALA H H 737 7.776 7.776 7.828 -0.052 17931
1923 1 9 . 1 1 23 23 LYS N N 738 118.327 118.327 113.997 4.330 17931
1924 1 9 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.395 -0.236 17931
1925 1 9 . 1 1 23 23 LYS C C 738 176.483 176.483 175.580 0.903 17931
1926 1 9 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.035 0.433 17931
1927 1 9 . 1 1 23 23 LYS CB C 738 32.526 32.526 34.137 -1.611 17931
1928 1 9 . 1 1 23 23 LYS H H 738 7.838 7.838 7.737 0.101 17931
1929 1 9 . 1 1 24 24 TRP N N 739 120.598 120.598 121.206 -0.608 17931
1930 1 9 . 1 1 24 24 TRP HA H 739 4.601 4.601 5.019 -0.418 17931
1931 1 9 . 1 1 24 24 TRP C C 739 175.904 175.904 175.846 0.058 17931
1932 1 9 . 1 1 24 24 TRP CA C 739 56.947 56.947 55.947 1.000 17931
1933 1 9 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.303 0.218 17931
1934 1 9 . 1 1 24 24 TRP H H 739 7.958 7.958 8.633 -0.675 17931
1935 1 9 . 1 1 25 25 ASP N N 740 121.214 121.214 121.333 -0.119 17931
1936 1 9 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.308 -0.157 17931
1937 1 9 . 1 1 25 25 ASP C C 740 176.626 176.626 177.464 -0.838 17931
1938 1 9 . 1 1 25 25 ASP CA C 740 54.173 54.173 57.801 -3.628 17931
1939 1 9 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.093 0.878 17931
1940 1 9 . 1 1 25 25 ASP H H 740 8.248 8.248 7.910 0.338 17931
1941 1 9 . 1 1 26 26 THR N N 741 113.708 113.708 113.673 0.035 17931
1942 1 9 . 1 1 26 26 THR HA H 741 4.221 4.221 4.116 0.105 17931
1943 1 9 . 1 1 26 26 THR C C 741 174.851 174.851 174.705 0.146 17931
1944 1 9 . 1 1 26 26 THR CA C 741 62.439 62.439 64.189 -1.750 17931
1945 1 9 . 1 1 26 26 THR CB C 741 69.255 69.255 68.255 1.000 17931
1946 1 9 . 1 1 26 26 THR H H 741 7.945 7.945 8.214 -0.269 17931
1947 1 9 . 1 1 27 27 ALA N N 742 124.543 124.543 122.047 2.496 17931
1948 1 9 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.393 -0.197 17931
1949 1 9 . 1 1 27 27 ALA C C 742 177.509 177.509 178.986 -1.477 17931
1950 1 9 . 1 1 27 27 ALA CA C 742 52.953 52.953 53.915 -0.962 17931
1951 1 9 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.400 -0.451 17931
1952 1 9 . 1 1 27 27 ALA H H 742 8.113 8.113 7.691 0.422 17931
1953 1 9 . 1 1 28 28 ASN N N 743 116.039 116.039 115.304 0.735 17931
1954 1 9 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.859 -0.260 17931
1955 1 9 . 1 1 28 28 ASN C C 743 174.330 174.330 175.975 -1.645 17931
1956 1 9 . 1 1 28 28 ASN CA C 743 52.868 52.868 54.268 -1.400 17931
1957 1 9 . 1 1 28 28 ASN CB C 743 38.995 38.995 40.872 -1.877 17931
1958 1 9 . 1 1 28 28 ASN H H 743 8.055 8.055 7.989 0.066 17931
1959 1 9 . 1 1 29 29 ASN N N 744 119.625 119.625 119.118 0.507 17931
1960 1 9 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.197 -0.589 17931
1961 1 9 . 1 1 29 29 ASN CA C 744 50.940 50.940 51.141 -0.201 17931
1962 1 9 . 1 1 29 29 ASN CB C 744 38.798 38.798 40.531 -1.733 17931
1963 1 9 . 1 1 29 29 ASN H H 744 8.015 8.015 8.090 -0.075 17931
1964 1 9 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.361 0.011 17931
1965 1 9 . 1 1 30 30 PRO C C 745 177.196 177.196 176.625 0.571 17931
1966 1 9 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.479 -0.896 17931
1967 1 9 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.241 -0.353 17931
1968 1 9 . 1 1 34 34 GLU N N 749 121.140 121.140 120.577 0.563 17931
1969 1 9 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.165 0.041 17931
1970 1 9 . 1 1 34 34 GLU C C 749 176.764 176.764 177.223 -0.459 17931
1971 1 9 . 1 1 34 34 GLU CA C 749 56.698 56.698 58.920 -2.222 17931
1972 1 9 . 1 1 34 34 GLU CB C 749 29.784 29.784 29.764 0.020 17931
1973 1 9 . 1 1 34 34 GLU H H 749 8.215 8.215 9.004 -0.789 17931
1974 1 9 . 1 1 35 35 ALA N N 750 124.506 124.506 120.852 3.654 17931
1975 1 9 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.291 -0.015 17931
1976 1 9 . 1 1 35 35 ALA C C 750 178.054 178.054 178.829 -0.775 17931
1977 1 9 . 1 1 35 35 ALA CA C 750 53.011 53.011 53.971 -0.960 17931
1978 1 9 . 1 1 35 35 ALA CB C 750 19.021 19.021 18.067 0.954 17931
1979 1 9 . 1 1 35 35 ALA H H 750 8.335 8.335 8.423 -0.088 17931
1980 1 9 . 1 1 36 36 THR N N 751 111.925 111.925 112.069 -0.144 17931
1981 1 9 . 1 1 36 36 THR HA H 751 4.225 4.225 4.595 -0.370 17931
1982 1 9 . 1 1 36 36 THR C C 751 175.137 175.137 175.666 -0.529 17931
1983 1 9 . 1 1 36 36 THR CA C 751 62.508 62.508 63.581 -1.073 17931
1984 1 9 . 1 1 36 36 THR CB C 751 69.600 69.600 68.875 0.725 17931
1985 1 9 . 1 1 36 36 THR H H 751 8.007 8.007 7.461 0.546 17931
1986 1 9 . 1 1 37 37 SER N N 752 117.676 117.676 118.215 -0.539 17931
1987 1 9 . 1 1 37 37 SER HA H 752 4.567 4.567 4.362 0.205 17931
1988 1 9 . 1 1 37 37 SER C C 752 174.881 174.881 175.995 -1.114 17931
1989 1 9 . 1 1 37 37 SER CA C 752 58.856 58.856 61.387 -2.531 17931
1990 1 9 . 1 1 37 37 SER CB C 752 63.705 63.705 63.501 0.204 17931
1991 1 9 . 1 1 37 37 SER H H 752 8.156 8.156 7.711 0.445 17931
1992 1 9 . 1 1 38 38 THR N N 753 116.343 116.343 114.932 1.411 17931
1993 1 9 . 1 1 38 38 THR HA H 753 4.126 4.126 4.352 -0.226 17931
1994 1 9 . 1 1 38 38 THR C C 753 174.555 174.555 174.078 0.477 17931
1995 1 9 . 1 1 38 38 THR CA C 753 62.889 62.889 62.363 0.526 17931
1996 1 9 . 1 1 38 38 THR CB C 753 69.292 69.292 69.537 -0.244 17931
1997 1 9 . 1 1 38 38 THR H H 753 8.042 8.042 8.013 0.029 17931
1998 1 9 . 1 1 39 39 PHE N N 754 120.983 120.983 121.252 -0.269 17931
1999 1 9 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.368 0.199 17931
2000 1 9 . 1 1 39 39 PHE C C 754 175.956 175.956 174.188 1.768 17931
2001 1 9 . 1 1 39 39 PHE CA C 754 58.289 58.289 58.393 -0.104 17931
2002 1 9 . 1 1 39 39 PHE CB C 754 39.222 39.222 37.332 1.890 17931
2003 1 9 . 1 1 39 39 PHE H H 754 8.163 8.163 7.984 0.179 17931
2004 1 9 . 1 1 40 40 THR N N 755 114.474 114.474 117.755 -3.281 17931
2005 1 9 . 1 1 40 40 THR HA H 755 4.159 4.159 4.332 -0.173 17931
2006 1 9 . 1 1 40 40 THR C C 755 174.168 174.168 175.652 -1.484 17931
2007 1 9 . 1 1 40 40 THR CA C 755 62.446 62.446 61.980 0.466 17931
2008 1 9 . 1 1 40 40 THR CB C 755 69.403 69.403 70.040 -0.637 17931
2009 1 9 . 1 1 40 40 THR H H 755 7.943 7.943 8.473 -0.530 17931
2010 1 9 . 1 1 41 41 ASN N N 756 120.598 120.598 122.721 -2.123 17931
2011 1 9 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.493 0.106 17931
2012 1 9 . 1 1 41 41 ASN C C 756 175.438 175.438 176.074 -0.636 17931
2013 1 9 . 1 1 41 41 ASN CA C 756 53.625 53.625 56.231 -2.606 17931
2014 1 9 . 1 1 41 41 ASN CB C 756 38.852 38.852 37.619 1.233 17931
2015 1 9 . 1 1 41 41 ASN H H 756 8.254 8.254 7.914 0.340 17931
2016 1 9 . 1 1 42 42 ILE N N 757 119.988 119.988 112.767 7.221 17931
2017 1 9 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.509 -0.376 17931
2018 1 9 . 1 1 42 42 ILE C C 757 176.180 176.180 175.449 0.731 17931
2019 1 9 . 1 1 42 42 ILE CA C 757 61.607 61.607 60.600 1.007 17931
2020 1 9 . 1 1 42 42 ILE CB C 757 38.526 38.526 37.121 1.405 17931
2021 1 9 . 1 1 42 42 ILE H H 757 7.988 7.988 7.854 0.134 17931
2022 1 9 . 1 1 46 46 GLY N N 761 109.795 109.795 110.020 -0.225 17931
2023 1 9 . 1 1 46 46 GLY C C 761 173.400 173.400 174.805 -1.405 17931
2024 1 9 . 1 1 46 46 GLY CA C 761 45.241 45.241 45.725 -0.484 17931
2025 1 9 . 1 1 46 46 GLY H H 761 8.038 8.038 8.762 -0.724 17931
2026 1 10 . 1 1 2 2 LEU N N 717 120.100 120.100 121.952 -1.852 17931
2027 1 10 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.407 -0.277 17931
2028 1 10 . 1 1 2 2 LEU C C 717 177.505 177.505 176.922 0.583 17931
2029 1 10 . 1 1 2 2 LEU CA C 717 56.674 56.674 57.050 -0.376 17931
2030 1 10 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.927 -0.074 17931
2031 1 10 . 1 1 2 2 LEU H H 717 7.866 7.866 7.935 -0.069 17931
2032 1 10 . 1 1 3 3 LEU N N 718 118.481 118.481 118.929 -0.448 17931
2033 1 10 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.130 -0.073 17931
2034 1 10 . 1 1 3 3 LEU C C 718 177.643 177.643 179.234 -1.591 17931
2035 1 10 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.783 -0.840 17931
2036 1 10 . 1 1 3 3 LEU CB C 718 41.735 41.735 40.279 1.456 17931
2037 1 10 . 1 1 3 3 LEU H H 718 7.746 7.746 8.070 -0.324 17931
2038 1 10 . 1 1 4 4 ILE N N 719 116.207 116.207 116.012 0.195 17931
2039 1 10 . 1 1 4 4 ILE HA H 719 3.911 3.911 4.088 -0.177 17931
2040 1 10 . 1 1 4 4 ILE C C 719 176.774 176.774 178.939 -2.165 17931
2041 1 10 . 1 1 4 4 ILE CA C 719 62.960 62.960 63.230 -0.270 17931
2042 1 10 . 1 1 4 4 ILE CB C 719 38.219 38.219 36.866 1.353 17931
2043 1 10 . 1 1 4 4 ILE H H 719 7.724 7.724 7.766 -0.042 17931
2044 1 10 . 1 1 5 5 THR N N 720 114.581 114.581 116.486 -1.905 17931
2045 1 10 . 1 1 5 5 THR HA H 720 4.161 4.161 4.183 -0.022 17931
2046 1 10 . 1 1 5 5 THR C C 720 175.458 175.458 176.185 -0.727 17931
2047 1 10 . 1 1 5 5 THR CA C 720 64.390 64.390 65.543 -1.153 17931
2048 1 10 . 1 1 5 5 THR CB C 720 69.052 69.052 68.481 0.571 17931
2049 1 10 . 1 1 5 5 THR H H 720 7.802 7.802 7.712 0.090 17931
2050 1 10 . 1 1 6 6 ILE N N 721 119.805 119.805 120.759 -0.954 17931
2051 1 10 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.548 0.361 17931
2052 1 10 . 1 1 6 6 ILE C C 721 176.102 176.102 176.994 -0.892 17931
2053 1 10 . 1 1 6 6 ILE CA C 721 63.025 63.025 65.252 -2.227 17931
2054 1 10 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.660 0.444 17931
2055 1 10 . 1 1 6 6 ILE H H 721 7.751 7.751 7.706 0.045 17931
2056 1 10 . 1 1 7 7 HIS N N 722 118.760 118.760 117.012 1.748 17931
2057 1 10 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.379 0.236 17931
2058 1 10 . 1 1 7 7 HIS C C 722 174.538 174.538 176.163 -1.625 17931
2059 1 10 . 1 1 7 7 HIS CA C 722 57.344 57.344 58.656 -1.312 17931
2060 1 10 . 1 1 7 7 HIS CB C 722 29.375 29.375 30.368 -0.993 17931
2061 1 10 . 1 1 7 7 HIS H H 722 8.097 8.097 7.694 0.403 17931
2062 1 10 . 1 1 8 8 ASP N N 723 117.884 117.884 117.558 0.326 17931
2063 1 10 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.876 -0.282 17931
2064 1 10 . 1 1 8 8 ASP C C 723 176.829 176.829 177.298 -0.469 17931
2065 1 10 . 1 1 8 8 ASP CA C 723 54.176 54.176 54.605 -0.429 17931
2066 1 10 . 1 1 8 8 ASP CB C 723 41.500 41.500 42.317 -0.817 17931
2067 1 10 . 1 1 8 8 ASP H H 723 7.969 7.969 7.849 0.120 17931
2068 1 10 . 1 1 9 9 ARG N N 724 121.014 121.014 120.425 0.589 17931
2069 1 10 . 1 1 9 9 ARG HA H 724 4.204 4.204 3.989 0.215 17931
2070 1 10 . 1 1 9 9 ARG C C 724 177.662 177.662 177.571 0.091 17931
2071 1 10 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.217 -2.398 17931
2072 1 10 . 1 1 9 9 ARG CB C 724 32.703 32.703 29.572 3.131 17931
2073 1 10 . 1 1 9 9 ARG H H 724 8.216 8.216 7.856 0.360 17931
2074 1 10 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.105 0.030 17931
2075 1 10 . 1 1 10 10 LYS C C 725 178.127 178.127 177.632 0.495 17931
2076 1 10 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.271 -0.524 17931
2077 1 10 . 1 1 10 10 LYS CB C 725 32.190 32.190 31.551 0.639 17931
2078 1 10 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.118 -0.022 17931
2079 1 10 . 1 1 11 11 GLU C C 726 177.791 177.791 177.767 0.024 17931
2080 1 10 . 1 1 11 11 GLU CA C 726 58.406 58.406 57.149 1.257 17931
2081 1 10 . 1 1 11 11 GLU CB C 726 29.340 29.340 29.617 -0.277 17931
2082 1 10 . 1 1 12 12 PHE N N 727 118.859 118.859 120.603 -1.744 17931
2083 1 10 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.423 -0.045 17931
2084 1 10 . 1 1 12 12 PHE C C 727 176.439 176.439 176.723 -0.284 17931
2085 1 10 . 1 1 12 12 PHE CA C 727 59.332 59.332 59.806 -0.474 17931
2086 1 10 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.570 -0.410 17931
2087 1 10 . 1 1 12 12 PHE H H 727 7.922 7.922 8.048 -0.126 17931
2088 1 10 . 1 1 13 13 ALA N N 728 122.111 122.111 121.250 0.861 17931
2089 1 10 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.877 0.281 17931
2090 1 10 . 1 1 13 13 ALA C C 728 178.542 178.542 179.073 -0.531 17931
2091 1 10 . 1 1 13 13 ALA CA C 728 54.083 54.083 54.544 -0.461 17931
2092 1 10 . 1 1 13 13 ALA CB C 728 18.409 18.409 17.957 0.452 17931
2093 1 10 . 1 1 13 13 ALA H H 728 7.970 7.970 8.496 -0.526 17931
2094 1 10 . 1 1 14 14 LYS N N 729 117.588 117.588 118.519 -0.931 17931
2095 1 10 . 1 1 14 14 LYS HA H 729 4.096 4.096 3.976 0.120 17931
2096 1 10 . 1 1 14 14 LYS C C 729 177.664 177.664 178.704 -1.040 17931
2097 1 10 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.466 -1.536 17931
2098 1 10 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.979 -1.464 17931
2099 1 10 . 1 1 14 14 LYS H H 729 7.792 7.792 7.777 0.015 17931
2100 1 10 . 1 1 15 15 PHE N N 730 119.916 119.916 117.655 2.261 17931
2101 1 10 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.351 0.028 17931
2102 1 10 . 1 1 15 15 PHE C C 730 176.732 176.732 178.350 -1.618 17931
2103 1 10 . 1 1 15 15 PHE CA C 730 59.753 59.753 59.013 0.740 17931
2104 1 10 . 1 1 15 15 PHE CB C 730 39.010 39.010 38.803 0.207 17931
2105 1 10 . 1 1 15 15 PHE H H 730 7.874 7.874 7.430 0.444 17931
2106 1 10 . 1 1 16 16 GLU N N 731 119.398 119.398 119.381 0.017 17931
2107 1 10 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.888 0.177 17931
2108 1 10 . 1 1 16 16 GLU C C 731 177.920 177.920 178.620 -0.700 17931
2109 1 10 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.450 -1.625 17931
2110 1 10 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.655 0.694 17931
2111 1 10 . 1 1 16 16 GLU H H 731 8.178 8.178 7.800 0.378 17931
2112 1 10 . 1 1 17 17 GLU N N 732 120.386 120.386 119.861 0.525 17931
2113 1 10 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.904 0.146 17931
2114 1 10 . 1 1 17 17 GLU C C 732 178.097 178.097 179.159 -1.062 17931
2115 1 10 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.346 -1.039 17931
2116 1 10 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.416 -0.028 17931
2117 1 10 . 1 1 17 17 GLU H H 732 8.117 8.117 8.460 -0.343 17931
2118 1 10 . 1 1 18 18 GLU N N 733 119.473 119.473 118.970 0.503 17931
2119 1 10 . 1 1 18 18 GLU HA H 733 4.056 4.056 4.060 -0.004 17931
2120 1 10 . 1 1 18 18 GLU C C 733 177.228 177.228 178.662 -1.434 17931
2121 1 10 . 1 1 18 18 GLU CA C 733 58.298 58.298 59.283 -0.985 17931
2122 1 10 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.405 0.042 17931
2123 1 10 . 1 1 18 18 GLU H H 733 8.130 8.130 7.752 0.378 17931
2124 1 10 . 1 1 19 19 ARG N N 734 118.929 118.929 119.440 -0.511 17931
2125 1 10 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.228 -0.199 17931
2126 1 10 . 1 1 19 19 ARG C C 734 177.402 177.402 177.778 -0.376 17931
2127 1 10 . 1 1 19 19 ARG CA C 734 58.400 58.400 58.275 0.125 17931
2128 1 10 . 1 1 19 19 ARG CB C 734 32.170 32.170 29.997 2.173 17931
2129 1 10 . 1 1 19 19 ARG H H 734 8.032 8.032 7.676 0.356 17931
2130 1 10 . 1 1 20 20 ALA N N 735 121.514 121.514 120.851 0.663 17931
2131 1 10 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.285 -0.156 17931
2132 1 10 . 1 1 20 20 ALA C C 735 179.108 179.108 179.227 -0.119 17931
2133 1 10 . 1 1 20 20 ALA CA C 735 53.559 53.559 54.544 -0.985 17931
2134 1 10 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.816 -0.255 17931
2135 1 10 . 1 1 20 20 ALA H H 735 7.853 7.853 8.559 -0.706 17931
2136 1 10 . 1 1 21 21 ARG N N 736 117.944 117.944 119.150 -1.206 17931
2137 1 10 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.120 -0.010 17931
2138 1 10 . 1 1 21 21 ARG C C 736 176.643 176.643 178.097 -1.454 17931
2139 1 10 . 1 1 21 21 ARG CA C 736 56.737 56.737 58.429 -1.692 17931
2140 1 10 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.187 0.386 17931
2141 1 10 . 1 1 21 21 ARG H H 736 7.850 7.850 8.074 -0.224 17931
2142 1 10 . 1 1 22 22 ALA N N 737 122.381 122.381 120.934 1.447 17931
