data_18400
save_entry_information
_Entry.Sf_category entry_information
_Entry.NMR_STAR_version 3.0.9.13
_Entry.Entry_ID 18400
_Entry.PDB_ID 2LRX
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 18400
_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 GLN N N 2 122.420 122.420 120.447 1.973 18400
2 1 1 . 1 1 2 2 GLN HA H 2 4.665 4.665 4.728 -0.063 18400
3 1 1 . 1 1 2 2 GLN CA C 2 53.740 53.740 53.883 -0.143 18400
4 1 1 . 1 1 2 2 GLN CB C 2 28.509 28.509 28.953 -0.444 18400
5 1 1 . 1 1 2 2 GLN H H 2 8.573 8.573 8.147 0.426 18400
6 1 1 . 1 1 3 3 PRO HA H 3 4.464 4.464 4.583 -0.119 18400
7 1 1 . 1 1 3 3 PRO C C 3 177.173 177.173 176.006 1.167 18400
8 1 1 . 1 1 3 3 PRO CA C 3 62.946 62.946 62.051 0.895 18400
9 1 1 . 1 1 3 3 PRO CB C 3 32.109 32.109 32.434 -0.325 18400
10 1 1 . 1 1 4 4 ARG N N 4 122.684 122.684 121.057 1.627 18400
11 1 1 . 1 1 4 4 ARG HA H 4 4.578 4.578 4.233 0.345 18400
12 1 1 . 1 1 4 4 ARG CA C 4 53.646 53.646 55.626 -1.980 18400
13 1 1 . 1 1 4 4 ARG CB C 4 29.634 29.634 29.536 0.098 18400
14 1 1 . 1 1 4 4 ARG H H 4 8.438 8.438 8.550 -0.112 18400
15 1 1 . 1 1 5 5 PRO HA H 5 4.400 4.400 4.532 -0.132 18400
16 1 1 . 1 1 5 5 PRO C C 5 177.137 177.137 175.635 1.502 18400
17 1 1 . 1 1 5 5 PRO CA C 5 62.490 62.490 62.516 -0.026 18400
18 1 1 . 1 1 5 5 PRO CB C 5 31.928 31.928 32.932 -1.004 18400
19 1 1 . 1 1 6 6 ALA N N 6 123.540 123.540 127.678 -4.138 18400
20 1 1 . 1 1 6 6 ALA HA H 6 3.919 3.919 4.388 -0.469 18400
21 1 1 . 1 1 6 6 ALA C C