2143 1 10 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.207 -0.056 17931
2144 1 10 . 1 1 22 22 ALA C C 737 177.640 177.640 178.498 -0.858 17931
2145 1 10 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.411 -1.641 17931
2146 1 10 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.683 0.063 17931
2147 1 10 . 1 1 22 22 ALA H H 737 7.776 7.776 7.978 -0.202 17931
2148 1 10 . 1 1 23 23 LYS N N 738 118.327 118.327 114.684 3.643 17931
2149 1 10 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.385 -0.226 17931
2150 1 10 . 1 1 23 23 LYS C C 738 176.483 176.483 176.638 -0.155 17931
2151 1 10 . 1 1 23 23 LYS CA C 738 56.468 56.468 57.222 -0.754 17931
2152 1 10 . 1 1 23 23 LYS CB C 738 32.526 32.526 34.948 -2.422 17931
2153 1 10 . 1 1 23 23 LYS H H 738 7.838 7.838 7.760 0.078 17931
2154 1 10 . 1 1 24 24 TRP N N 739 120.598 120.598 121.496 -0.898 17931
2155 1 10 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.996 -0.395 17931
2156 1 10 . 1 1 24 24 TRP C C 739 175.904 175.904 175.419 0.485 17931
2157 1 10 . 1 1 24 24 TRP CA C 739 56.947 56.947 55.871 1.076 17931
2158 1 10 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.160 0.361 17931
2159 1 10 . 1 1 24 24 TRP H H 739 7.958 7.958 8.760 -0.802 17931
2160 1 10 . 1 1 25 25 ASP N N 740 121.214 121.214 121.040 0.174 17931
2161 1 10 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.379 -0.228 17931
2162 1 10 . 1 1 25 25 ASP C C 740 176.626 176.626 177.404 -0.778 17931
2163 1 10 . 1 1 25 25 ASP CA C 740 54.173 54.173 57.156 -2.983 17931
2164 1 10 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.376 0.595 17931
2165 1 10 . 1 1 25 25 ASP H H 740 8.248 8.248 8.335 -0.087 17931
2166 1 10 . 1 1 26 26 THR N N 741 113.708 113.708 114.913 -1.205 17931
2167 1 10 . 1 1 26 26 THR HA H 741 4.221 4.221 4.068 0.153 17931
2168 1 10 . 1 1 26 26 THR C C 741 174.851 174.851 174.965 -0.114 17931
2169 1 10 . 1 1 26 26 THR CA C 741 62.439 62.439 66.003 -3.564 17931
2170 1 10 . 1 1 26 26 THR CB C 741 69.255 69.255 68.754 0.501 17931
2171 1 10 . 1 1 26 26 THR H H 741 7.945 7.945 8.376 -0.431 17931
2172 1 10 . 1 1 27 27 ALA N N 742 124.543 124.543 121.162 3.381 17931
2173 1 10 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.363 -0.167 17931
2174 1 10 . 1 1 27 27 ALA C C 742 177.509 177.509 178.644 -1.135 17931
2175 1 10 . 1 1 27 27 ALA CA C 742 52.953 52.953 53.790 -0.837 17931
2176 1 10 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.700 -0.751 17931
2177 1 10 . 1 1 27 27 ALA H H 742 8.113 8.113 7.775 0.338 17931
2178 1 10 . 1 1 28 28 ASN N N 743 116.039 116.039 114.458 1.581 17931
2179 1 10 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.732 -0.133 17931
2180 1 10 . 1 1 28 28 ASN C C 743 174.330 174.330 174.930 -0.600 17931
2181 1 10 . 1 1 28 28 ASN CA C 743 52.868 52.868 54.754 -1.886 17931
2182 1 10 . 1 1 28 28 ASN CB C 743 38.995 38.995 40.404 -1.409 17931
2183 1 10 . 1 1 28 28 ASN H H 743 8.055 8.055 8.058 -0.003 17931
2184 1 10 . 1 1 29 29 ASN N N 744 119.625 119.625 119.350 0.275 17931
2185 1 10 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.019 -0.411 17931
2186 1 10 . 1 1 29 29 ASN CA C 744 50.940 50.940 51.532 -0.592 17931
2187 1 10 . 1 1 29 29 ASN CB C 744 38.798 38.798 39.507 -0.709 17931
2188 1 10 . 1 1 29 29 ASN H H 744 8.015 8.015 7.609 0.406 17931
2189 1 10 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.345 0.027 17931
2190 1 10 . 1 1 30 30 PRO C C 745 177.196 177.196 176.958 0.238 17931
2191 1 10 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.386 -0.803 17931
2192 1 10 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.278 -0.390 17931
2193 1 10 . 1 1 34 34 GLU N N 749 121.140 121.140 119.574 1.566 17931
2194 1 10 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.119 0.087 17931
2195 1 10 . 1 1 34 34 GLU C C 749 176.764 176.764 176.435 0.329 17931
2196 1 10 . 1 1 34 34 GLU CA C 749 56.698 56.698 58.384 -1.686 17931
2197 1 10 . 1 1 34 34 GLU CB C 749 29.784 29.784 30.012 -0.228 17931
2198 1 10 . 1 1 34 34 GLU H H 749 8.215 8.215 8.681 -0.466 17931
2199 1 10 . 1 1 35 35 ALA N N 750 124.506 124.506 121.774 2.732 17931
2200 1 10 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.683 -0.407 17931
2201 1 10 . 1 1 35 35 ALA C C 750 178.054 178.054 176.648 1.406 17931
2202 1 10 . 1 1 35 35 ALA CA C 750 53.011 53.011 50.868 2.143 17931
2203 1 10 . 1 1 35 35 ALA CB C 750 19.021 19.021 18.633 0.389 17931
2204 1 10 . 1 1 35 35 ALA H H 750 8.335 8.335 7.690 0.645 17931
2205 1 10 . 1 1 36 36 THR N N 751 111.925 111.925 115.402 -3.477 17931
2206 1 10 . 1 1 36 36 THR HA H 751 4.225 4.225 3.869 0.356 17931
2207 1 10 . 1 1 36 36 THR C C 751 175.137 175.137 176.231 -1.094 17931
2208 1 10 . 1 1 36 36 THR CA C 751 62.508 62.508 66.180 -3.672 17931
2209 1 10 . 1 1 36 36 THR CB C 751 69.600 69.600 68.430 1.170 17931
2210 1 10 . 1 1 36 36 THR H H 751 8.007 8.007 7.877 0.130 17931
2211 1 10 . 1 1 37 37 SER N N 752 117.676 117.676 113.871 3.805 17931
2212 1 10 . 1 1 37 37 SER HA H 752 4.567 4.567 4.227 0.340 17931
2213 1 10 . 1 1 37 37 SER C C 752 174.881 174.881 175.913 -1.032 17931
2214 1 10 . 1 1 37 37 SER CA C 752 58.856 58.856 60.708 -1.852 17931
2215 1 10 . 1 1 37 37 SER CB C 752 63.705 63.705 62.722 0.983 17931
2216 1 10 . 1 1 37 37 SER H H 752 8.156 8.156 8.368 -0.212 17931
2217 1 10 . 1 1 38 38 THR N N 753 116.343 116.343 115.930 0.413 17931
2218 1 10 . 1 1 38 38 THR HA H 753 4.126 4.126 4.342 -0.216 17931
2219 1 10 . 1 1 38 38 THR C C 753 174.555 174.555 174.225 0.330 17931
2220 1 10 . 1 1 38 38 THR CA C 753 62.889 62.889 63.483 -0.594 17931
2221 1 10 . 1 1 38 38 THR CB C 753 69.292 69.292 69.998 -0.706 17931
2222 1 10 . 1 1 38 38 THR H H 753 8.042 8.042 7.548 0.494 17931
2223 1 10 . 1 1 39 39 PHE N N 754 120.983 120.983 117.062 3.921 17931
2224 1 10 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.930 -0.363 17931
2225 1 10 . 1 1 39 39 PHE C C 754 175.956 175.956 173.941 2.015 17931
2226 1 10 . 1 1 39 39 PHE CA C 754 58.289 58.289 56.592 1.698 17931
2227 1 10 . 1 1 39 39 PHE CB C 754 39.222 39.222 40.015 -0.793 17931
2228 1 10 . 1 1 39 39 PHE H H 754 8.163 8.163 7.983 0.180 17931
2229 1 10 . 1 1 40 40 THR N N 755 114.474 114.474 119.183 -4.709 17931
2230 1 10 . 1 1 40 40 THR HA H 755 4.159 4.159 4.181 -0.022 17931
2231 1 10 . 1 1 40 40 THR C C 755 174.168 174.168 173.483 0.685 17931
2232 1 10 . 1 1 40 40 THR CA C 755 62.446 62.446 64.054 -1.608 17931
2233 1 10 . 1 1 40 40 THR CB C 755 69.403 69.403 69.638 -0.235 17931
2234 1 10 . 1 1 40 40 THR H H 755 7.943 7.943 8.373 -0.430 17931
2235 1 10 . 1 1 41 41 ASN N N 756 120.598 120.598 116.872 3.726 17931
2236 1 10 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.955 -0.356 17931
2237 1 10 . 1 1 41 41 ASN C C 756 175.438 175.438 174.859 0.579 17931
2238 1 10 . 1 1 41 41 ASN CA C 756 53.625 53.625 53.505 0.120 17931
2239 1 10 . 1 1 41 41 ASN CB C 756 38.852 38.852 39.331 -0.479 17931
2240 1 10 . 1 1 41 41 ASN H H 756 8.254 8.254 8.065 0.189 17931
2241 1 10 . 1 1 42 42 ILE N N 757 119.988 119.988 124.363 -4.375 17931
2242 1 10 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.261 -0.128 17931
2243 1 10 . 1 1 42 42 ILE C C 757 176.180 176.180 176.849 -0.669 17931
2244 1 10 . 1 1 42 42 ILE CA C 757 61.607 61.607 62.303 -0.696 17931
2245 1 10 . 1 1 42 42 ILE CB C 757 38.526 38.526 38.267 0.259 17931
2246 1 10 . 1 1 42 42 ILE H H 757 7.988 7.988 8.569 -0.581 17931
2247 1 10 . 1 1 46 46 GLY N N 761 109.795 109.795 110.557 -0.762 17931
2248 1 10 . 1 1 46 46 GLY C C 761 173.400 173.400 173.775 -0.375 17931
2249 1 10 . 1 1 46 46 GLY CA C 761 45.241 45.241 45.173 0.068 17931
2250 1 10 . 1 1 46 46 GLY H H 761 8.038 8.038 8.776 -0.738 17931
2251 1 11 . 1 1 2 2 LEU N N 717 120.100 120.100 122.403 -2.303 17931
2252 1 11 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.358 -0.228 17931
2253 1 11 . 1 1 2 2 LEU C C 717 177.505 177.505 177.753 -0.248 17931
2254 1 11 . 1 1 2 2 LEU CA C 717 56.674 56.674 57.160 -0.486 17931
2255 1 11 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.463 0.390 17931
2256 1 11 . 1 1 2 2 LEU H H 717 7.866 7.866 7.978 -0.112 17931
2257 1 11 . 1 1 3 3 LEU N N 718 118.481 118.481 118.889 -0.408 17931
2258 1 11 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.114 -0.057 17931
2259 1 11 . 1 1 3 3 LEU C C 718 177.643 177.643 179.123 -1.480 17931
2260 1 11 . 1 1 3 3 LEU CA C 718 56.943 56.943 58.156 -1.213 17931
2261 1 11 . 1 1 3 3 LEU CB C 718 41.735 41.735 40.894 0.841 17931
2262 1 11 . 1 1 3 3 LEU H H 718 7.746 7.746 7.921 -0.175 17931
2263 1 11 . 1 1 4 4 ILE N N 719 116.207 116.207 116.769 -0.562 17931
2264 1 11 . 1 1 4 4 ILE HA H 719 3.911 3.911 3.865 0.046 17931
2265 1 11 . 1 1 4 4 ILE C C 719 176.774 176.774 178.784 -2.010 17931
2266 1 11 . 1 1 4 4 ILE CA C 719 62.960 62.960 63.120 -0.160 17931
2267 1 11 . 1 1 4 4 ILE CB C 719 38.219 38.219 37.021 1.198 17931
2268 1 11 . 1 1 4 4 ILE H H 719 7.724 7.724 7.708 0.016 17931
2269 1 11 . 1 1 5 5 THR N N 720 114.581 114.581 116.747 -2.166 17931
2270 1 11 . 1 1 5 5 THR HA H 720 4.161 4.161 4.073 0.088 17931
2271 1 11 . 1 1 5 5 THR C C 720 175.458 175.458 176.476 -1.018 17931
2272 1 11 . 1 1 5 5 THR CA C 720 64.390 64.390 66.104 -1.714 17931
2273 1 11 . 1 1 5 5 THR CB C 720 69.052 69.052 68.742 0.310 17931
2274 1 11 . 1 1 5 5 THR H H 720 7.802 7.802 8.244 -0.442 17931
2275 1 11 . 1 1 6 6 ILE N N 721 119.805 119.805 120.064 -0.259 17931
2276 1 11 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.770 0.139 17931
2277 1 11 . 1 1 6 6 ILE C C 721 176.102 176.102 177.571 -1.469 17931
2278 1 11 . 1 1 6 6 ILE CA C 721 63.025 63.025 63.821 -0.796 17931
2279 1 11 . 1 1 6 6 ILE CB C 721 38.104 38.104 36.767 1.337 17931
2280 1 11 . 1 1 6 6 ILE H H 721 7.751 7.751 7.756 -0.005 17931
2281 1 11 . 1 1 7 7 HIS N N 722 118.760 118.760 116.897 1.863 17931
2282 1 11 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.423 0.192 17931
2283 1 11 . 1 1 7 7 HIS C C 722 174.538 174.538 176.993 -2.455 17931
2284 1 11 . 1 1 7 7 HIS CA C 722 57.344 57.344 59.122 -1.778 17931
2285 1 11 . 1 1 7 7 HIS CB C 722 29.375 29.375 30.151 -0.776 17931
2286 1 11 . 1 1 7 7 HIS H H 722 8.097 8.097 7.948 0.149 17931
2287 1 11 . 1 1 8 8 ASP N N 723 117.884 117.884 117.582 0.302 17931
2288 1 11 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.919 -0.325 17931
2289 1 11 . 1 1 8 8 ASP C C 723 176.829 176.829 177.012 -0.183 17931
2290 1 11 . 1 1 8 8 ASP CA C 723 54.176 54.176 55.098 -0.922 17931
2291 1 11 . 1 1 8 8 ASP CB C 723 41.500 41.500 41.420 0.080 17931
2292 1 11 . 1 1 8 8 ASP H H 723 7.969 7.969 7.671 0.298 17931
2293 1 11 . 1 1 9 9 ARG N N 724 121.014 121.014 119.503 1.511 17931
2294 1 11 . 1 1 9 9 ARG HA H 724 4.204 4.204 3.995 0.209 17931
2295 1 11 . 1 1 9 9 ARG C C 724 177.662 177.662 177.587 0.075 17931
2296 1 11 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.621 -2.802 17931
2297 1 11 . 1 1 9 9 ARG CB C 724 32.703 32.703 29.675 3.028 17931
2298 1 11 . 1 1 9 9 ARG H H 724 8.216 8.216 7.959 0.257 17931
2299 1 11 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.119 0.016 17931
2300 1 11 . 1 1 10 10 LYS C C 725 178.127 178.127 177.894 0.233 17931
2301 1 11 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.311 -0.564 17931
2302 1 11 . 1 1 10 10 LYS CB C 725 32.190 32.190 31.936 0.254 17931
2303 1 11 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.359 -0.263 17931
2304 1 11 . 1 1 11 11 GLU C C 726 177.791 177.791 178.493 -0.702 17931
2305 1 11 . 1 1 11 11 GLU CA C 726 58.406 58.406 58.244 0.162 17931
2306 1 11 . 1 1 11 11 GLU CB C 726 29.340 29.340 30.264 -0.924 17931
2307 1 11 . 1 1 12 12 PHE N N 727 118.859 118.859 119.971 -1.112 17931
2308 1 11 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.760 -0.382 17931
2309 1 11 . 1 1 12 12 PHE C C 727 176.439 176.439 177.692 -1.253 17931
2310 1 11 . 1 1 12 12 PHE CA C 727 59.332 59.332 60.101 -0.769 17931
2311 1 11 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.577 -0.417 17931
2312 1 11 . 1 1 12 12 PHE H H 727 7.922 7.922 8.553 -0.631 17931
2313 1 11 . 1 1 13 13 ALA N N 728 122.111 122.111 122.562 -0.451 17931
2314 1 11 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.558 0.600 17931
2315 1 11 . 1 1 13 13 ALA C C 728 178.542 178.542 178.971 -0.429 17931
2316 1 11 . 1 1 13 13 ALA CA C 728 54.083 54.083 55.057 -0.974 17931
2317 1 11 . 1 1 13 13 ALA CB C 728 18.409 18.409 17.817 0.592 17931
2318 1 11 . 1 1 13 13 ALA H H 728 7.970 7.970 7.779 0.191 17931
2319 1 11 . 1 1 14 14 LYS N N 729 117.588 117.588 118.682 -1.094 17931
2320 1 11 . 1 1 14 14 LYS HA H 729 4.096 4.096 4.139 -0.043 17931
2321 1 11 . 1 1 14 14 LYS C C 729 177.664 177.664 178.723 -1.059 17931
2322 1 11 . 1 1 14 14 LYS CA C 729 56.930 56.930 57.979 -1.049 17931
2323 1 11 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.647 -1.132 17931
2324 1 11 . 1 1 14 14 LYS H H 729 7.792 7.792 7.735 0.057 17931
2325 1 11 . 1 1 15 15 PHE N N 730 119.916 119.916 117.860 2.056 17931
2326 1 11 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.173 0.206 17931
2327 1 11 . 1 1 15 15 PHE C C 730 176.732 176.732 178.240 -1.508 17931
2328 1 11 . 1 1 15 15 PHE CA C 730 59.753 59.753 61.890 -2.137 17931
2329 1 11 . 1 1 15 15 PHE CB C 730 39.010 39.010 38.733 0.277 17931
2330 1 11 . 1 1 15 15 PHE H H 730 7.874 7.874 7.766 0.108 17931
2331 1 11 . 1 1 16 16 GLU N N 731 119.398 119.398 119.067 0.331 17931
2332 1 11 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.996 0.069 17931
2333 1 11 . 1 1 16 16 GLU C C 731 177.920 177.920 178.687 -0.767 17931
2334 1 11 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.206 -1.381 17931
2335 1 11 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.604 0.745 17931
2336 1 11 . 1 1 16 16 GLU H H 731 8.178 8.178 8.270 -0.092 17931
2337 1 11 . 1 1 17 17 GLU N N 732 120.386 120.386 119.883 0.503 17931
2338 1 11 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.947 0.103 17931
2339 1 11 . 1 1 17 17 GLU C C 732 178.097 178.097 178.944 -0.847 17931
2340 1 11 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.350 -1.044 17931
2341 1 11 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.390 -0.002 17931
2342 1 11 . 1 1 17 17 GLU H H 732 8.117 8.117 8.471 -0.354 17931
2343 1 11 . 1 1 18 18 GLU N N 733 119.473 119.473 119.238 0.235 17931
2344 1 11 . 1 1 18 18 GLU HA H 733 4.056 4.056 4.017 0.039 17931
2345 1 11 . 1 1 18 18 GLU C C 733 177.228 177.228 178.907 -1.679 17931
2346 1 11 . 1 1 18 18 GLU CA C 733 58.298 58.298 59.378 -1.080 17931
2347 1 11 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.305 0.142 17931
2348 1 11 . 1 1 18 18 GLU H H 733 8.130 8.130 7.617 0.513 17931
2349 1 11 . 1 1 19 19 ARG N N 734 118.929 118.929 118.020 0.909 17931
2350 1 11 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.249 -0.220 17931
2351 1 11 . 1 1 19 19 ARG C C 734 177.402 177.402 178.517 -1.115 17931
2352 1 11 . 1 1 19 19 ARG CA C 734 58.400 58.400 57.619 0.781 17931
2353 1 11 . 1 1 19 19 ARG CB C 734 32.170 32.170 29.633 2.537 17931
2354 1 11 . 1 1 19 19 ARG H H 734 8.032 8.032 7.810 0.222 17931
2355 1 11 . 1 1 20 20 ALA N N 735 121.514 121.514 122.215 -0.701 17931
2356 1 11 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.173 -0.044 17931
2357 1 11 . 1 1 20 20 ALA C C 735 179.108 179.108 179.659 -0.551 17931
2358 1 11 . 1 1 20 20 ALA CA C 735 53.559 53.559 54.945 -1.386 17931
2359 1 11 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.521 0.040 17931
2360 1 11 . 1 1 20 20 ALA H H 735 7.853 7.853 8.400 -0.547 17931
2361 1 11 . 1 1 21 21 ARG N N 736 117.944 117.944 118.518 -0.574 17931
2362 1 11 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.136 -0.026 17931
2363 1 11 . 1 1 21 21 ARG C C 736 176.643 176.643 177.603 -0.960 17931
2364 1 11 . 1 1 21 21 ARG CA C 736 56.737 56.737 57.750 -1.013 17931
2365 1 11 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.473 0.100 17931
2366 1 11 . 1 1 21 21 ARG H H 736 7.850 7.850 8.562 -0.712 17931
2367 1 11 . 1 1 22 22 ALA N N 737 122.381 122.381 120.155 2.226 17931
2368 1 11 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.160 -0.009 17931
2369 1 11 . 1 1 22 22 ALA C C 737 177.640 177.640 178.129 -0.489 17931
2370 1 11 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.064 -1.294 17931
2371 1 11 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.819 -0.072 17931
2372 1 11 . 1 1 22 22 ALA H H 737 7.776 7.776 7.622 0.154 17931
2373 1 11 . 1 1 23 23 LYS N N 738 118.327 118.327 113.999 4.328 17931
2374 1 11 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.333 -0.174 17931
2375 1 11 . 1 1 23 23 LYS C C 738 176.483 176.483 176.260 0.223 17931
2376 1 11 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.528 -0.060 17931
2377 1 11 . 1 1 23 23 LYS CB C 738 32.526 32.526 33.757 -1.231 17931
2378 1 11 . 1 1 23 23 LYS H H 738 7.838 7.838 7.726 0.112 17931
2379 1 11 . 1 1 24 24 TRP N N 739 120.598 120.598 121.331 -0.733 17931
2380 1 11 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.981 -0.380 17931
2381 1 11 . 1 1 24 24 TRP C C 739 175.904 175.904 175.796 0.108 17931
2382 1 11 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.248 0.699 17931
2383 1 11 . 1 1 24 24 TRP CB C 739 29.521 29.521 28.946 0.575 17931
2384 1 11 . 1 1 24 24 TRP H H 739 7.958 7.958 7.904 0.054 17931
2385 1 11 . 1 1 25 25 ASP N N 740 121.214 121.214 122.717 -1.503 17931
2386 1 11 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.244 -0.093 17931
2387 1 11 . 1 1 25 25 ASP C C 740 176.626 176.626 177.948 -1.322 17931
2388 1 11 . 1 1 25 25 ASP CA C 740 54.173 54.173 58.373 -4.200 17931
2389 1 11 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.605 0.366 17931
2390 1 11 . 1 1 25 25 ASP H H 740 8.248 8.248 8.401 -0.153 17931
2391 1 11 . 1 1 26 26 THR N N 741 113.708 113.708 111.376 2.332 17931
2392 1 11 . 1 1 26 26 THR HA H 741 4.221 4.221 4.140 0.081 17931
2393 1 11 . 1 1 26 26 THR C C 741 174.851 174.851 174.759 0.092 17931
2394 1 11 . 1 1 26 26 THR CA C 741 62.439 62.439 63.940 -1.501 17931
2395 1 11 . 1 1 26 26 THR CB C 741 69.255 69.255 68.754 0.501 17931
2396 1 11 . 1 1 26 26 THR H H 741 7.945 7.945 8.146 -0.201 17931
2397 1 11 . 1 1 27 27 ALA N N 742 124.543 124.543 122.070 2.473 17931
2398 1 11 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.376 -0.180 17931
2399 1 11 . 1 1 27 27 ALA C C 742 177.509 177.509 178.944 -1.435 17931
2400 1 11 . 1 1 27 27 ALA CA C 742 52.953 52.953 53.914 -0.961 17931
2401 1 11 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.545 -0.596 17931
2402 1 11 . 1 1 27 27 ALA H H 742 8.113 8.113 7.529 0.584 17931
2403 1 11 . 1 1 28 28 ASN N N 743 116.039 116.039 116.375 -0.336 17931
2404 1 11 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.588 0.011 17931
2405 1 11 . 1 1 28 28 ASN C C 743 174.330 174.330 175.701 -1.371 17931
2406 1 11 . 1 1 28 28 ASN CA C 743 52.868 52.868 55.475 -2.607 17931
2407 1 11 . 1 1 28 28 ASN CB C 743 38.995 38.995 39.426 -0.431 17931
2408 1 11 . 1 1 28 28 ASN H H 743 8.055 8.055 8.564 -0.509 17931
2409 1 11 . 1 1 29 29 ASN N N 744 119.625 119.625 117.898 1.727 17931
2410 1 11 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.119 -0.511 17931
2411 1 11 . 1 1 29 29 ASN CA C 744 50.940 50.940 51.023 -0.083 17931
2412 1 11 . 1 1 29 29 ASN CB C 744 38.798 38.798 40.528 -1.730 17931
2413 1 11 . 1 1 29 29 ASN H H 744 8.015 8.015 7.484 0.531 17931
2414 1 11 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.347 0.025 17931
2415 1 11 . 1 1 30 30 PRO C C 745 177.196 177.196 176.854 0.342 17931
2416 1 11 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.564 -0.981 17931
2417 1 11 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.206 -0.318 17931
2418 1 11 . 1 1 34 34 GLU N N 749 121.140 121.140 119.719 1.421 17931
2419 1 11 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.179 0.027 17931
2420 1 11 . 1 1 34 34 GLU C C 749 176.764 176.764 176.449 0.315 17931
2421 1 11 . 1 1 34 34 GLU CA C 749 56.698 56.698 58.420 -1.722 17931
2422 1 11 . 1 1 34 34 GLU CB C 749 29.784 29.784 29.948 -0.164 17931
2423 1 11 . 1 1 34 34 GLU H H 749 8.215 8.215 8.902 -0.687 17931
2424 1 11 . 1 1 35 35 ALA N N 750 124.506 124.506 122.994 1.512 17931
2425 1 11 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.732 -0.456 17931
2426 1 11 . 1 1 35 35 ALA C C 750 178.054 178.054 177.145 0.909 17931
2427 1 11 . 1 1 35 35 ALA CA C 750 53.011 53.011 50.999 2.012 17931
2428 1 11 . 1 1 35 35 ALA CB C 750 19.021 19.021 18.872 0.149 17931
2429 1 11 . 1 1 35 35 ALA H H 750 8.335 8.335 8.173 0.162 17931
2430 1 11 . 1 1 36 36 THR N N 751 111.925 111.925 117.243 -5.318 17931
2431 1 11 . 1 1 36 36 THR HA H 751 4.225 4.225 4.148 0.077 17931
2432 1 11 . 1 1 36 36 THR C C 751 175.137 175.137 175.800 -0.663 17931
2433 1 11 . 1 1 36 36 THR CA C 751 62.508 62.508 66.392 -3.884 17931
2434 1 11 . 1 1 36 36 THR CB C 751 69.600 69.600 68.550 1.050 17931
2435 1 11 . 1 1 36 36 THR H H 751 8.007 8.007 8.670 -0.663 17931
2436 1 11 . 1 1 37 37 SER N N 752 117.676 117.676 115.756 1.920 17931
2437 1 11 . 1 1 37 37 SER HA H 752 4.567 4.567 4.514 0.053 17931
2438 1 11 . 1 1 37 37 SER C C 752 174.881 174.881 175.992 -1.111 17931
2439 1 11 . 1 1 37 37 SER CA C 752 58.856 58.856 61.345 -2.489 17931
2440 1 11 . 1 1 37 37 SER CB C 752 63.705 63.705 62.200 1.506 17931
2441 1 11 . 1 1 37 37 SER H H 752 8.156 8.156 8.396 -0.240 17931
2442 1 11 . 1 1 38 38 THR N N 753 116.343 116.343 112.948 3.395 17931
2443 1 11 . 1 1 38 38 THR HA H 753 4.126 4.126 4.028 0.098 17931
2444 1 11 . 1 1 38 38 THR C C 753 174.555 174.555 175.249 -0.694 17931
2445 1 11 . 1 1 38 38 THR CA C 753 62.889 62.889 64.327 -1.438 17931
2446 1 11 . 1 1 38 38 THR CB C 753 69.292 69.292 68.779 0.513 17931
2447 1 11 . 1 1 38 38 THR H H 753 8.042 8.042 7.918 0.124 17931
2448 1 11 . 1 1 39 39 PHE N N 754 120.983 120.983 121.410 -0.427 17931
2449 1 11 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.721 -0.154 17931
2450 1 11 . 1 1 39 39 PHE C C 754 175.956 175.956 175.927 0.029 17931
2451 1 11 . 1 1 39 39 PHE CA C 754 58.289 58.289 59.261 -0.972 17931
2452 1 11 . 1 1 39 39 PHE CB C 754 39.222 39.222 40.715 -1.493 17931
2453 1 11 . 1 1 39 39 PHE H H 754 8.163 8.163 7.820 0.343 17931
2454 1 11 . 1 1 40 40 THR N N 755 114.474 114.474 113.289 1.185 17931
2455 1 11 . 1 1 40 40 THR HA H 755 4.159 4.159 4.576 -0.417 17931
2456 1 11 . 1 1 40 40 THR C C 755 174.168 174.168 174.179 -0.011 17931
2457 1 11 . 1 1 40 40 THR CA C 755 62.446 62.446 60.876 1.571 17931
2458 1 11 . 1 1 40 40 THR CB C 755 69.403 69.403 70.503 -1.100 17931
2459 1 11 . 1 1 40 40 THR H H 755 7.943 7.943 8.442 -0.499 17931
2460 1 11 . 1 1 41 41 ASN N N 756 120.598 120.598 122.566 -1.968 17931
2461 1 11 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.484 0.115 17931
2462 1 11 . 1 1 41 41 ASN C C 756 175.438 175.438 175.295 0.143 17931
2463 1 11 . 1 1 41 41 ASN CA C 756 53.625 53.625 54.845 -1.220 17931
2464 1 11 . 1 1 41 41 ASN CB C 756 38.852 38.852 38.696 0.156 17931
2465 1 11 . 1 1 41 41 ASN H H 756 8.254 8.254 8.768 -0.514 17931
2466 1 11 . 1 1 42 42 ILE N N 757 119.988 119.988 120.803 -0.815 17931
2467 1 11 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.201 -0.068 17931
2468 1 11 . 1 1 42 42 ILE C C 757 176.180 176.180 175.839 0.341 17931
2469 1 11 . 1 1 42 42 ILE CA C 757 61.607 61.607 61.151 0.456 17931
2470 1 11 . 1 1 42 42 ILE CB C 757 38.526 38.526 38.450 0.076 17931
2471 1 11 . 1 1 42 42 ILE H H 757 7.988 7.988 7.725 0.263 17931
2472 1 11 . 1 1 46 46 GLY N N 761 109.795 109.795 113.570 -3.775 17931
2473 1 11 . 1 1 46 46 GLY C C 761 173.400 173.400 174.058 -0.658 17931
2474 1 11 . 1 1 46 46 GLY CA C 761 45.241 45.241 44.808 0.433 17931
2475 1 11 . 1 1 46 46 GLY H H 761 8.038 8.038 8.702 -0.664 17931
2476 1 12 . 1 1 2 2 LEU N N 717 120.100 120.100 122.812 -2.712 17931
2477 1 12 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.372 -0.242 17931
2478 1 12 . 1 1 2 2 LEU C C 717 177.505 177.505 177.912 -0.407 17931
2479 1 12 . 1 1 2 2 LEU CA C 717 56.674 56.674 56.811 -0.137 17931
2480 1 12 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.496 0.357 17931
2481 1 12 . 1 1 2 2 LEU H H 717 7.866 7.866 7.990 -0.124 17931
2482 1 12 . 1 1 3 3 LEU N N 718 118.481 118.481 117.937 0.544 17931
2483 1 12 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.020 0.037 17931
2484 1 12 . 1 1 3 3 LEU C C 718 177.643 177.643 178.291 -0.648 17931
2485 1 12 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.588 -0.645 17931
2486 1 12 . 1 1 3 3 LEU CB C 718 41.735 41.735 41.170 0.565 17931
2487 1 12 . 1 1 3 3 LEU H H 718 7.746 7.746 7.915 -0.169 17931
2488 1 12 . 1 1 4 4 ILE N N 719 116.207 116.207 116.594 -0.387 17931
2489 1 12 . 1 1 4 4 ILE HA H 719 3.911 3.911 4.064 -0.153 17931
2490 1 12 . 1 1 4 4 ILE C C 719 176.774 176.774 178.891 -2.117 17931
2491 1 12 . 1 1 4 4 ILE CA C 719 62.960 62.960 63.206 -0.246 17931
2492 1 12 . 1 1 4 4 ILE CB C 719 38.219 38.219 36.878 1.341 17931
2493 1 12 . 1 1 4 4 ILE H H 719 7.724 7.724 7.607 0.117 17931
2494 1 12 . 1 1 5 5 THR N N 720 114.581 114.581 117.221 -2.640 17931
2495 1 12 . 1 1 5 5 THR HA H 720 4.161 4.161 4.155 0.006 17931
2496 1 12 . 1 1 5 5 THR C C 720 175.458 175.458 176.561 -1.103 17931
2497 1 12 . 1 1 5 5 THR CA C 720 64.390 64.390 65.588 -1.198 17931
2498 1 12 . 1 1 5 5 THR CB C 720 69.052 69.052 68.069 0.983 17931
2499 1 12 . 1 1 5 5 THR H H 720 7.802 7.802 8.278 -0.476 17931
2500 1 12 . 1 1 6 6 ILE N N 721 119.805 119.805 121.935 -2.130 17931
2501 1 12 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.616 0.292 17931
2502 1 12 . 1 1 6 6 ILE C C 721 176.102 176.102 177.787 -1.685 17931
2503 1 12 . 1 1 6 6 ILE CA C 721 63.025 63.025 65.611 -2.586 17931
2504 1 12 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.426 0.678 17931
2505 1 12 . 1 1 6 6 ILE H H 721 7.751 7.751 7.758 -0.007 17931
2506 1 12 . 1 1 7 7 HIS N N 722 118.760 118.760 119.406 -0.646 17931
2507 1 12 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.317 0.298 17931
2508 1 12 . 1 1 7 7 HIS C C 722 174.538 174.538 176.386 -1.848 17931
2509 1 12 . 1 1 7 7 HIS CA C 722 57.344 57.344 60.192 -2.848 17931
2510 1 12 . 1 1 7 7 HIS CB C 722 29.375 29.375 30.127 -0.752 17931
2511 1 12 . 1 1 7 7 HIS H H 722 8.097 8.097 7.769 0.328 17931
2512 1 12 . 1 1 8 8 ASP N N 723 117.884 117.884 118.156 -0.272 17931
2513 1 12 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.568 0.026 17931
2514 1 12 . 1 1 8 8 ASP C C 723 176.829 176.829 177.758 -0.929 17931
2515 1 12 . 1 1 8 8 ASP CA C 723 54.176 54.176 56.703 -2.527 17931
2516 1 12 . 1 1 8 8 ASP CB C 723 41.500 41.500 40.991 0.509 17931
2517 1 12 . 1 1 8 8 ASP H H 723 7.969 7.969 7.614 0.355 17931
2518 1 12 . 1 1 9 9 ARG N N 724 121.014 121.014 120.671 0.343 17931
2519 1 12 . 1 1 9 9 ARG HA H 724 4.204 4.204 3.932 0.272 17931
2520 1 12 . 1 1 9 9 ARG C C 724 177.662 177.662 178.168 -0.506 17931
2521 1 12 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.131 -2.312 17931
2522 1 12 . 1 1 9 9 ARG CB C 724 32.703 32.703 30.014 2.689 17931
2523 1 12 . 1 1 9 9 ARG H H 724 8.216 8.216 8.456 -0.240 17931
2524 1 12 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.037 0.098 17931
2525 1 12 . 1 1 10 10 LYS C C 725 178.127 178.127 177.443 0.684 17931
2526 1 12 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.223 -0.476 17931
2527 1 12 . 1 1 10 10 LYS CB C 725 32.190 32.190 31.864 0.326 17931
2528 1 12 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.154 -0.058 17931
2529 1 12 . 1 1 11 11 GLU C C 726 177.791 177.791 177.952 -0.161 17931
2530 1 12 . 1 1 11 11 GLU CA C 726 58.406 58.406 57.429 0.977 17931
2531 1 12 . 1 1 11 11 GLU CB C 726 29.340 29.340 31.019 -1.679 17931
2532 1 12 . 1 1 12 12 PHE N N 727 118.859 118.859 120.036 -1.177 17931
2533 1 12 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.403 -0.025 17931
2534 1 12 . 1 1 12 12 PHE C C 727 176.439 176.439 177.527 -1.088 17931
2535 1 12 . 1 1 12 12 PHE CA C 727 59.332 59.332 60.303 -0.971 17931
2536 1 12 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.519 -0.359 17931
2537 1 12 . 1 1 12 12 PHE H H 727 7.922 7.922 8.500 -0.578 17931
2538 1 12 . 1 1 13 13 ALA N N 728 122.111 122.111 122.184 -0.073 17931
2539 1 12 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.490 0.668 17931
2540 1 12 . 1 1 13 13 ALA C C 728 178.542 178.542 178.864 -0.322 17931
2541 1 12 . 1 1 13 13 ALA CA C 728 54.083 54.083 54.809 -0.726 17931
2542 1 12 . 1 1 13 13 ALA CB C 728 18.409 18.409 17.742 0.667 17931
2543 1 12 . 1 1 13 13 ALA H H 728 7.970 7.970 7.647 0.323 17931
2544 1 12 . 1 1 14 14 LYS N N 729 117.588 117.588 118.756 -1.168 17931
2545 1 12 . 1 1 14 14 LYS HA H 729 4.096 4.096 3.964 0.132 17931
2546 1 12 . 1 1 14 14 LYS C C 729 177.664 177.664 178.608 -0.944 17931
2547 1 12 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.316 -1.387 17931
2548 1 12 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.550 -1.035 17931
2549 1 12 . 1 1 14 14 LYS H H 729 7.792 7.792 7.782 0.010 17931
2550 1 12 . 1 1 15 15 PHE N N 730 119.916 119.916 117.841 2.075 17931
2551 1 12 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.551 -0.172 17931
2552 1 12 . 1 1 15 15 PHE C C 730 176.732 176.732 178.268 -1.536 17931
2553 1 12 . 1 1 15 15 PHE CA C 730 59.753 59.753 60.268 -0.515 17931
2554 1 12 . 1 1 15 15 PHE CB C 730 39.010 39.010 38.344 0.665 17931
2555 1 12 . 1 1 15 15 PHE H H 730 7.874 7.874 7.552 0.322 17931
2556 1 12 . 1 1 16 16 GLU N N 731 119.398 119.398 118.416 0.982 17931
2557 1 12 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.984 0.081 17931
2558 1 12 . 1 1 16 16 GLU C C 731 177.920 177.920 178.936 -1.016 17931
2559 1 12 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.284 -1.459 17931
2560 1 12 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.748 0.601 17931
2561 1 12 . 1 1 16 16 GLU H H 731 8.178 8.178 8.189 -0.011 17931
2562 1 12 . 1 1 17 17 GLU N N 732 120.386 120.386 120.177 0.209 17931
2563 1 12 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.975 0.075 17931
2564 1 12 . 1 1 17 17 GLU C C 732 178.097 178.097 179.151 -1.054 17931
2565 1 12 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.106 -0.799 17931
2566 1 12 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.396 -0.008 17931
2567 1 12 . 1 1 17 17 GLU H H 732 8.117 8.117 8.415 -0.298 17931
2568 1 12 . 1 1 18 18 GLU N N 733 119.473 119.473 119.902 -0.429 17931
2569 1 12 . 1 1 18 18 GLU HA H 733 4.056 4.056 4.019 0.037 17931
2570 1 12 . 1 1 18 18 GLU C C 733 177.228 177.228 178.429 -1.201 17931
2571 1 12 . 1 1 18 18 GLU CA C 733 58.298 58.298 59.493 -1.195 17931
2572 1 12 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.427 0.020 17931
2573 1 12 . 1 1 18 18 GLU H H 733 8.130 8.130 8.103 0.027 17931
2574 1 12 . 1 1 19 19 ARG N N 734 118.929 118.929 118.520 0.409 17931
2575 1 12 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.248 -0.219 17931
2576 1 12 . 1 1 19 19 ARG C C 734 177.402 177.402 177.915 -0.513 17931
2577 1 12 . 1 1 19 19 ARG CA C 734 58.400 58.400 58.014 0.387 17931
2578 1 12 . 1 1 19 19 ARG CB C 734 32.170 32.170 29.814 2.356 17931
2579 1 12 . 1 1 19 19 ARG H H 734 8.032 8.032 7.700 0.332 17931
2580 1 12 . 1 1 20 20 ALA N N 735 121.514 121.514 121.281 0.233 17931
2581 1 12 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.243 -0.114 17931
2582 1 12 . 1 1 20 20 ALA C C 735 179.108 179.108 179.676 -0.568 17931
2583 1 12 . 1 1 20 20 ALA CA C 735 53.559 53.559 54.795 -1.236 17931
2584 1 12 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.681 -0.120 17931
2585 1 12 . 1 1 20 20 ALA H H 735 7.853 7.853 8.366 -0.513 17931
2586 1 12 . 1 1 21 21 ARG N N 736 117.944 117.944 118.338 -0.394 17931
2587 1 12 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.165 -0.055 17931
2588 1 12 . 1 1 21 21 ARG C C 736 176.643 176.643 178.265 -1.622 17931
2589 1 12 . 1 1 21 21 ARG CA C 736 56.737 56.737 57.915 -1.178 17931
2590 1 12 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.427 0.145 17931
2591 1 12 . 1 1 21 21 ARG H H 736 7.850 7.850 8.474 -0.624 17931
2592 1 12 . 1 1 22 22 ALA N N 737 122.381 122.381 122.817 -0.436 17931
2593 1 12 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.138 0.013 17931
2594 1 12 . 1 1 22 22 ALA C C 737 177.640 177.640 178.783 -1.143 17931
2595 1 12 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.827 -2.057 17931
2596 1 12 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.474 0.273 17931
2597 1 12 . 1 1 22 22 ALA H H 737 7.776 7.776 8.135 -0.359 17931
2598 1 12 . 1 1 23 23 LYS N N 738 118.327 118.327 113.377 4.950 17931
2599 1 12 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.421 -0.262 17931
2600 1 12 . 1 1 23 23 LYS C C 738 176.483 176.483 176.815 -0.332 17931
2601 1 12 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.219 0.249 17931
2602 1 12 . 1 1 23 23 LYS CB C 738 32.526 32.526 33.998 -1.472 17931
2603 1 12 . 1 1 23 23 LYS H H 738 7.838 7.838 8.445 -0.607 17931
2604 1 12 . 1 1 24 24 TRP N N 739 120.598 120.598 121.067 -0.469 17931
2605 1 12 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.929 -0.328 17931
2606 1 12 . 1 1 24 24 TRP C C 739 175.904 175.904 176.269 -0.365 17931
2607 1 12 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.025 0.922 17931
2608 1 12 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.078 0.443 17931
2609 1 12 . 1 1 24 24 TRP H H 739 7.958 7.958 7.823 0.135 17931
2610 1 12 . 1 1 25 25 ASP N N 740 121.214 121.214 121.531 -0.317 17931
2611 1 12 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.312 -0.161 17931
2612 1 12 . 1 1 25 25 ASP C C 740 176.626 176.626 177.730 -1.104 17931
2613 1 12 . 1 1 25 25 ASP CA C 740 54.173 54.173 57.479 -3.306 17931
2614 1 12 . 1 1 25 25 ASP CB C 740 40.971 40.971 39.712 1.258 17931
2615 1 12 . 1 1 25 25 ASP H H 740 8.248 8.248 8.229 0.019 17931
2616 1 12 . 1 1 26 26 THR N N 741 113.708 113.708 113.378 0.330 17931
2617 1 12 . 1 1 26 26 THR HA H 741 4.221 4.221 4.067 0.154 17931
2618 1 12 . 1 1 26 26 THR C C 741 174.851 174.851 174.779 0.072 17931
2619 1 12 . 1 1 26 26 THR CA C 741 62.439 62.439 64.222 -1.783 17931
2620 1 12 . 1 1 26 26 THR CB C 741 69.255 69.255 68.547 0.708 17931
2621 1 12 . 1 1 26 26 THR H H 741 7.945 7.945 8.319 -0.374 17931
2622 1 12 . 1 1 27 27 ALA N N 742 124.543 124.543 120.984 3.559 17931
2623 1 12 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.465 -0.269 17931
2624 1 12 . 1 1 27 27 ALA C C 742 177.509 177.509 178.318 -0.809 17931
2625 1 12 . 1 1 27 27 ALA CA C 742 52.953 52.953 53.530 -0.577 17931
2626 1 12 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.519 -0.570 17931
2627 1 12 . 1 1 27 27 ALA H H 742 8.113 8.113 7.873 0.240 17931
2628 1 12 . 1 1 28 28 ASN N N 743 116.039 116.039 115.552 0.487 17931
2629 1 12 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.875 -0.276 17931
2630 1 12 . 1 1 28 28 ASN C C 743 174.330 174.330 175.661 -1.331 17931
2631 1 12 . 1 1 28 28 ASN CA C 743 52.868 52.868 54.093 -1.225 17931
2632 1 12 . 1 1 28 28 ASN CB C 743 38.995 38.995 41.151 -2.156 17931
2633 1 12 . 1 1 28 28 ASN H H 743 8.055 8.055 7.853 0.202 17931
2634 1 12 . 1 1 29 29 ASN N N 744 119.625 119.625 119.865 -0.240 17931
2635 1 12 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.140 -0.532 17931
2636 1 12 . 1 1 29 29 ASN CA C 744 50.940 50.940 51.337 -0.397 17931
2637 1 12 . 1 1 29 29 ASN CB C 744 38.798 38.798 39.596 -0.798 17931
2638 1 12 . 1 1 29 29 ASN H H 744 8.015 8.015 8.220 -0.205 17931
2639 1 12 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.263 0.109 17931
2640 1 12 . 1 1 30 30 PRO C C 745 177.196 177.196 176.689 0.507 17931
2641 1 12 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.716 -1.133 17931
2642 1 12 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.191 -0.303 17931
2643 1 12 . 1 1 34 34 GLU N N 749 121.140 121.140 119.395 1.745 17931
2644 1 12 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.078 0.128 17931
2645 1 12 . 1 1 34 34 GLU C C 749 176.764 176.764 177.936 -1.172 17931
2646 1 12 . 1 1 34 34 GLU CA C 749 56.698 56.698 58.708 -2.010 17931
2647 1 12 . 1 1 34 34 GLU CB C 749 29.784 29.784 29.685 0.099 17931
2648 1 12 . 1 1 34 34 GLU H H 749 8.215 8.215 8.602 -0.387 17931
2649 1 12 . 1 1 35 35 ALA N N 750 124.506 124.506 121.191 3.315 17931
2650 1 12 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.574 -0.298 17931
2651 1 12 . 1 1 35 35 ALA C C 750 178.054 178.054 178.763 -0.709 17931
2652 1 12 . 1 1 35 35 ALA CA C 750 53.011 53.011 53.944 -0.933 17931
2653 1 12 . 1 1 35 35 ALA CB C 750 19.021 19.021 17.826 1.195 17931
2654 1 12 . 1 1 35 35 ALA H H 750 8.335 8.335 8.375 -0.040 17931
2655 1 12 . 1 1 36 36 THR N N 751 111.925 111.925 115.749 -3.824 17931
2656 1 12 . 1 1 36 36 THR HA H 751 4.225 4.225 4.239 -0.014 17931
2657 1 12 . 1 1 36 36 THR C C 751 175.137 175.137 176.376 -1.239 17931
2658 1 12 . 1 1 36 36 THR CA C 751 62.508 62.508 66.203 -3.695 17931
2659 1 12 . 1 1 36 36 THR CB C 751 69.600 69.600 68.358 1.242 17931
2660 1 12 . 1 1 36 36 THR H H 751 8.007 8.007 8.183 -0.176 17931
2661 1 12 . 1 1 37 37 SER N N 752 117.676 117.676 115.750 1.926 17931
2662 1 12 . 1 1 37 37 SER HA H 752 4.567 4.567 4.310 0.257 17931
2663 1 12 . 1 1 37 37 SER C C 752 174.881 174.881 175.668 -0.787 17931
2664 1 12 . 1 1 37 37 SER CA C 752 58.856 58.856 61.461 -2.605 17931
2665 1 12 . 1 1 37 37 SER CB C 752 63.705 63.705 62.879 0.826 17931
2666 1 12 . 1 1 37 37 SER H H 752 8.156 8.156 7.642 0.514 17931
2667 1 12 . 1 1 38 38 THR N N 753 116.343 116.343 115.644 0.699 17931
2668 1 12 . 1 1 38 38 THR HA H 753 4.126 4.126 4.013 0.113 17931
2669 1 12 . 1 1 38 38 THR C C 753 174.555 174.555 174.704 -0.149 17931
2670 1 12 . 1 1 38 38 THR CA C 753 62.889 62.889 64.285 -1.396 17931
2671 1 12 . 1 1 38 38 THR CB C 753 69.292 69.292 69.257 0.035 17931
2672 1 12 . 1 1 38 38 THR H H 753 8.042 8.042 7.981 0.061 17931
2673 1 12 . 1 1 39 39 PHE N N 754 120.983 120.983 120.892 0.091 17931
2674 1 12 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.757 -0.190 17931
2675 1 12 . 1 1 39 39 PHE C C 754 175.956 175.956 175.547 0.409 17931
2676 1 12 . 1 1 39 39 PHE CA C 754 58.289 58.289 56.772 1.517 17931
2677 1 12 . 1 1 39 39 PHE CB C 754 39.222 39.222 40.031 -0.809 17931
2678 1 12 . 1 1 39 39 PHE H H 754 8.163 8.163 8.408 -0.245 17931
2679 1 12 . 1 1 40 40 THR N N 755 114.474 114.474 120.907 -6.433 17931
2680 1 12 . 1 1 40 40 THR HA H 755 4.159 4.159 4.350 -0.191 17931
2681 1 12 . 1 1 40 40 THR C C 755 174.168 174.168 174.626 -0.458 17931
2682 1 12 . 1 1 40 40 THR CA C 755 62.446 62.446 62.940 -0.494 17931
2683 1 12 . 1 1 40 40 THR CB C 755 69.403 69.403 69.526 -0.123 17931
2684 1 12 . 1 1 40 40 THR H H 755 7.943 7.943 8.736 -0.793 17931
2685 1 12 . 1 1 41 41 ASN N N 756 120.598 120.598 117.126 3.472 17931
2686 1 12 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.719 -0.120 17931
2687 1 12 . 1 1 41 41 ASN C C 756 175.438 175.438 174.468 0.970 17931
2688 1 12 . 1 1 41 41 ASN CA C 756 53.625 53.625 52.998 0.627 17931
2689 1 12 . 1 1 41 41 ASN CB C 756 38.852 38.852 38.854 -0.002 17931
2690 1 12 . 1 1 41 41 ASN H H 756 8.254 8.254 8.105 0.149 17931
2691 1 12 . 1 1 42 42 ILE N N 757 119.988 119.988 122.738 -2.750 17931
2692 1 12 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.397 -0.264 17931
2693 1 12 . 1 1 42 42 ILE C C 757 176.180 176.180 175.682 0.498 17931
2694 1 12 . 1 1 42 42 ILE CA C 757 61.607 61.607 61.413 0.194 17931
2695 1 12 . 1 1 42 42 ILE CB C 757 38.526 38.526 35.267 3.259 17931
2696 1 12 . 1 1 42 42 ILE H H 757 7.988 7.988 8.666 -0.678 17931
2697 1 12 . 1 1 46 46 GLY N N 761 109.795 109.795 109.160 0.635 17931
2698 1 12 . 1 1 46 46 GLY C C 761 173.400 173.400 174.119 -0.719 17931
2699 1 12 . 1 1 46 46 GLY CA C 761 45.241 45.241 44.593 0.648 17931
2700 1 12 . 1 1 46 46 GLY H H 761 8.038 8.038 8.419 -0.381 17931
2701 1 13 . 1 1 2 2 LEU N N 717 120.100 120.100 122.831 -2.731 17931
2702 1 13 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.339 -0.209 17931
2703 1 13 . 1 1 2 2 LEU C C 717 177.505 177.505 177.717 -0.212 17931
2704 1 13 . 1 1 2 2 LEU CA C 717 56.674 56.674 56.896 -0.222 17931
2705 1 13 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.546 0.307 17931
2706 1 13 . 1 1 2 2 LEU H H 717 7.866 7.866 7.928 -0.062 17931
2707 1 13 . 1 1 3 3 LEU N N 718 118.481 118.481 118.252 0.229 17931
2708 1 13 . 1 1 3 3 LEU HA H 718 4.057 4.057 3.973 0.084 17931
2709 1 13 . 1 1 3 3 LEU C C 718 177.643 177.643 178.891 -1.248 17931
2710 1 13 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.718 -0.775 17931
2711 1 13 . 1 1 3 3 LEU CB C 718 41.735 41.735 40.982 0.753 17931
2712 1 13 . 1 1 3 3 LEU H H 718 7.746 7.746 7.850 -0.104 17931
2713 1 13 . 1 1 4 4 ILE N N 719 116.207 116.207 116.520 -0.313 17931
2714 1 13 . 1 1 4 4 ILE HA H 719 3.911 3.911 3.894 0.017 17931
2715 1 13 . 1 1 4 4 ILE C C 719 176.774 176.774 178.576 -1.802 17931
2716 1 13 . 1 1 4 4 ILE CA C 719 62.960 62.960 62.732 0.228 17931
2717 1 13 . 1 1 4 4 ILE CB C 719 38.219 38.219 36.913 1.306 17931
2718 1 13 . 1 1 4 4 ILE H H 719 7.724 7.724 7.683 0.041 17931
2719 1 13 . 1 1 5 5 THR N N 720 114.581 114.581 116.634 -2.053 17931
2720 1 13 . 1 1 5 5 THR HA H 720 4.161 4.161 4.161 0.000 17931
2721 1 13 . 1 1 5 5 THR C C 720 175.458 175.458 177.111 -1.653 17931
2722 1 13 . 1 1 5 5 THR CA C 720 64.390 64.390 65.742 -1.352 17931
2723 1 13 . 1 1 5 5 THR CB C 720 69.052 69.052 68.546 0.506 17931
2724 1 13 . 1 1 5 5 THR H H 720 7.802 7.802 7.932 -0.130 17931
2725 1 13 . 1 1 6 6 ILE N N 721 119.805 119.805 121.353 -1.548 17931
2726 1 13 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.578 0.331 17931
2727 1 13 . 1 1 6 6 ILE C C 721 176.102 176.102 177.087 -0.985 17931
2728 1 13 . 1 1 6 6 ILE CA C 721 63.025 63.025 64.755 -1.730 17931
2729 1 13 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.630 0.474 17931
2730 1 13 . 1 1 6 6 ILE H H 721 7.751 7.751 7.695 0.056 17931
2731 1 13 . 1 1 7 7 HIS N N 722 118.760 118.760 116.487 2.273 17931
2732 1 13 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.333 0.282 17931
2733 1 13 . 1 1 7 7 HIS C C 722 174.538 174.538 177.295 -2.757 17931
2734 1 13 . 1 1 7 7 HIS CA C 722 57.344 57.344 58.353 -1.009 17931
2735 1 13 . 1 1 7 7 HIS CB C 722 29.375 29.375 29.991 -0.616 17931
2736 1 13 . 1 1 7 7 HIS H H 722 8.097 8.097 7.432 0.665 17931
2737 1 13 . 1 1 8 8 ASP N N 723 117.884 117.884 118.048 -0.164 17931
2738 1 13 . 1 1 8 8 ASP HA H 723 4.594 4.594 5.089 -0.495 17931
2739 1 13 . 1 1 8 8 ASP C C 723 176.829 176.829 177.465 -0.636 17931
2740 1 13 . 1 1 8 8 ASP CA C 723 54.176 54.176 54.830 -0.654 17931
2741 1 13 . 1 1 8 8 ASP CB C 723 41.500 41.500 41.540 -0.040 17931
2742 1 13 . 1 1 8 8 ASP H H 723 7.969 7.969 8.124 -0.155 17931
2743 1 13 . 1 1 9 9 ARG N N 724 121.014 121.014 120.328 0.686 17931
2744 1 13 . 1 1 9 9 ARG HA H 724 4.204 4.204 4.043 0.161 17931
2745 1 13 . 1 1 9 9 ARG C C 724 177.662 177.662 177.595 0.067 17931
2746 1 13 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.253 -2.434 17931
2747 1 13 . 1 1 9 9 ARG CB C 724 32.703 32.703 29.530 3.173 17931
2748 1 13 . 1 1 9 9 ARG H H 724 8.216 8.216 7.907 0.309 17931
2749 1 13 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.070 0.065 17931
2750 1 13 . 1 1 10 10 LYS C C 725 178.127 178.127 177.646 0.481 17931
2751 1 13 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.966 -1.219 17931
2752 1 13 . 1 1 10 10 LYS CB C 725 32.190 32.190 32.145 0.045 17931
2753 1 13 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.184 -0.088 17931
2754 1 13 . 1 1 11 11 GLU C C 726 177.791 177.791 177.856 -0.065 17931
2755 1 13 . 1 1 11 11 GLU CA C 726 58.406 58.406 57.278 1.128 17931
2756 1 13 . 1 1 11 11 GLU CB C 726 29.340 29.340 29.338 0.002 17931
2757 1 13 . 1 1 12 12 PHE N N 727 118.859 118.859 121.956 -3.097 17931
2758 1 13 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.709 -0.331 17931
2759 1 13 . 1 1 12 12 PHE C C 727 176.439 176.439 176.858 -0.419 17931
2760 1 13 . 1 1 12 12 PHE CA C 727 59.332 59.332 60.057 -0.725 17931
2761 1 13 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.737 -0.577 17931
2762 1 13 . 1 1 12 12 PHE H H 727 7.922 7.922 8.197 -0.275 17931
2763 1 13 . 1 1 13 13 ALA N N 728 122.111 122.111 121.841 0.270 17931
2764 1 13 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.685 0.473 17931
2765 1 13 . 1 1 13 13 ALA C C 728 178.542 178.542 179.002 -0.460 17931
2766 1 13 . 1 1 13 13 ALA CA C 728 54.083 54.083 55.104 -1.021 17931
2767 1 13 . 1 1 13 13 ALA CB C 728 18.409 18.409 18.123 0.286 17931
2768 1 13 . 1 1 13 13 ALA H H 728 7.970 7.970 8.407 -0.437 17931
2769 1 13 . 1 1 14 14 LYS N N 729 117.588 117.588 118.607 -1.019 17931
2770 1 13 . 1 1 14 14 LYS HA H 729 4.096 4.096 3.935 0.161 17931
2771 1 13 . 1 1 14 14 LYS C C 729 177.664 177.664 178.396 -0.732 17931
2772 1 13 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.345 -1.415 17931
2773 1 13 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.889 -1.374 17931
2774 1 13 . 1 1 14 14 LYS H H 729 7.792 7.792 7.686 0.106 17931
2775 1 13 . 1 1 15 15 PHE N N 730 119.916 119.916 117.378 2.538 17931
2776 1 13 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.455 -0.076 17931
2777 1 13 . 1 1 15 15 PHE C C 730 176.732 176.732 178.344 -1.612 17931
2778 1 13 . 1 1 15 15 PHE CA C 730 59.753 59.753 59.973 -0.220 17931
2779 1 13 . 1 1 15 15 PHE CB C 730 39.010 39.010 39.089 -0.079 17931
2780 1 13 . 1 1 15 15 PHE H H 730 7.874 7.874 7.432 0.442 17931
2781 1 13 . 1 1 16 16 GLU N N 731 119.398 119.398 119.258 0.140 17931
2782 1 13 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.859 0.206 17931
2783 1 13 . 1 1 16 16 GLU C C 731 177.920 177.920 178.646 -0.726 17931
2784 1 13 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.462 -1.637 17931
2785 1 13 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.591 0.758 17931
2786 1 13 . 1 1 16 16 GLU H H 731 8.178 8.178 7.822 0.356 17931
2787 1 13 . 1 1 17 17 GLU N N 732 120.386 120.386 119.870 0.516 17931
2788 1 13 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.904 0.146 17931
2789 1 13 . 1 1 17 17 GLU C C 732 178.097 178.097 179.098 -1.001 17931
2790 1 13 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.179 -0.872 17931
2791 1 13 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.378 0.010 17931
2792 1 13 . 1 1 17 17 GLU H H 732 8.117 8.117 8.150 -0.033 17931
2793 1 13 . 1 1 18 18 GLU N N 733 119.473 119.473 119.269 0.204 17931
2794 1 13 . 1 1 18 18 GLU HA H 733 4.056 4.056 4.022 0.034 17931
2795 1 13 . 1 1 18 18 GLU C C 733 177.228 177.228 178.325 -1.097 17931
2796 1 13 . 1 1 18 18 GLU CA C 733 58.298 58.298 59.151 -0.853 17931
2797 1 13 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.428 0.019 17931
2798 1 13 . 1 1 18 18 GLU H H 733 8.130 8.130 7.829 0.301 17931
2799 1 13 . 1 1 19 19 ARG N N 734 118.929 118.929 118.681 0.248 17931
2800 1 13 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.252 -0.223 17931
2801 1 13 . 1 1 19 19 ARG C C 734 177.402 177.402 178.031 -0.629 17931
2802 1 13 . 1 1 19 19 ARG CA C 734 58.400 58.400 58.057 0.343 17931
2803 1 13 . 1 1 19 19 ARG CB C 734 32.170 32.170 29.994 2.176 17931
2804 1 13 . 1 1 19 19 ARG H H 734 8.032 8.032 7.697 0.335 17931
2805 1 13 . 1 1 20 20 ALA N N 735 121.514 121.514 120.592 0.922 17931
2806 1 13 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.259 -0.130 17931
2807 1 13 . 1 1 20 20 ALA C C 735 179.108 179.108 179.685 -0.577 17931
2808 1 13 . 1 1 20 20 ALA CA C 735 53.559 53.559 54.618 -1.059 17931
2809 1 13 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.737 -0.176 17931
2810 1 13 . 1 1 20 20 ALA H H 735 7.853 7.853 8.312 -0.459 17931
2811 1 13 . 1 1 21 21 ARG N N 736 117.944 117.944 117.385 0.559 17931
2812 1 13 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.264 -0.154 17931
2813 1 13 . 1 1 21 21 ARG C C 736 176.643 176.643 177.541 -0.898 17931
2814 1 13 . 1 1 21 21 ARG CA C 736 56.737 56.737 56.983 -0.246 17931
2815 1 13 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.547 0.026 17931
2816 1 13 . 1 1 21 21 ARG H H 736 7.850 7.850 8.244 -0.394 17931
2817 1 13 . 1 1 22 22 ALA N N 737 122.381 122.381 122.086 0.295 17931
2818 1 13 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.129 0.022 17931
2819 1 13 . 1 1 22 22 ALA C C 737 177.640 177.640 178.407 -0.767 17931
2820 1 13 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.748 -1.978 17931
2821 1 13 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.608 0.139 17931
2822 1 13 . 1 1 22 22 ALA H H 737 7.776 7.776 7.417 0.359 17931
2823 1 13 . 1 1 23 23 LYS N N 738 118.327 118.327 114.267 4.060 17931
2824 1 13 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.388 -0.229 17931
2825 1 13 . 1 1 23 23 LYS C C 738 176.483 176.483 176.812 -0.329 17931
2826 1 13 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.894 -0.426 17931
2827 1 13 . 1 1 23 23 LYS CB C 738 32.526 32.526 33.979 -1.453 17931
2828 1 13 . 1 1 23 23 LYS H H 738 7.838 7.838 8.407 -0.569 17931
2829 1 13 . 1 1 24 24 TRP N N 739 120.598 120.598 120.916 -0.318 17931
2830 1 13 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.963 -0.362 17931
2831 1 13 . 1 1 24 24 TRP C C 739 175.904 175.904 175.679 0.225 17931
2832 1 13 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.146 0.801 17931
2833 1 13 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.110 0.411 17931
2834 1 13 . 1 1 24 24 TRP H H 739 7.958 7.958 7.904 0.054 17931
2835 1 13 . 1 1 25 25 ASP N N 740 121.214 121.214 121.072 0.142 17931
2836 1 13 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.459 -0.308 17931
2837 1 13 . 1 1 25 25 ASP C C 740 176.626 176.626 177.813 -1.187 17931
2838 1 13 . 1 1 25 25 ASP CA C 740 54.173 54.173 57.186 -3.013 17931
2839 1 13 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.044 0.927 17931
2840 1 13 . 1 1 25 25 ASP H H 740 8.248 8.248 8.162 0.086 17931
2841 1 13 . 1 1 26 26 THR N N 741 113.708 113.708 112.017 1.691 17931
2842 1 13 . 1 1 26 26 THR HA H 741 4.221 4.221 4.075 0.146 17931
2843 1 13 . 1 1 26 26 THR C C 741 174.851 174.851 174.826 0.025 17931
2844 1 13 . 1 1 26 26 THR CA C 741 62.439 62.439 63.894 -1.454 17931
2845 1 13 . 1 1 26 26 THR CB C 741 69.255 69.255 68.613 0.642 17931
2846 1 13 . 1 1 26 26 THR H H 741 7.945 7.945 8.239 -0.294 17931
2847 1 13 . 1 1 27 27 ALA N N 742 124.543 124.543 122.154 2.389 17931
2848 1 13 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.406 -0.210 17931
2849 1 13 . 1 1 27 27 ALA C C 742 177.509 177.509 178.780 -1.271 17931
2850 1 13 . 1 1 27 27 ALA CA C 742 52.953 52.953 53.621 -0.668 17931
2851 1 13 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.937 -0.988 17931
2852 1 13 . 1 1 27 27 ALA H H 742 8.113 8.113 7.652 0.461 17931
2853 1 13 . 1 1 28 28 ASN N N 743 116.039 116.039 116.798 -0.759 17931
2854 1 13 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.629 -0.030 17931
2855 1 13 . 1 1 28 28 ASN C C 743 174.330 174.330 175.748 -1.418 17931
2856 1 13 . 1 1 28 28 ASN CA C 743 52.868 52.868 54.916 -2.048 17931
2857 1 13 . 1 1 28 28 ASN CB C 743 38.995 38.995 39.277 -0.282 17931
2858 1 13 . 1 1 28 28 ASN H H 743 8.055 8.055 8.487 -0.432 17931
2859 1 13 . 1 1 29 29 ASN N N 744 119.625 119.625 118.336 1.289 17931
2860 1 13 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.044 -0.436 17931
2861 1 13 . 1 1 29 29 ASN CA C 744 50.940 50.940 51.185 -0.245 17931
2862 1 13 . 1 1 29 29 ASN CB C 744 38.798 38.798 39.644 -0.846 17931
2863 1 13 . 1 1 29 29 ASN H H 744 8.015 8.015 7.651 0.364 17931
2864 1 13 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.318 0.054 17931
2865 1 13 . 1 1 30 30 PRO C C 745 177.196 177.196 176.648 0.548 17931
2866 1 13 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.527 -0.944 17931
2867 1 13 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.262 -0.374 17931
2868 1 13 . 1 1 34 34 GLU N N 749 121.140 121.140 121.285 -0.145 17931
2869 1 13 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.114 0.092 17931
2870 1 13 . 1 1 34 34 GLU C C 749 176.764 176.764 178.132 -1.368 17931
2871 1 13 . 1 1 34 34 GLU CA C 749 56.698 56.698 59.099 -2.401 17931
2872 1 13 . 1 1 34 34 GLU CB C 749 29.784 29.784 29.722 0.062 17931
2873 1 13 . 1 1 34 34 GLU H H 749 8.215 8.215 8.912 -0.697 17931
2874 1 13 . 1 1 35 35 ALA N N 750 124.506 124.506 121.224 3.282 17931
2875 1 13 . 1 1 35 35 ALA HA H 750 4.276 4.276 3.984 0.292 17931
2876 1 13 . 1 1 35 35 ALA C C 750 178.054 178.054 178.555 -0.501 17931
2877 1 13 . 1 1 35 35 ALA CA C 750 53.011 53.011 54.459 -1.448 17931
2878 1 13 . 1 1 35 35 ALA CB C 750 19.021 19.021 17.540 1.481 17931
2879 1 13 . 1 1 35 35 ALA H H 750 8.335 8.335 8.400 -0.065 17931
2880 1 13 . 1 1 36 36 THR N N 751 111.925 111.925 112.003 -0.078 17931
2881 1 13 . 1 1 36 36 THR HA H 751 4.225 4.225 3.978 0.247 17931
2882 1 13 . 1 1 36 36 THR C C 751 175.137 175.137 175.985 -0.848 17931
2883 1 13 . 1 1 36 36 THR CA C 751 62.508 62.508 64.600 -2.092 17931
2884 1 13 . 1 1 36 36 THR CB C 751 69.600 69.600 68.457 1.143 17931
2885 1 13 . 1 1 36 36 THR H H 751 8.007 8.007 8.051 -0.044 17931
2886 1 13 . 1 1 37 37 SER N N 752 117.676 117.676 115.113 2.563 17931
2887 1 13 . 1 1 37 37 SER HA H 752 4.567 4.567 4.311 0.256 17931
2888 1 13 . 1 1 37 37 SER C C 752 174.881 174.881 175.703 -0.822 17931
2889 1 13 . 1 1 37 37 SER CA C 752 58.856 58.856 60.522 -1.666 17931
2890 1 13 . 1 1 37 37 SER CB C 752 63.705 63.705 63.312 0.393 17931
2891 1 13 . 1 1 37 37 SER H H 752 8.156 8.156 7.787 0.369 17931
2892 1 13 . 1 1 38 38 THR N N 753 116.343 116.343 115.231 1.112 17931
2893 1 13 . 1 1 38 38 THR HA H 753 4.126 4.126 4.365 -0.239 17931
2894 1 13 . 1 1 38 38 THR C C 753 174.555 174.555 174.337 0.218 17931
2895 1 13 . 1 1 38 38 THR CA C 753 62.889 62.889 63.509 -0.620 17931
2896 1 13 . 1 1 38 38 THR CB C 753 69.292 69.292 69.823 -0.531 17931
2897 1 13 . 1 1 38 38 THR H H 753 8.042 8.042 7.362 0.680 17931
2898 1 13 . 1 1 39 39 PHE N N 754 120.983 120.983 117.381 3.602 17931
2899 1 13 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.827 -0.260 17931
2900 1 13 . 1 1 39 39 PHE C C 754 175.956 175.956 173.246 2.710 17931
2901 1 13 . 1 1 39 39 PHE CA C 754 58.289 58.289 57.461 0.828 17931
2902 1 13 . 1 1 39 39 PHE CB C 754 39.222 39.222 40.462 -1.240 17931
2903 1 13 . 1 1 39 39 PHE H H 754 8.163 8.163 8.009 0.154 17931
2904 1 13 . 1 1 40 40 THR N N 755 114.474 114.474 116.818 -2.344 17931
2905 1 13 . 1 1 40 40 THR HA H 755 4.159 4.159 4.367 -0.208 17931
2906 1 13 . 1 1 40 40 THR C C 755 174.168 174.168 173.484 0.684 17931
2907 1 13 . 1 1 40 40 THR CA C 755 62.446 62.446 62.290 0.156 17931
2908 1 13 . 1 1 40 40 THR CB C 755 69.403 69.403 71.478 -2.075 17931
2909 1 13 . 1 1 40 40 THR H H 755 7.943 7.943 8.206 -0.263 17931
2910 1 13 . 1 1 41 41 ASN N N 756 120.598 120.598 125.137 -4.539 17931
2911 1 13 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.855 -0.256 17931
2912 1 13 . 1 1 41 41 ASN C C 756 175.438 175.438 175.996 -0.558 17931
2913 1 13 . 1 1 41 41 ASN CA C 756 53.625 53.625 52.958 0.667 17931
2914 1 13 . 1 1 41 41 ASN CB C 756 38.852 38.852 38.310 0.542 17931
2915 1 13 . 1 1 41 41 ASN H H 756 8.254 8.254 8.726 -0.472 17931
2916 1 13 . 1 1 42 42 ILE N N 757 119.988 119.988 121.328 -1.340 17931
2917 1 13 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.821 -0.688 17931
2918 1 13 . 1 1 42 42 ILE C C 757 176.180 176.180 175.931 0.249 17931
2919 1 13 . 1 1 42 42 ILE CA C 757 61.607 61.607 60.318 1.289 17931
2920 1 13 . 1 1 42 42 ILE CB C 757 38.526 38.526 37.268 1.258 17931
2921 1 13 . 1 1 42 42 ILE H H 757 7.988 7.988 7.971 0.017 17931
2922 1 13 . 1 1 46 46 GLY N N 761 109.795 109.795 111.041 -1.246 17931
2923 1 13 . 1 1 46 46 GLY C C 761 173.400 173.400 174.369 -0.969 17931
2924 1 13 . 1 1 46 46 GLY CA C 761 45.241 45.241 45.214 0.027 17931
2925 1 13 . 1 1 46 46 GLY H H 761 8.038 8.038 8.651 -0.613 17931
2926 1 14 . 1 1 2 2 LEU N N 717 120.100 120.100 122.739 -2.639 17931
2927 1 14 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.106 0.024 17931
2928 1 14 . 1 1 2 2 LEU C C 717 177.505 177.505 177.421 0.084 17931
2929 1 14 . 1 1 2 2 LEU CA C 717 56.674 56.674 58.003 -1.329 17931
2930 1 14 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.505 0.348 17931
2931 1 14 . 1 1 2 2 LEU H H 717 7.866 7.866 8.214 -0.348 17931
2932 1 14 . 1 1 3 3 LEU N N 718 118.481 118.481 117.016 1.465 17931
2933 1 14 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.028 0.029 17931
2934 1 14 . 1 1 3 3 LEU C C 718 177.643 177.643 178.807 -1.164 17931
2935 1 14 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.726 -0.783 17931
2936 1 14 . 1 1 3 3 LEU CB C 718 41.735 41.735 41.136 0.599 17931
2937 1 14 . 1 1 3 3 LEU H H 718 7.746 7.746 8.041 -0.295 17931
2938 1 14 . 1 1 4 4 ILE N N 719 116.207 116.207 116.462 -0.255 17931
2939 1 14 . 1 1 4 4 ILE HA H 719 3.911 3.911 3.879 0.032 17931
2940 1 14 . 1 1 4 4 ILE C C 719 176.774 176.774 178.574 -1.800 17931
2941 1 14 . 1 1 4 4 ILE CA C 719 62.960 62.960 62.593 0.367 17931
2942 1 14 . 1 1 4 4 ILE CB C 719 38.219 38.219 37.129 1.090 17931
2943 1 14 . 1 1 4 4 ILE H H 719 7.724 7.724 7.207 0.517 17931
2944 1 14 . 1 1 5 5 THR N N 720 114.581 114.581 116.562 -1.981 17931
2945 1 14 . 1 1 5 5 THR HA H 720 4.161 4.161 4.173 -0.012 17931
2946 1 14 . 1 1 5 5 THR C C 720 175.458 175.458 177.237 -1.779 17931
2947 1 14 . 1 1 5 5 THR CA C 720 64.390 64.390 65.587 -1.197 17931
2948 1 14 . 1 1 5 5 THR CB C 720 69.052 69.052 68.314 0.738 17931
2949 1 14 . 1 1 5 5 THR H H 720 7.802 7.802 8.280 -0.478 17931
2950 1 14 . 1 1 6 6 ILE N N 721 119.805 119.805 121.550 -1.745 17931
2951 1 14 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.592 0.317 17931
2952 1 14 . 1 1 6 6 ILE C C 721 176.102 176.102 178.243 -2.141 17931
2953 1 14 . 1 1 6 6 ILE CA C 721 63.025 63.025 65.114 -2.089 17931
2954 1 14 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.508 0.596 17931
2955 1 14 . 1 1 6 6 ILE H H 721 7.751 7.751 7.666 0.085 17931
2956 1 14 . 1 1 7 7 HIS N N 722 118.760 118.760 118.301 0.459 17931
2957 1 14 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.336 0.279 17931
2958 1 14 . 1 1 7 7 HIS C C 722 174.538 174.538 176.462 -1.924 17931
2959 1 14 . 1 1 7 7 HIS CA C 722 57.344 57.344 58.217 -0.873 17931
2960 1 14 . 1 1 7 7 HIS CB C 722 29.375 29.375 29.923 -0.548 17931
2961 1 14 . 1 1 7 7 HIS H H 722 8.097 8.097 7.698 0.399 17931
2962 1 14 . 1 1 8 8 ASP N N 723 117.884 117.884 115.903 1.981 17931
2963 1 14 . 1 1 8 8 ASP HA H 723 4.594 4.594 5.002 -0.408 17931
2964 1 14 . 1 1 8 8 ASP C C 723 176.829 176.829 176.279 0.550 17931
2965 1 14 . 1 1 8 8 ASP CA C 723 54.176 54.176 54.650 -0.474 17931
2966 1 14 . 1 1 8 8 ASP CB C 723 41.500 41.500 41.763 -0.263 17931
2967 1 14 . 1 1 8 8 ASP H H 723 7.969 7.969 8.061 -0.092 17931
2968 1 14 . 1 1 9 9 ARG N N 724 121.014 121.014 119.948 1.066 17931
2969 1 14 . 1 1 9 9 ARG HA H 724 4.204 4.204 4.109 0.095 17931
2970 1 14 . 1 1 9 9 ARG C C 724 177.662 177.662 177.571 0.091 17931
2971 1 14 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.088 -2.269 17931
2972 1 14 . 1 1 9 9 ARG CB C 724 32.703 32.703 29.675 3.028 17931
2973 1 14 . 1 1 9 9 ARG H H 724 8.216 8.216 7.817 0.399 17931
2974 1 14 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.162 -0.027 17931
2975 1 14 . 1 1 10 10 LYS C C 725 178.127 178.127 178.034 0.093 17931
2976 1 14 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.738 -0.991 17931
2977 1 14 . 1 1 10 10 LYS CB C 725 32.190 32.190 32.107 0.083 17931
2978 1 14 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.343 -0.247 17931
2979 1 14 . 1 1 11 11 GLU C C 726 177.791 177.791 178.037 -0.246 17931
2980 1 14 . 1 1 11 11 GLU CA C 726 58.406 58.406 57.523 0.883 17931
2981 1 14 . 1 1 11 11 GLU CB C 726 29.340 29.340 29.881 -0.541 17931
2982 1 14 . 1 1 12 12 PHE N N 727 118.859 118.859 120.747 -1.888 17931
2983 1 14 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.664 -0.286 17931
2984 1 14 . 1 1 12 12 PHE C C 727 176.439 176.439 177.492 -1.053 17931
2985 1 14 . 1 1 12 12 PHE CA C 727 59.332 59.332 59.897 -0.565 17931
2986 1 14 . 1 1 12 12 PHE CB C 727 39.160 39.160 40.157 -0.998 17931
2987 1 14 . 1 1 12 12 PHE H H 727 7.922 7.922 8.343 -0.421 17931
2988 1 14 . 1 1 13 13 ALA N N 728 122.111 122.111 122.152 -0.041 17931
2989 1 14 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.987 0.171 17931
2990 1 14 . 1 1 13 13 ALA C C 728 178.542 178.542 178.962 -0.420 17931
2991 1 14 . 1 1 13 13 ALA CA C 728 54.083 54.083 54.847 -0.764 17931
2992 1 14 . 1 1 13 13 ALA CB C 728 18.409 18.409 17.854 0.555 17931
2993 1 14 . 1 1 13 13 ALA H H 728 7.970 7.970 7.941 0.029 17931
2994 1 14 . 1 1 14 14 LYS N N 729 117.588 117.588 119.235 -1.647 17931
2995 1 14 . 1 1 14 14 LYS HA H 729 4.096 4.096 4.141 -0.045 17931
2996 1 14 . 1 1 14 14 LYS C C 729 177.664 177.664 178.059 -0.395 17931
2997 1 14 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.291 -1.361 17931
2998 1 14 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.836 -1.321 17931
2999 1 14 . 1 1 14 14 LYS H H 729 7.792 7.792 7.756 0.036 17931
3000 1 14 . 1 1 15 15 PHE N N 730 119.916 119.916 116.532 3.384 17931
3001 1 14 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.218 0.161 17931
3002 1 14 . 1 1 15 15 PHE C C 730 176.732 176.732 177.670 -0.938 17931
3003 1 14 . 1 1 15 15 PHE CA C 730 59.753 59.753 61.382 -1.629 17931
3004 1 14 . 1 1 15 15 PHE CB C 730 39.010 39.010 39.280 -0.270 17931
3005 1 14 . 1 1 15 15 PHE H H 730 7.874 7.874 7.886 -0.012 17931
3006 1 14 . 1 1 16 16 GLU N N 731 119.398 119.398 119.202 0.196 17931
3007 1 14 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.855 0.210 17931
3008 1 14 . 1 1 16 16 GLU C C 731 177.920 177.920 178.667 -0.747 17931
3009 1 14 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.297 -1.472 17931
3010 1 14 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.642 0.707 17931
3011 1 14 . 1 1 16 16 GLU H H 731 8.178 8.178 7.658 0.520 17931
3012 1 14 . 1 1 17 17 GLU N N 732 120.386 120.386 120.159 0.227 17931
3013 1 14 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.947 0.103 17931
3014 1 14 . 1 1 17 17 GLU C C 732 178.097 178.097 179.116 -1.019 17931
3015 1 14 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.362 -1.055 17931
3016 1 14 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.192 0.196 17931
3017 1 14 . 1 1 17 17 GLU H H 732 8.117 8.117 8.563 -0.446 17931
3018 1 14 . 1 1 18 18 GLU N N 733 119.473 119.473 119.184 0.289 17931
3019 1 14 . 1 1 18 18 GLU HA H 733 4.056 4.056 4.032 0.024 17931
3020 1 14 . 1 1 18 18 GLU C C 733 177.228 177.228 179.031 -1.803 17931
3021 1 14 . 1 1 18 18 GLU CA C 733 58.298 58.298 59.281 -0.983 17931
3022 1 14 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.360 0.087 17931
3023 1 14 . 1 1 18 18 GLU H H 733 8.130 8.130 7.772 0.358 17931
3024 1 14 . 1 1 19 19 ARG N N 734 118.929 118.929 118.280 0.649 17931
3025 1 14 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.251 -0.222 17931
3026 1 14 . 1 1 19 19 ARG C C 734 177.402 177.402 178.548 -1.146 17931
3027 1 14 . 1 1 19 19 ARG CA C 734 58.400 58.400 57.624 0.776 17931
3028 1 14 . 1 1 19 19 ARG CB C 734 32.170 32.170 29.763 2.407 17931
3029 1 14 . 1 1 19 19 ARG H H 734 8.032 8.032 7.664 0.368 17931
3030 1 14 . 1 1 20 20 ALA N N 735 121.514 121.514 122.472 -0.958 17931
3031 1 14 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.204 -0.075 17931
3032 1 14 . 1 1 20 20 ALA C C 735 179.108 179.108 179.550 -0.442 17931
3033 1 14 . 1 1 20 20 ALA CA C 735 53.559 53.559 55.123 -1.564 17931
3034 1 14 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.453 0.108 17931
3035 1 14 . 1 1 20 20 ALA H H 735 7.853 7.853 8.700 -0.847 17931
3036 1 14 . 1 1 21 21 ARG N N 736 117.944 117.944 119.030 -1.086 17931
3037 1 14 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.284 -0.174 17931
3038 1 14 . 1 1 21 21 ARG C C 736 176.643 176.643 178.061 -1.418 17931
3039 1 14 . 1 1 21 21 ARG CA C 736 56.737 56.737 58.260 -1.523 17931
3040 1 14 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.303 0.270 17931
3041 1 14 . 1 1 21 21 ARG H H 736 7.850 7.850 8.558 -0.708 17931
3042 1 14 . 1 1 22 22 ALA N N 737 122.381 122.381 121.125 1.256 17931
3043 1 14 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.226 -0.075 17931
3044 1 14 . 1 1 22 22 ALA C C 737 177.640 177.640 178.599 -0.959 17931
3045 1 14 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.374 -1.604 17931
3046 1 14 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.784 -0.037 17931
3047 1 14 . 1 1 22 22 ALA H H 737 7.776 7.776 7.767 0.009 17931
3048 1 14 . 1 1 23 23 LYS N N 738 118.327 118.327 113.834 4.493 17931
3049 1 14 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.410 -0.251 17931
3050 1 14 . 1 1 23 23 LYS C C 738 176.483 176.483 176.574 -0.091 17931
3051 1 14 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.220 0.248 17931
3052 1 14 . 1 1 23 23 LYS CB C 738 32.526 32.526 34.756 -2.230 17931
3053 1 14 . 1 1 23 23 LYS H H 738 7.838 7.838 7.709 0.129 17931
3054 1 14 . 1 1 24 24 TRP N N 739 120.598 120.598 121.405 -0.807 17931
3055 1 14 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.964 -0.363 17931
3056 1 14 . 1 1 24 24 TRP C C 739 175.904 175.904 175.441 0.463 17931
3057 1 14 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.250 0.697 17931
3058 1 14 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.610 -0.089 17931
3059 1 14 . 1 1 24 24 TRP H H 739 7.958 7.958 8.624 -0.666 17931
3060 1 14 . 1 1 25 25 ASP N N 740 121.214 121.214 120.999 0.215 17931
3061 1 14 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.367 -0.216 17931
3062 1 14 . 1 1 25 25 ASP C C 740 176.626 176.626 177.475 -0.849 17931
3063 1 14 . 1 1 25 25 ASP CA C 740 54.173 54.173 57.542 -3.369 17931
3064 1 14 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.298 0.673 17931
3065 1 14 . 1 1 25 25 ASP H H 740 8.248 8.248 8.437 -0.189 17931
3066 1 14 . 1 1 26 26 THR N N 741 113.708 113.708 112.864 0.844 17931
3067 1 14 . 1 1 26 26 THR HA H 741 4.221 4.221 4.161 0.060 17931
3068 1 14 . 1 1 26 26 THR C C 741 174.851 174.851 174.624 0.227 17931
3069 1 14 . 1 1 26 26 THR CA C 741 62.439 62.439 63.719 -1.280 17931
3070 1 14 . 1 1 26 26 THR CB C 741 69.255 69.255 68.593 0.662 17931
3071 1 14 . 1 1 26 26 THR H H 741 7.945 7.945 8.155 -0.210 17931
3072 1 14 . 1 1 27 27 ALA N N 742 124.543 124.543 122.871 1.672 17931
3073 1 14 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.428 -0.232 17931
3074 1 14 . 1 1 27 27 ALA C C 742 177.509 177.509 179.023 -1.514 17931
3075 1 14 . 1 1 27 27 ALA CA C 742 52.953 52.953 54.099 -1.147 17931
3076 1 14 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.175 -0.226 17931
3077 1 14 . 1 1 27 27 ALA H H 742 8.113 8.113 7.403 0.710 17931
3078 1 14 . 1 1 28 28 ASN N N 743 116.039 116.039 116.114 -0.075 17931
3079 1 14 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.691 -0.092 17931
3080 1 14 . 1 1 28 28 ASN C C 743 174.330 174.330 175.564 -1.234 17931
3081 1 14 . 1 1 28 28 ASN CA C 743 52.868 52.868 54.967 -2.099 17931
3082 1 14 . 1 1 28 28 ASN CB C 743 38.995 38.995 39.727 -0.732 17931
3083 1 14 . 1 1 28 28 ASN H H 743 8.055 8.055 8.359 -0.304 17931
3084 1 14 . 1 1 29 29 ASN N N 744 119.625 119.625 118.310 1.315 17931
3085 1 14 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.146 -0.538 17931
3086 1 14 . 1 1 29 29 ASN CA C 744 50.940 50.940 51.102 -0.163 17931
3087 1 14 . 1 1 29 29 ASN CB C 744 38.798 38.798 40.603 -1.805 17931
3088 1 14 . 1 1 29 29 ASN H H 744 8.015 8.015 7.580 0.435 17931
3089 1 14 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.344 0.028 17931
3090 1 14 . 1 1 30 30 PRO C C 745 177.196 177.196 176.732 0.464 17931
3091 1 14 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.487 -0.904 17931
3092 1 14 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.308 -0.420 17931
3093 1 14 . 1 1 34 34 GLU N N 749 121.140 121.140 120.433 0.707 17931
3094 1 14 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.175 0.031 17931
3095 1 14 . 1 1 34 34 GLU C C 749 176.764 176.764 177.954 -1.190 17931
3096 1 14 . 1 1 34 34 GLU CA C 749 56.698 56.698 58.755 -2.057 17931
3097 1 14 . 1 1 34 34 GLU CB C 749 29.784 29.784 29.628 0.156 17931
3098 1 14 . 1 1 34 34 GLU H H 749 8.215 8.215 8.798 -0.583 17931
3099 1 14 . 1 1 35 35 ALA N N 750 124.506 124.506 121.908 2.598 17931
3100 1 14 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.500 -0.224 17931
3101 1 14 . 1 1 35 35 ALA C C 750 178.054 178.054 178.914 -0.860 17931
3102 1 14 . 1 1 35 35 ALA CA C 750 53.011 53.011 54.161 -1.150 17931
3103 1 14 . 1 1 35 35 ALA CB C 750 19.021 19.021 18.008 1.013 17931
3104 1 14 . 1 1 35 35 ALA H H 750 8.335 8.335 8.373 -0.038 17931
3105 1 14 . 1 1 36 36 THR N N 751 111.925 111.925 115.212 -3.287 17931
3106 1 14 . 1 1 36 36 THR HA H 751 4.225 4.225 4.507 -0.282 17931
3107 1 14 . 1 1 36 36 THR C C 751 175.137 175.137 176.422 -1.285 17931
3108 1 14 . 1 1 36 36 THR CA C 751 62.508 62.508 65.727 -3.219 17931
3109 1 14 . 1 1 36 36 THR CB C 751 69.600 69.600 68.296 1.304 17931
3110 1 14 . 1 1 36 36 THR H H 751 8.007 8.007 7.659 0.348 17931
3111 1 14 . 1 1 37 37 SER N N 752 117.676 117.676 116.334 1.342 17931
3112 1 14 . 1 1 37 37 SER HA H 752 4.567 4.567 4.371 0.196 17931
3113 1 14 . 1 1 37 37 SER C C 752 174.881 174.881 175.607 -0.726 17931
3114 1 14 . 1 1 37 37 SER CA C 752 58.856 58.856 61.336 -2.479 17931
3115 1 14 . 1 1 37 37 SER CB C 752 63.705 63.705 62.832 0.873 17931
3116 1 14 . 1 1 37 37 SER H H 752 8.156 8.156 7.651 0.505 17931
3117 1 14 . 1 1 38 38 THR N N 753 116.343 116.343 115.250 1.093 17931
3118 1 14 . 1 1 38 38 THR HA H 753 4.126 4.126 4.092 0.034 17931
3119 1 14 . 1 1 38 38 THR C C 753 174.555 174.555 174.840 -0.285 17931
3120 1 14 . 1 1 38 38 THR CA C 753 62.889 62.889 64.347 -1.458 17931
3121 1 14 . 1 1 38 38 THR CB C 753 69.292 69.292 69.294 -0.002 17931
3122 1 14 . 1 1 38 38 THR H H 753 8.042 8.042 7.940 0.102 17931
3123 1 14 . 1 1 39 39 PHE N N 754 120.983 120.983 122.050 -1.067 17931
3124 1 14 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.924 -0.357 17931
3125 1 14 . 1 1 39 39 PHE C C 754 175.956 175.956 175.385 0.571 17931
3126 1 14 . 1 1 39 39 PHE CA C 754 58.289 58.289 56.575 1.714 17931
3127 1 14 . 1 1 39 39 PHE CB C 754 39.222 39.222 39.458 -0.236 17931
3128 1 14 . 1 1 39 39 PHE H H 754 8.163 8.163 8.579 -0.416 17931
3129 1 14 . 1 1 40 40 THR N N 755 114.474 114.474 119.361 -4.887 17931
3130 1 14 . 1 1 40 40 THR HA H 755 4.159 4.159 4.461 -0.302 17931
3131 1 14 . 1 1 40 40 THR C C 755 174.168 174.168 175.191 -1.023 17931
3132 1 14 . 1 1 40 40 THR CA C 755 62.446 62.446 64.602 -2.156 17931
3133 1 14 . 1 1 40 40 THR CB C 755 69.403 69.403 69.332 0.071 17931
3134 1 14 . 1 1 40 40 THR H H 755 7.943 7.943 8.484 -0.541 17931
3135 1 14 . 1 1 41 41 ASN N N 756 120.598 120.598 120.576 0.022 17931
3136 1 14 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.719 -0.120 17931
3137 1 14 . 1 1 41 41 ASN C C 756 175.438 175.438 174.330 1.108 17931
3138 1 14 . 1 1 41 41 ASN CA C 756 53.625 53.625 53.512 0.113 17931
3139 1 14 . 1 1 41 41 ASN CB C 756 38.852 38.852 37.224 1.627 17931
3140 1 14 . 1 1 41 41 ASN H H 756 8.254 8.254 8.358 -0.104 17931
3141 1 14 . 1 1 42 42 ILE N N 757 119.988 119.988 121.058 -1.070 17931
3142 1 14 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.428 -0.295 17931
3143 1 14 . 1 1 42 42 ILE C C 757 176.180 176.180 176.542 -0.362 17931
3144 1 14 . 1 1 42 42 ILE CA C 757 61.607 61.607 61.936 -0.329 17931
3145 1 14 . 1 1 42 42 ILE CB C 757 38.526 38.526 39.496 -0.970 17931
3146 1 14 . 1 1 42 42 ILE H H 757 7.988 7.988 8.396 -0.408 17931
3147 1 14 . 1 1 46 46 GLY N N 761 109.795 109.795 111.939 -2.144 17931
3148 1 14 . 1 1 46 46 GLY C C 761 173.400 173.400 174.267 -0.867 17931
3149 1 14 . 1 1 46 46 GLY CA C 761 45.241 45.241 45.636 -0.395 17931
3150 1 14 . 1 1 46 46 GLY H H 761 8.038 8.038 8.472 -0.434 17931
3151 1 15 . 1 1 2 2 LEU N N 717 120.100 120.100 122.443 -2.343 17931
3152 1 15 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.414 -0.284 17931
3153 1 15 . 1 1 2 2 LEU C C 717 177.505 177.505 177.620 -0.115 17931
3154 1 15 . 1 1 2 2 LEU CA C 717 56.674 56.674 57.318 -0.644 17931
3155 1 15 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.535 0.318 17931
3156 1 15 . 1 1 2 2 LEU H H 717 7.866 7.866 7.888 -0.022 17931
3157 1 15 . 1 1 3 3 LEU N N 718 118.481 118.481 118.978 -0.497 17931
3158 1 15 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.073 -0.016 17931
3159 1 15 . 1 1 3 3 LEU C C 718 177.643 177.643 179.007 -1.364 17931
3160 1 15 . 1 1 3 3 LEU CA C 718 56.943 56.943 58.787 -1.844 17931
3161 1 15 . 1 1 3 3 LEU CB C 718 41.735 41.735 40.620 1.115 17931
3162 1 15 . 1 1 3 3 LEU H H 718 7.746 7.746 8.086 -0.340 17931
3163 1 15 . 1 1 4 4 ILE N N 719 116.207 116.207 116.689 -0.482 17931
3164 1 15 . 1 1 4 4 ILE HA H 719 3.911 3.911 3.792 0.119 17931
3165 1 15 . 1 1 4 4 ILE C C 719 176.774 176.774 178.436 -1.662 17931
3166 1 15 . 1 1 4 4 ILE CA C 719 62.960 62.960 63.661 -0.701 17931
3167 1 15 . 1 1 4 4 ILE CB C 719 38.219 38.219 36.608 1.611 17931
3168 1 15 . 1 1 4 4 ILE H H 719 7.724 7.724 7.882 -0.158 17931
3169 1 15 . 1 1 5 5 THR N N 720 114.581 114.581 116.778 -2.197 17931
3170 1 15 . 1 1 5 5 THR HA H 720 4.161 4.161 4.109 0.052 17931
3171 1 15 . 1 1 5 5 THR C C 720 175.458 175.458 177.079 -1.621 17931
3172 1 15 . 1 1 5 5 THR CA C 720 64.390 64.390 66.590 -2.200 17931
3173 1 15 . 1 1 5 5 THR CB C 720 69.052 69.052 68.747 0.305 17931
3174 1 15 . 1 1 5 5 THR H H 720 7.802 7.802 7.739 0.063 17931
3175 1 15 . 1 1 6 6 ILE N N 721 119.805 119.805 120.756 -0.951 17931
3176 1 15 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.616 0.293 17931
3177 1 15 . 1 1 6 6 ILE C C 721 176.102 176.102 177.639 -1.537 17931
3178 1 15 . 1 1 6 6 ILE CA C 721 63.025 63.025 66.077 -3.052 17931
3179 1 15 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.842 0.262 17931
3180 1 15 . 1 1 6 6 ILE H H 721 7.751 7.751 8.571 -0.820 17931
3181 1 15 . 1 1 7 7 HIS N N 722 118.760 118.760 118.075 0.685 17931
3182 1 15 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.382 0.233 17931
3183 1 15 . 1 1 7 7 HIS C C 722 174.538 174.538 177.648 -3.110 17931
3184 1 15 . 1 1 7 7 HIS CA C 722 57.344 57.344 59.994 -2.650 17931
3185 1 15 . 1 1 7 7 HIS CB C 722 29.375 29.375 29.690 -0.315 17931
3186 1 15 . 1 1 7 7 HIS H H 722 8.097 8.097 7.652 0.445 17931
3187 1 15 . 1 1 8 8 ASP N N 723 117.884 117.884 119.559 -1.675 17931
3188 1 15 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.720 -0.126 17931
3189 1 15 . 1 1 8 8 ASP C C 723 176.829 176.829 177.675 -0.846 17931
3190 1 15 . 1 1 8 8 ASP CA C 723 54.176 54.176 56.558 -2.382 17931
3191 1 15 . 1 1 8 8 ASP CB C 723 41.500 41.500 41.121 0.379 17931
3192 1 15 . 1 1 8 8 ASP H H 723 7.969 7.969 7.974 -0.005 17931
3193 1 15 . 1 1 9 9 ARG N N 724 121.014 121.014 119.773 1.241 17931
3194 1 15 . 1 1 9 9 ARG HA H 724 4.204 4.204 4.032 0.172 17931
3195 1 15 . 1 1 9 9 ARG C C 724 177.662 177.662 177.785 -0.123 17931
3196 1 15 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.294 -2.475 17931
3197 1 15 . 1 1 9 9 ARG CB C 724 32.703 32.703 30.104 2.599 17931
3198 1 15 . 1 1 9 9 ARG H H 724 8.216 8.216 8.117 0.099 17931
3199 1 15 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.134 0.001 17931
3200 1 15 . 1 1 10 10 LYS C C 725 178.127 178.127 178.163 -0.036 17931
3201 1 15 . 1 1 10 10 LYS CA C 725 57.747 57.747 59.041 -1.294 17931
3202 1 15 . 1 1 10 10 LYS CB C 725 32.190 32.190 32.122 0.068 17931
3203 1 15 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.282 -0.186 17931
3204 1 15 . 1 1 11 11 GLU C C 726 177.791 177.791 178.528 -0.737 17931
3205 1 15 . 1 1 11 11 GLU CA C 726 58.406 58.406 58.276 0.130 17931
3206 1 15 . 1 1 11 11 GLU CB C 726 29.340 29.340 29.982 -0.642 17931
3207 1 15 . 1 1 12 12 PHE N N 727 118.859 118.859 119.854 -0.995 17931
3208 1 15 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.332 0.046 17931
3209 1 15 . 1 1 12 12 PHE C C 727 176.439 176.439 177.523 -1.084 17931
3210 1 15 . 1 1 12 12 PHE CA C 727 59.332 59.332 59.804 -0.472 17931
3211 1 15 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.503 -0.343 17931
3212 1 15 . 1 1 12 12 PHE H H 727 7.922 7.922 8.232 -0.310 17931
3213 1 15 . 1 1 13 13 ALA N N 728 122.111 122.111 121.618 0.493 17931
3214 1 15 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.885 0.273 17931
3215 1 15 . 1 1 13 13 ALA C C 728 178.542 178.542 179.032 -0.490 17931
3216 1 15 . 1 1 13 13 ALA CA C 728 54.083 54.083 54.767 -0.684 17931
3217 1 15 . 1 1 13 13 ALA CB C 728 18.409 18.409 17.792 0.617 17931
3218 1 15 . 1 1 13 13 ALA H H 728 7.970 7.970 8.048 -0.078 17931
3219 1 15 . 1 1 14 14 LYS N N 729 117.588 117.588 119.541 -1.953 17931
3220 1 15 . 1 1 14 14 LYS HA H 729 4.096 4.096 4.064 0.032 17931
3221 1 15 . 1 1 14 14 LYS C C 729 177.664 177.664 178.750 -1.086 17931
3222 1 15 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.731 -1.801 17931
3223 1 15 . 1 1 14 14 LYS CB C 729 30.515 30.515 32.035 -1.520 17931
3224 1 15 . 1 1 14 14 LYS H H 729 7.792 7.792 7.850 -0.058 17931
3225 1 15 . 1 1 15 15 PHE N N 730 119.916 119.916 117.566 2.350 17931
3226 1 15 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.642 -0.263 17931
3227 1 15 . 1 1 15 15 PHE C C 730 176.732 176.732 178.034 -1.302 17931
3228 1 15 . 1 1 15 15 PHE CA C 730 59.753 59.753 60.760 -1.007 17931
3229 1 15 . 1 1 15 15 PHE CB C 730 39.010 39.010 39.319 -0.309 17931
3230 1 15 . 1 1 15 15 PHE H H 730 7.874 7.874 8.176 -0.302 17931
3231 1 15 . 1 1 16 16 GLU N N 731 119.398 119.398 118.786 0.612 17931
3232 1 15 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.932 0.133 17931
3233 1 15 . 1 1 16 16 GLU C C 731 177.920 177.920 178.797 -0.877 17931
3234 1 15 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.328 -1.503 17931
3235 1 15 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.875 0.475 17931
3236 1 15 . 1 1 16 16 GLU H H 731 8.178 8.178 7.610 0.568 17931
3237 1 15 . 1 1 17 17 GLU N N 732 120.386 120.386 119.741 0.645 17931
3238 1 15 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.945 0.105 17931
3239 1 15 . 1 1 17 17 GLU C C 732 178.097 178.097 178.983 -0.886 17931
3240 1 15 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.379 -1.072 17931
3241 1 15 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.390 -0.002 17931
3242 1 15 . 1 1 17 17 GLU H H 732 8.117 8.117 8.616 -0.499 17931
3243 1 15 . 1 1 18 18 GLU N N 733 119.473 119.473 118.937 0.536 17931
3244 1 15 . 1 1 18 18 GLU HA H 733 4.056 4.056 3.942 0.114 17931
3245 1 15 . 1 1 18 18 GLU C C 733 177.228 177.228 178.453 -1.225 17931
3246 1 15 . 1 1 18 18 GLU CA C 733 58.298 58.298 59.712 -1.414 17931
3247 1 15 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.361 0.086 17931
3248 1 15 . 1 1 18 18 GLU H H 733 8.130 8.130 7.588 0.542 17931
3249 1 15 . 1 1 19 19 ARG N N 734 118.929 118.929 117.574 1.355 17931
3250 1 15 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.212 -0.183 17931
3251 1 15 . 1 1 19 19 ARG C C 734 177.402 177.402 178.477 -1.075 17931
3252 1 15 . 1 1 19 19 ARG CA C 734 58.400 58.400 57.648 0.752 17931
3253 1 15 . 1 1 19 19 ARG CB C 734 32.170 32.170 29.417 2.753 17931
3254 1 15 . 1 1 19 19 ARG H H 734 8.032 8.032 7.464 0.568 17931
3255 1 15 . 1 1 20 20 ALA N N 735 121.514 121.514 122.071 -0.557 17931
3256 1 15 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.212 -0.083 17931
3257 1 15 . 1 1 20 20 ALA C C 735 179.108 179.108 179.655 -0.547 17931
3258 1 15 . 1 1 20 20 ALA CA C 735 53.559 53.559 54.798 -1.239 17931
3259 1 15 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.561 0.000 17931
3260 1 15 . 1 1 20 20 ALA H H 735 7.853 7.853 8.576 -0.723 17931
3261 1 15 . 1 1 21 21 ARG N N 736 117.944 117.944 117.383 0.561 17931
3262 1 15 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.255 -0.145 17931
3263 1 15 . 1 1 21 21 ARG C C 736 176.643 176.643 177.826 -1.183 17931
3264 1 15 . 1 1 21 21 ARG CA C 736 56.737 56.737 57.462 -0.725 17931
3265 1 15 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.560 0.013 17931
3266 1 15 . 1 1 21 21 ARG H H 736 7.850 7.850 8.550 -0.700 17931
3267 1 15 . 1 1 22 22 ALA N N 737 122.381 122.381 122.266 0.115 17931
3268 1 15 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.136 0.015 17931
3269 1 15 . 1 1 22 22 ALA C C 737 177.640 177.640 178.808 -1.168 17931
3270 1 15 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.649 -1.879 17931
3271 1 15 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.750 -0.003 17931
3272 1 15 . 1 1 22 22 ALA H H 737 7.776 7.776 7.428 0.348 17931
3273 1 15 . 1 1 23 23 LYS N N 738 118.327 118.327 113.195 5.132 17931
3274 1 15 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.427 -0.268 17931
3275 1 15 . 1 1 23 23 LYS C C 738 176.483 176.483 176.864 -0.381 17931
3276 1 15 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.299 0.169 17931
3277 1 15 . 1 1 23 23 LYS CB C 738 32.526 32.526 34.320 -1.794 17931
3278 1 15 . 1 1 23 23 LYS H H 738 7.838 7.838 8.008 -0.170 17931
3279 1 15 . 1 1 24 24 TRP N N 739 120.598 120.598 121.709 -1.111 17931
3280 1 15 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.952 -0.351 17931
3281 1 15 . 1 1 24 24 TRP C C 739 175.904 175.904 175.512 0.392 17931
3282 1 15 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.120 0.827 17931
3283 1 15 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.205 0.316 17931
3284 1 15 . 1 1 24 24 TRP H H 739 7.958 7.958 7.805 0.153 17931
3285 1 15 . 1 1 25 25 ASP N N 740 121.214 121.214 120.618 0.596 17931
3286 1 15 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.311 -0.160 17931
3287 1 15 . 1 1 25 25 ASP C C 740 176.626 176.626 177.521 -0.895 17931
3288 1 15 . 1 1 25 25 ASP CA C 740 54.173 54.173 57.554 -3.381 17931
3289 1 15 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.136 0.835 17931
3290 1 15 . 1 1 25 25 ASP H H 740 8.248 8.248 8.253 -0.005 17931
3291 1 15 . 1 1 26 26 THR N N 741 113.708 113.708 113.123 0.585 17931
3292 1 15 . 1 1 26 26 THR HA H 741 4.221 4.221 4.141 0.080 17931
3293 1 15 . 1 1 26 26 THR C C 741 174.851 174.851 174.862 -0.011 17931
3294 1 15 . 1 1 26 26 THR CA C 741 62.439 62.439 63.855 -1.416 17931
3295 1 15 . 1 1 26 26 THR CB C 741 69.255 69.255 68.938 0.317 17931
3296 1 15 . 1 1 26 26 THR H H 741 7.945 7.945 8.220 -0.275 17931
3297 1 15 . 1 1 27 27 ALA N N 742 124.543 124.543 122.656 1.887 17931
3298 1 15 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.423 -0.227 17931
3299 1 15 . 1 1 27 27 ALA C C 742 177.509 177.509 179.153 -1.644 17931
3300 1 15 . 1 1 27 27 ALA CA C 742 52.953 52.953 54.137 -1.184 17931
3301 1 15 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.332 -0.384 17931
3302 1 15 . 1 1 27 27 ALA H H 742 8.113 8.113 7.640 0.473 17931
3303 1 15 . 1 1 28 28 ASN N N 743 116.039 116.039 115.079 0.960 17931
3304 1 15 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.810 -0.211 17931
3305 1 15 . 1 1 28 28 ASN C C 743 174.330 174.330 175.417 -1.087 17931
3306 1 15 . 1 1 28 28 ASN CA C 743 52.868 52.868 54.518 -1.650 17931
3307 1 15 . 1 1 28 28 ASN CB C 743 38.995 38.995 40.589 -1.594 17931
3308 1 15 . 1 1 28 28 ASN H H 743 8.055 8.055 8.365 -0.310 17931
3309 1 15 . 1 1 29 29 ASN N N 744 119.625 119.625 119.161 0.464 17931
3310 1 15 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.108 -0.500 17931
3311 1 15 . 1 1 29 29 ASN CA C 744 50.940 50.940 51.301 -0.361 17931
3312 1 15 . 1 1 29 29 ASN CB C 744 38.798 38.798 39.995 -1.196 17931
3313 1 15 . 1 1 29 29 ASN H H 744 8.015 8.015 7.665 0.350 17931
3314 1 15 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.340 0.032 17931
3315 1 15 . 1 1 30 30 PRO C C 745 177.196 177.196 177.154 0.042 17931
3316 1 15 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.453 -0.870 17931
3317 1 15 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.218 -0.330 17931
3318 1 15 . 1 1 34 34 GLU N N 749 121.140 121.140 120.567 0.573 17931
3319 1 15 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.076 0.130 17931
3320 1 15 . 1 1 34 34 GLU C C 749 176.764 176.764 177.184 -0.420 17931
3321 1 15 . 1 1 34 34 GLU CA C 749 56.698 56.698 59.202 -2.504 17931
3322 1 15 . 1 1 34 34 GLU CB C 749 29.784 29.784 29.342 0.442 17931
3323 1 15 . 1 1 34 34 GLU H H 749 8.215 8.215 8.860 -0.645 17931
3324 1 15 . 1 1 35 35 ALA N N 750 124.506 124.506 120.022 4.484 17931
3325 1 15 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.338 -0.062 17931
3326 1 15 . 1 1 35 35 ALA C C 750 178.054 178.054 178.648 -0.594 17931
3327 1 15 . 1 1 35 35 ALA CA C 750 53.011 53.011 54.148 -1.137 17931
3328 1 15 . 1 1 35 35 ALA CB C 750 19.021 19.021 18.046 0.975 17931
3329 1 15 . 1 1 35 35 ALA H H 750 8.335 8.335 8.517 -0.182 17931
3330 1 15 . 1 1 36 36 THR N N 751 111.925 111.925 113.197 -1.272 17931
3331 1 15 . 1 1 36 36 THR HA H 751 4.225 4.225 4.391 -0.166 17931
3332 1 15 . 1 1 36 36 THR C C 751 175.137 175.137 175.824 -0.687 17931
3333 1 15 . 1 1 36 36 THR CA C 751 62.508 62.508 64.988 -2.480 17931
3334 1 15 . 1 1 36 36 THR CB C 751 69.600 69.600 69.095 0.505 17931
3335 1 15 . 1 1 36 36 THR H H 751 8.007 8.007 7.915 0.092 17931
3336 1 15 . 1 1 37 37 SER N N 752 117.676 117.676 116.662 1.014 17931
3337 1 15 . 1 1 37 37 SER HA H 752 4.567 4.567 4.392 0.175 17931
3338 1 15 . 1 1 37 37 SER C C 752 174.881 174.881 176.237 -1.356 17931
3339 1 15 . 1 1 37 37 SER CA C 752 58.856 58.856 61.248 -2.392 17931
3340 1 15 . 1 1 37 37 SER CB C 752 63.705 63.705 63.579 0.126 17931
3341 1 15 . 1 1 37 37 SER H H 752 8.156 8.156 7.904 0.252 17931
3342 1 15 . 1 1 38 38 THR N N 753 116.343 116.343 115.307 1.036 17931
3343 1 15 . 1 1 38 38 THR HA H 753 4.126 4.126 4.323 -0.197 17931
3344 1 15 . 1 1 38 38 THR C C 753 174.555 174.555 174.665 -0.110 17931
3345 1 15 . 1 1 38 38 THR CA C 753 62.889 62.889 62.613 0.276 17931
3346 1 15 . 1 1 38 38 THR CB C 753 69.292 69.292 69.608 -0.316 17931
3347 1 15 . 1 1 38 38 THR H H 753 8.042 8.042 8.029 0.013 17931
3348 1 15 . 1 1 39 39 PHE N N 754 120.983 120.983 121.694 -0.711 17931
3349 1 15 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.471 0.096 17931
3350 1 15 . 1 1 39 39 PHE C C 754 175.956 175.956 175.221 0.735 17931
3351 1 15 . 1 1 39 39 PHE CA C 754 58.289 58.289 58.028 0.261 17931
3352 1 15 . 1 1 39 39 PHE CB C 754 39.222 39.222 37.488 1.734 17931
3353 1 15 . 1 1 39 39 PHE H H 754 8.163 8.163 7.832 0.331 17931
3354 1 15 . 1 1 40 40 THR N N 755 114.474 114.474 114.369 0.105 17931
3355 1 15 . 1 1 40 40 THR HA H 755 4.159 4.159 4.088 0.071 17931
3356 1 15 . 1 1 40 40 THR C C 755 174.168 174.168 174.224 -0.056 17931
3357 1 15 . 1 1 40 40 THR CA C 755 62.446 62.446 61.654 0.792 17931
3358 1 15 . 1 1 40 40 THR CB C 755 69.403 69.403 70.171 -0.768 17931
3359 1 15 . 1 1 40 40 THR H H 755 7.943 7.943 7.903 0.040 17931
3360 1 15 . 1 1 41 41 ASN N N 756 120.598 120.598 119.295 1.303 17931
3361 1 15 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.299 0.300 17931
3362 1 15 . 1 1 41 41 ASN C C 756 175.438 175.438 174.217 1.221 17931
3363 1 15 . 1 1 41 41 ASN CA C 756 53.625 53.625 53.836 -0.211 17931
3364 1 15 . 1 1 41 41 ASN CB C 756 38.852 38.852 37.900 0.952 17931
3365 1 15 . 1 1 41 41 ASN H H 756 8.254 8.254 7.713 0.541 17931
3366 1 15 . 1 1 42 42 ILE N N 757 119.988 119.988 121.658 -1.670 17931
3367 1 15 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.139 -0.006 17931
3368 1 15 . 1 1 42 42 ILE C C 757 176.180 176.180 175.888 0.292 17931
3369 1 15 . 1 1 42 42 ILE CA C 757 61.607 61.607 62.081 -0.474 17931
3370 1 15 . 1 1 42 42 ILE CB C 757 38.526 38.526 38.712 -0.186 17931
3371 1 15 . 1 1 42 42 ILE H H 757 7.988 7.988 8.422 -0.434 17931
3372 1 15 . 1 1 46 46 GLY N N 761 109.795 109.795 110.817 -1.022 17931
3373 1 15 . 1 1 46 46 GLY C C 761 173.400 173.400 174.133 -0.733 17931
3374 1 15 . 1 1 46 46 GLY CA C 761 45.241 45.241 45.008 0.233 17931
3375 1 15 . 1 1 46 46 GLY H H 761 8.038 8.038 8.365 -0.327 17931
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 36 1.908 -0.320 1.907 17931
2 1 1 "Average Difference" HA 40 0.226 0.030 0.227 17931
3 1 1 "Average Difference" C 38 0.967 0.703 0.672 17931
4 1 1 "Average Difference" CA 39 1.497 0.978 1.148 17931
5 1 1 "Average Difference" CB 38 0.865 -0.197 0.853 17931
6 1 1 "Average Difference" HN 36 0.429 -0.026 0.434 17931
7 1 2 "Average Difference" N 36 1.985 -0.402 1.972 17931
8 1 2 "Average Difference" HA 40 0.250 0.048 0.248 17931
9 1 2 "Average Difference" C 38 1.123 0.768 0.830 17931
10 1 2 "Average Difference" CA 39 1.660 1.089 1.270 17931
11 1 2 "Average Difference" CB 38 0.864 -0.171 0.858 17931
12 1 2 "Average Difference" HN 36 0.383 0.018 0.388 17931
13 1 3 "Average Difference" N 36 2.042 0.080 2.069 17931
14 1 3 "Average Difference" HA 40 0.244 0.042 0.243 17931
15 1 3 "Average Difference" C 38 1.076 0.649 0.869 17931
16 1 3 "Average Difference" CA 39 1.661 1.024 1.324 17931
17 1 3 "Average Difference" CB 38 0.971 -0.119 0.977 17931
18 1 3 "Average Difference" HN 36 0.413 0.084 0.410 17931
19 1 4 "Average Difference" N 36 1.884 -0.178 1.902 17931
20 1 4 "Average Difference" HA 40 0.234 0.042 0.233 17931
21 1 4 "Average Difference" C 38 1.021 0.677 0.774 17931
22 1 4 "Average Difference" CA 39 1.766 1.086 1.410 17931
23 1 4 "Average Difference" CB 38 0.954 -0.056 0.965 17931
24 1 4 "Average Difference" HN 36 0.401 0.060 0.402 17931
25 1 5 "Average Difference" N 36 2.146 0.097 2.174 17931
26 1 5 "Average Difference" HA 40 0.236 0.055 0.233 17931
27 1 5 "Average Difference" C 38 1.035 0.603 0.852 17931
28 1 5 "Average Difference" CA 39 1.458 0.852 1.198 17931
29 1 5 "Average Difference" CB 38 0.893 -0.151 0.892 17931
30 1 5 "Average Difference" HN 36 0.381 0.052 0.383 17931
31 1 6 "Average Difference" N 36 1.791 0.055 1.815 17931
32 1 6 "Average Difference" HA 40 0.247 0.066 0.241 17931
33 1 6 "Average Difference" C 38 1.027 0.619 0.830 17931
34 1 6 "Average Difference" CA 39 1.532 0.893 1.260 17931
35 1 6 "Average Difference" CB 38 0.881 -0.221 0.864 17931
36 1 6 "Average Difference" HN 36 0.409 0.081 0.406 17931
37 1 7 "Average Difference" N 36 1.690 -0.002 1.714 17931
38 1 7 "Average Difference" HA 40 0.211 0.057 0.205 17931
39 1 7 "Average Difference" C 38 1.158 0.653 0.969 17931
40 1 7 "Average Difference" CA 39 1.592 1.016 1.242 17931
41 1 7 "Average Difference" CB 38 0.995 -0.138 0.999 17931
42 1 7 "Average Difference" HN 36 0.365 0.073 0.363 17931
43 1 8 "Average Difference" N 36 2.066 -0.059 2.094 17931
44 1 8 "Average Difference" HA 40 0.218 0.071 0.209 17931
45 1 8 "Average Difference" C 38 0.944 0.606 0.734 17931
46 1 8 "Average Difference" CA 39 1.546 1.039 1.159 17931
47 1 8 "Average Difference" CB 38 0.845 -0.139 0.845 17931
48 1 8 "Average Difference" HN 36 0.382 0.065 0.382 17931
49 1 9 "Average Difference" N 36 1.930 -0.193 1.948 17931
50 1 9 "Average Difference" HA 40 0.221 0.039 0.220 17931
51 1 9 "Average Difference" C 38 1.095 0.681 0.869 17931
52 1 9 "Average Difference" CA 39 1.515 1.033 1.123 17931
53 1 9 "Average Difference" CB 38 1.003 -0.241 0.987 17931
54 1 9 "Average Difference" HN 36 0.398 0.049 0.401 17931
55 1 10 "Average Difference" N 36 2.132 -0.260 2.146 17931
56 1 10 "Average Difference" HA 40 0.229 0.062 0.223 17931
57 1 10 "Average Difference" C 38 0.963 0.411 0.882 17931
58 1 10 "Average Difference" CA 39 1.524 0.879 1.261 17931
59 1 10 "Average Difference" CB 38 1.003 -0.090 1.012 17931
60 1 10 "Average Difference" HN 36 0.381 0.035 0.385 17931
61 1 11 "Average Difference" N 36 1.934 -0.159 1.955 17931
62 1 11 "Average Difference" HA 40 0.219 0.039 0.218 17931
63 1 11 "Average Difference" C 38 0.995 0.649 0.764 17931
64 1 11 "Average Difference" CA 39 1.592 0.989 1.264 17931
65 1 11 "Average Difference" CB 38 0.984 -0.168 0.983 17931
66 1 11 "Average Difference" HN 36 0.382 0.085 0.378 17931
67 1 12 "Average Difference" N 36 2.114 0.014 2.144 17931
68 1 12 "Average Difference" HA 40 0.229 0.043 0.228 17931
69 1 12 "Average Difference" C 38 0.988 0.696 0.711 17931
70 1 12 "Average Difference" CA 39 1.551 0.988 1.211 17931
71 1 12 "Average Difference" CB 38 1.122 -0.291 1.099 17931
72 1 12 "Average Difference" HN 36 0.355 0.115 0.340 17931
73 1 13 "Average Difference" N 36 1.879 -0.203 1.894 17931
74 1 13 "Average Difference" HA 40 0.252 0.040 0.252 17931
75 1 13 "Average Difference" C 38 1.068 0.588 0.904 17931
76 1 13 "Average Difference" CA 39 1.286 0.794 1.024 17931
77 1 13 "Average Difference" CB 38 1.001 -0.163 1.001 17931
78 1 13 "Average Difference" HN 36 0.359 0.010 0.364 17931
79 1 14 "Average Difference" N 36 1.836 0.008 1.862 17931
80 1 14 "Average Difference" HA 40 0.214 0.083 0.199 17931
81 1 14 "Average Difference" C 38 1.038 0.685 0.791 17931
82 1 14 "Average Difference" CA 39 1.485 1.024 1.089 17931
83 1 14 "Average Difference" CB 38 1.013 -0.171 1.012 17931
84 1 14 "Average Difference" HN 36 0.410 0.072 0.409 17931
85 1 15 "Average Difference" N 36 1.614 -0.258 1.616 17931
86 1 15 "Average Difference" HA 40 0.186 0.029 0.186 17931
87 1 15 "Average Difference" C 38 1.059 0.720 0.787 17931
88 1 15 "Average Difference" CA 39 1.562 1.119 1.104 17931
89 1 15 "Average Difference" CB 38 0.982 -0.187 0.977 17931
90 1 15 "Average Difference" HN 36 0.385 0.041 0.388 17931
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 17931
_Entity_delta_chem_shifts.ID 2
_Entity_delta_chem_shifts.Details
;
This saveframe contains the averaged SPARTA chemical shift over all the models used.
;
loop_
_Delta_CS.Atom_chem_shift_ID
_Delta_CS.Entity_delta_chem_shifts_ID
_Delta_CS.Assembly_atom_ID
_Delta_CS.Entity_assembly_ID
_Delta_CS.Entity_ID
_Delta_CS.Comp_index_ID
_Delta_CS.Seq_ID
_Delta_CS.Comp_ID
_Delta_CS.Atom_ID
_Delta_CS.Atom_type
_Delta_CS.Auth_seq_ID
_Delta_CS.Original_CS_value
_Delta_CS.Corrected_CS_value
_Delta_CS.Sparta_CS_value
_Delta_CS.Delta_CS_value
_Delta_CS.Entry_ID
1 1 . 1 1 2 2 LEU N N 717 120.100 120.100 122.518 -2.418 17931
2 1 . 1 1 2 2 LEU HA H 717 4.130 4.130 4.310 -0.180 17931
3 1 . 1 1 2 2 LEU C C 717 177.505 177.505 177.694 -0.189 17931
4 1 . 1 1 2 2 LEU CA C 717 56.674 56.674 57.177 -0.503 17931
5 1 . 1 1 2 2 LEU CB C 717 41.853 41.853 41.463 0.390 17931
6 1 . 1 1 2 2 LEU H H 717 7.866 7.866 8.011 -0.145 17931
7 1 . 1 1 3 3 LEU N N 718 118.481 118.481 117.986 0.495 17931
8 1 . 1 1 3 3 LEU HA H 718 4.057 4.057 4.077 -0.020 17931
9 1 . 1 1 3 3 LEU C C 718 177.643 177.643 178.734 -1.091 17931
10 1 . 1 1 3 3 LEU CA C 718 56.943 56.943 57.750 -0.807 17931
11 1 . 1 1 3 3 LEU CB C 718 41.735 41.735 41.065 0.670 17931
12 1 . 1 1 3 3 LEU H H 718 7.746 7.746 7.969 -0.223 17931
13 1 . 1 1 4 4 ILE N N 719 116.207 116.207 116.766 -0.559 17931
14 1 . 1 1 4 4 ILE HA H 719 3.911 3.911 3.975 -0.064 17931
15 1 . 1 1 4 4 ILE C C 719 176.774 176.774 178.711 -1.937 17931
16 1 . 1 1 4 4 ILE CA C 719 62.960 62.960 62.989 -0.030 17931
17 1 . 1 1 4 4 ILE CB C 719 38.219 38.219 37.133 1.086 17931
18 1 . 1 1 4 4 ILE H H 719 7.724 7.724 7.506 0.218 17931
19 1 . 1 1 5 5 THR N N 720 114.581 114.581 116.699 -2.118 17931
20 1 . 1 1 5 5 THR HA H 720 4.161 4.161 4.149 0.012 17931
21 1 . 1 1 5 5 THR C C 720 175.458 175.458 176.706 -1.248 17931
22 1 . 1 1 5 5 THR CA C 720 64.390 64.390 65.751 -1.361 17931
23 1 . 1 1 5 5 THR CB C 720 69.052 69.052 68.411 0.641 17931
24 1 . 1 1 5 5 THR H H 720 7.802 7.802 8.164 -0.362 17931
25 1 . 1 1 6 6 ILE N N 721 119.805 119.805 121.333 -1.528 17931
26 1 . 1 1 6 6 ILE HA H 721 3.909 3.909 3.582 0.327 17931
27 1 . 1 1 6 6 ILE C C 721 176.102 176.102 177.388 -1.286 17931
28 1 . 1 1 6 6 ILE CA C 721 63.025 63.025 65.303 -2.278 17931
29 1 . 1 1 6 6 ILE CB C 721 38.104 38.104 37.526 0.578 17931
30 1 . 1 1 6 6 ILE H H 721 7.751 7.751 7.790 -0.039 17931
31 1 . 1 1 7 7 HIS N N 722 118.760 118.760 117.699 1.061 17931
32 1 . 1 1 7 7 HIS HA H 722 4.615 4.615 4.316 0.299 17931
33 1 . 1 1 7 7 HIS C C 722 174.538 174.538 176.910 -2.372 17931
34 1 . 1 1 7 7 HIS CA C 722 57.344 57.344 59.211 -1.867 17931
35 1 . 1 1 7 7 HIS CB C 722 29.375 29.375 29.982 -0.607 17931
36 1 . 1 1 7 7 HIS H H 722 8.097 8.097 7.760 0.337 17931
37 1 . 1 1 8 8 ASP N N 723 117.884 117.884 117.833 0.051 17931
38 1 . 1 1 8 8 ASP HA H 723 4.594 4.594 4.816 -0.222 17931
39 1 . 1 1 8 8 ASP C C 723 176.829 176.829 177.324 -0.495 17931
40 1 . 1 1 8 8 ASP CA C 723 54.176 54.176 55.682 -1.506 17931
41 1 . 1 1 8 8 ASP CB C 723 41.500 41.500 41.477 0.023 17931
42 1 . 1 1 8 8 ASP H H 723 7.969 7.969 7.853 0.116 17931
43 1 . 1 1 9 9 ARG N N 724 121.014 121.014 120.652 0.362 17931
44 1 . 1 1 9 9 ARG HA H 724 4.204 4.204 4.013 0.191 17931
45 1 . 1 1 9 9 ARG C C 724 177.662 177.662 177.862 -0.200 17931
46 1 . 1 1 9 9 ARG CA C 724 56.819 56.819 59.438 -2.619 17931
47 1 . 1 1 9 9 ARG CB C 724 32.703 32.703 29.977 2.726 17931
48 1 . 1 1 9 9 ARG H H 724 8.216 8.216 8.091 0.125 17931
49 1 . 1 1 10 10 LYS HA H 725 4.135 4.135 4.118 0.017 17931
50 1 . 1 1 10 10 LYS C C 725 178.127 178.127 177.809 0.318 17931
51 1 . 1 1 10 10 LYS CA C 725 57.747 57.747 58.605 -0.858 17931
52 1 . 1 1 10 10 LYS CB C 725 32.190 32.190 31.988 0.202 17931
53 1 . 1 1 11 11 GLU HA H 726 4.096 4.096 4.278 -0.182 17931
54 1 . 1 1 11 11 GLU C C 726 177.791 177.791 178.034 -0.243 17931
55 1 . 1 1 11 11 GLU CA C 726 58.406 58.406 57.633 0.773 17931
56 1 . 1 1 11 11 GLU CB C 726 29.340 29.340 30.137 -0.797 17931
57 1 . 1 1 12 12 PHE N N 727 118.859 118.859 120.412 -1.553 17931
58 1 . 1 1 12 12 PHE HA H 727 4.378 4.378 4.563 -0.185 17931
59 1 . 1 1 12 12 PHE C C 727 176.439 176.439 177.326 -0.887 17931
60 1 . 1 1 12 12 PHE CA C 727 59.332 59.332 60.109 -0.777 17931
61 1 . 1 1 12 12 PHE CB C 727 39.160 39.160 39.713 -0.553 17931
62 1 . 1 1 12 12 PHE H H 727 7.922 7.922 8.354 -0.432 17931
63 1 . 1 1 13 13 ALA N N 728 122.111 122.111 122.113 -0.002 17931
64 1 . 1 1 13 13 ALA HA H 728 4.158 4.158 3.745 0.413 17931
65 1 . 1 1 13 13 ALA C C 728 178.542 178.542 179.068 -0.526 17931
66 1 . 1 1 13 13 ALA CA C 728 54.083 54.083 54.891 -0.808 17931
67 1 . 1 1 13 13 ALA CB C 728 18.409 18.409 17.900 0.509 17931
68 1 . 1 1 13 13 ALA H H 728 7.970 7.970 8.029 -0.059 17931
69 1 . 1 1 14 14 LYS N N 729 117.588 117.588 118.806 -1.218 17931
70 1 . 1 1 14 14 LYS HA H 729 4.096 4.096 4.015 0.081 17931
71 1 . 1 1 14 14 LYS C C 729 177.664 177.664 178.640 -0.976 17931
72 1 . 1 1 14 14 LYS CA C 729 56.930 56.930 58.392 -1.462 17931
73 1 . 1 1 14 14 LYS CB C 729 30.515 30.515 31.760 -1.245 17931
74 1 . 1 1 14 14 LYS H H 729 7.792 7.792 7.808 -0.016 17931
75 1 . 1 1 15 15 PHE N N 730 119.916 119.916 117.718 2.198 17931
76 1 . 1 1 15 15 PHE HA H 730 4.379 4.379 4.376 0.003 17931
77 1 . 1 1 15 15 PHE C C 730 176.732 176.732 178.092 -1.360 17931
78 1 . 1 1 15 15 PHE CA C 730 59.753 59.753 60.801 -1.048 17931
79 1 . 1 1 15 15 PHE CB C 730 39.010 39.010 39.032 -0.023 17931
80 1 . 1 1 15 15 PHE H H 730 7.874 7.874 7.808 0.066 17931
81 1 . 1 1 16 16 GLU N N 731 119.398 119.398 118.683 0.715 17931
82 1 . 1 1 16 16 GLU HA H 731 4.065 4.065 3.926 0.139 17931
83 1 . 1 1 16 16 GLU C C 731 177.920 177.920 178.746 -0.826 17931
84 1 . 1 1 16 16 GLU CA C 731 57.825 57.825 59.282 -1.457 17931
85 1 . 1 1 16 16 GLU CB C 731 29.349 29.349 28.784 0.565 17931
86 1 . 1 1 16 16 GLU H H 731 8.178 8.178 7.799 0.379 17931
87 1 . 1 1 17 17 GLU N N 732 120.386 120.386 119.909 0.477 17931
88 1 . 1 1 17 17 GLU HA H 732 4.050 4.050 3.952 0.098 17931
89 1 . 1 1 17 17 GLU C C 732 178.097 178.097 179.032 -0.935 17931
90 1 . 1 1 17 17 GLU CA C 732 58.307 58.307 59.274 -0.968 17931
91 1 . 1 1 17 17 GLU CB C 732 29.388 29.388 29.340 0.048 17931
92 1 . 1 1 17 17 GLU H H 732 8.117 8.117 8.501 -0.384 17931
93 1 . 1 1 18 18 GLU N N 733 119.473 119.473 119.189 0.284 17931
94 1 . 1 1 18 18 GLU HA H 733 4.056 4.056 4.001 0.055 17931
95 1 . 1 1 18 18 GLU C C 733 177.228 177.228 178.576 -1.348 17931
96 1 . 1 1 18 18 GLU CA C 733 58.298 58.298 59.215 -0.917 17931
97 1 . 1 1 18 18 GLU CB C 733 29.447 29.447 29.363 0.084 17931
98 1 . 1 1 18 18 GLU H H 733 8.130 8.130 7.724 0.406 17931
99 1 . 1 1 19 19 ARG N N 734 118.929 118.929 118.765 0.164 17931
100 1 . 1 1 19 19 ARG HA H 734 4.029 4.029 4.229 -0.200 17931
101 1 . 1 1 19 19 ARG C C 734 177.402 177.402 178.107 -0.705 17931
102 1 . 1 1 19 19 ARG CA C 734 58.400 58.400 57.980 0.420 17931
103 1 . 1 1 19 19 ARG CB C 734 32.170 32.170 29.916 2.254 17931
104 1 . 1 1 19 19 ARG H H 734 8.032 8.032 7.622 0.410 17931
105 1 . 1 1 20 20 ALA N N 735 121.514 121.514 121.493 0.021 17931
106 1 . 1 1 20 20 ALA HA H 735 4.129 4.129 4.212 -0.083 17931
107 1 . 1 1 20 20 ALA C C 735 179.108 179.108 179.626 -0.518 17931
108 1 . 1 1 20 20 ALA CA C 735 53.559 53.559 54.801 -1.242 17931
109 1 . 1 1 20 20 ALA CB C 735 18.561 18.561 18.581 -0.020 17931
110 1 . 1 1 20 20 ALA H H 735 7.853 7.853 8.452 -0.599 17931
111 1 . 1 1 21 21 ARG N N 736 117.944 117.944 118.522 -0.578 17931
112 1 . 1 1 21 21 ARG HA H 736 4.110 4.110 4.195 -0.085 17931
113 1 . 1 1 21 21 ARG C C 736 176.643 176.643 178.026 -1.383 17931
114 1 . 1 1 21 21 ARG CA C 736 56.737 56.737 57.990 -1.253 17931
115 1 . 1 1 21 21 ARG CB C 736 30.573 30.573 30.382 0.191 17931
116 1 . 1 1 21 21 ARG H H 736 7.850 7.850 8.466 -0.616 17931
117 1 . 1 1 22 22 ALA N N 737 122.381 122.381 121.486 0.895 17931
118 1 . 1 1 22 22 ALA HA H 737 4.151 4.151 4.159 -0.008 17931
119 1 . 1 1 22 22 ALA C C 737 177.640 177.640 178.639 -0.999 17931
120 1 . 1 1 22 22 ALA CA C 737 52.770 52.770 54.583 -1.813 17931
121 1 . 1 1 22 22 ALA CB C 737 18.747 18.747 18.638 0.109 17931
122 1 . 1 1 22 22 ALA H H 737 7.776 7.776 7.777 -0.001 17931
123 1 . 1 1 23 23 LYS N N 738 118.327 118.327 113.995 4.332 17931
124 1 . 1 1 23 23 LYS HA H 738 4.159 4.159 4.379 -0.220 17931
125 1 . 1 1 23 23 LYS C C 738 176.483 176.483 176.552 -0.069 17931
126 1 . 1 1 23 23 LYS CA C 738 56.468 56.468 56.521 -0.053 17931
127 1 . 1 1 23 23 LYS CB C 738 32.526 32.526 34.254 -1.728 17931
128 1 . 1 1 23 23 LYS H H 738 7.838 7.838 7.954 -0.116 17931
129 1 . 1 1 24 24 TRP N N 739 120.598 120.598 121.109 -0.511 17931
130 1 . 1 1 24 24 TRP HA H 739 4.601 4.601 4.967 -0.366 17931
131 1 . 1 1 24 24 TRP C C 739 175.904 175.904 175.639 0.265 17931
132 1 . 1 1 24 24 TRP CA C 739 56.947 56.947 56.174 0.773 17931
133 1 . 1 1 24 24 TRP CB C 739 29.521 29.521 29.289 0.232 17931
134 1 . 1 1 24 24 TRP H H 739 7.958 7.958 8.168 -0.210 17931
135 1 . 1 1 25 25 ASP N N 740 121.214 121.214 121.384 -0.170 17931
136 1 . 1 1 25 25 ASP HA H 740 4.151 4.151 4.338 -0.187 17931
137 1 . 1 1 25 25 ASP C C 740 176.626 176.626 177.694 -1.068 17931
138 1 . 1 1 25 25 ASP CA C 740 54.173 54.173 57.654 -3.481 17931
139 1 . 1 1 25 25 ASP CB C 740 40.971 40.971 40.292 0.679 17931
140 1 . 1 1 25 25 ASP H H 740 8.248 8.248 8.144 0.104 17931
141 1 . 1 1 26 26 THR N N 741 113.708 113.708 112.842 0.866 17931
142 1 . 1 1 26 26 THR HA H 741 4.221 4.221 4.116 0.105 17931
143 1 . 1 1 26 26 THR C C 741 174.851 174.851 174.802 0.049 17931
144 1 . 1 1 26 26 THR CA C 741 62.439 62.439 64.268 -1.829 17931
145 1 . 1 1 26 26 THR CB C 741 69.255 69.255 68.611 0.644 17931
146 1 . 1 1 26 26 THR H H 741 7.945 7.945 8.287 -0.342 17931
147 1 . 1 1 27 27 ALA N N 742 124.543 124.543 122.119 2.424 17931
148 1 . 1 1 27 27 ALA HA H 742 4.196 4.196 4.397 -0.201 17931
149 1 . 1 1 27 27 ALA C C 742 177.509 177.509 178.844 -1.335 17931
150 1 . 1 1 27 27 ALA CA C 742 52.953 52.953 53.890 -0.937 17931
151 1 . 1 1 27 27 ALA CB C 742 18.949 18.949 19.541 -0.592 17931
152 1 . 1 1 27 27 ALA H H 742 8.113 8.113 7.596 0.517 17931
153 1 . 1 1 28 28 ASN N N 743 116.039 116.039 115.824 0.215 17931
154 1 . 1 1 28 28 ASN HA H 743 4.599 4.599 4.741 -0.142 17931
155 1 . 1 1 28 28 ASN C C 743 174.330 174.330 175.658 -1.328 17931
156 1 . 1 1 28 28 ASN CA C 743 52.868 52.868 54.635 -1.767 17931
157 1 . 1 1 28 28 ASN CB C 743 38.995 38.995 40.140 -1.145 17931
158 1 . 1 1 28 28 ASN H H 743 8.055 8.055 8.277 -0.222 17931
159 1 . 1 1 29 29 ASN N N 744 119.625 119.625 119.110 0.515 17931
160 1 . 1 1 29 29 ASN HA H 744 4.608 4.608 5.092 -0.484 17931
161 1 . 1 1 29 29 ASN CA C 744 50.940 50.940 51.310 -0.370 17931
162 1 . 1 1 29 29 ASN CB C 744 38.798 38.798 39.865 -1.066 17931
163 1 . 1 1 29 29 ASN H H 744 8.015 8.015 7.822 0.193 17931
164 1 . 1 1 30 30 PRO HA H 745 4.372 4.372 4.318 0.054 17931
165 1 . 1 1 30 30 PRO C C 745 177.196 177.196 176.830 0.366 17931
166 1 . 1 1 30 30 PRO CA C 745 63.583 63.583 64.560 -0.977 17931
167 1 . 1 1 30 30 PRO CB C 745 31.888 31.888 32.222 -0.334 17931
168 1 . 1 1 34 34 GLU N N 749 121.140 121.140 120.394 0.746 17931
169 1 . 1 1 34 34 GLU HA H 749 4.206 4.206 4.112 0.094 17931
170 1 . 1 1 34 34 GLU C C 749 176.764 176.764 177.209 -0.445 17931
171 1 . 1 1 34 34 GLU CA C 749 56.698 56.698 58.629 -1.931 17931
172 1 . 1 1 34 34 GLU CB C 749 29.784 29.784 29.822 -0.038 17931
173 1 . 1 1 34 34 GLU H H 749 8.215 8.215 8.753 -0.538 17931
174 1 . 1 1 35 35 ALA N N 750 124.506 124.506 121.745 2.761 17931
175 1 . 1 1 35 35 ALA HA H 750 4.276 4.276 4.453 -0.177 17931
176 1 . 1 1 35 35 ALA C C 750 178.054 178.054 178.290 -0.236 17931
177 1 . 1 1 35 35 ALA CA C 750 53.011 53.011 53.075 -0.064 17931
178 1 . 1 1 35 35 ALA CB C 750 19.021 19.021 18.226 0.795 17931
179 1 . 1 1 35 35 ALA H H 750 8.335 8.335 8.226 0.109 17931
180 1 . 1 1 36 36 THR N N 751 111.925 111.925 114.511 -2.586 17931
181 1 . 1 1 36 36 THR HA H 751 4.225 4.225 4.223 0.002 17931
182 1 . 1 1 36 36 THR C C 751 175.137 175.137 176.098 -0.961 17931
183 1 . 1 1 36 36 THR CA C 751 62.508 62.508 65.471 -2.963 17931
184 1 . 1 1 36 36 THR CB C 751 69.600 69.600 68.538 1.062 17931
185 1 . 1 1 36 36 THR H H 751 8.007 8.007 8.106 -0.099 17931
186 1 . 1 1 37 37 SER N N 752 117.676 117.676 115.739 1.937 17931
187 1 . 1 1 37 37 SER HA H 752 4.567 4.567 4.320 0.247 17931
188 1 . 1 1 37 37 SER C C 752 174.881 174.881 175.879 -0.998 17931
189 1 . 1 1 37 37 SER CA C 752 58.856 58.856 61.223 -2.367 17931
190 1 . 1 1 37 37 SER CB C 752 63.705 63.705 63.036 0.669 17931
191 1 . 1 1 37 37 SER H H 752 8.156 8.156 7.977 0.179 17931
192 1 . 1 1 38 38 THR N N 753 116.343 116.343 115.191 1.152 17931
193 1 . 1 1 38 38 THR HA H 753 4.126 4.126 4.195 -0.069 17931
194 1 . 1 1 38 38 THR C C 753 174.555 174.555 174.874 -0.319 17931
195 1 . 1 1 38 38 THR CA C 753 62.889 62.889 63.897 -1.008 17931
196 1 . 1 1 38 38 THR CB C 753 69.292 69.292 69.330 -0.038 17931
197 1 . 1 1 38 38 THR H H 753 8.042 8.042 7.692 0.350 17931
198 1 . 1 1 39 39 PHE N N 754 120.983 120.983 120.332 0.651 17931
199 1 . 1 1 39 39 PHE HA H 754 4.567 4.567 4.790 -0.223 17931
200 1 . 1 1 39 39 PHE C C 754 175.956 175.956 174.984 0.972 17931
201 1 . 1 1 39 39 PHE CA C 754 58.289 58.289 57.403 0.886 17931
202 1 . 1 1 39 39 PHE CB C 754 39.222 39.222 39.435 -0.213 17931
203 1 . 1 1 39 39 PHE H H 754 8.163 8.163 8.151 0.012 17931
204 1 . 1 1 40 40 THR N N 755 114.474 114.474 117.033 -2.559 17931
205 1 . 1 1 40 40 THR HA H 755 4.159 4.159 4.343 -0.184 17931
206 1 . 1 1 40 40 THR C C 755 174.168 174.168 174.480 -0.312 17931
207 1 . 1 1 40 40 THR CA C 755 62.446 62.446 62.771 -0.325 17931
208 1 . 1 1 40 40 THR CB C 755 69.403 69.403 69.535 -0.132 17931
209 1 . 1 1 40 40 THR H H 755 7.943 7.943 8.280 -0.337 17931
210 1 . 1 1 41 41 ASN N N 756 120.598 120.598 121.277 -0.679 17931
211 1 . 1 1 41 41 ASN HA H 756 4.599 4.599 4.717 -0.118 17931
212 1 . 1 1 41 41 ASN C C 756 175.438 175.438 175.037 0.401 17931
213 1 . 1 1 41 41 ASN CA C 756 53.625 53.625 54.001 -0.376 17931
214 1 . 1 1 41 41 ASN CB C 756 38.852 38.852 38.754 0.097 17931
215 1 . 1 1 41 41 ASN H H 756 8.254 8.254 8.312 -0.058 17931
216 1 . 1 1 42 42 ILE N N 757 119.988 119.988 120.176 -0.188 17931
217 1 . 1 1 42 42 ILE HA H 757 4.133 4.133 4.398 -0.265 17931
218 1 . 1 1 42 42 ILE C C 757 176.180 176.180 175.804 0.376 17931
219 1 . 1 1 42 42 ILE CA C 757 61.607 61.607 61.157 0.450 17931
220 1 . 1 1 42 42 ILE CB C 757 38.526 38.526 37.910 0.616 17931
221 1 . 1 1 42 42 ILE H H 757 7.988 7.988 8.184 -0.196 17931
222 1 . 1 1 46 46 GLY N N 761 109.795 109.795 111.174 -1.379 17931
223 1 . 1 1 46 46 GLY C C 761 173.400 173.400 174.153 -0.753 17931
224 1 . 1 1 46 46 GLY CA C 761 45.241 45.241 45.014 0.227 17931
225 1 . 1 1 46 46 GLY H H 761 8.038 8.038 8.522 -0.484 17931
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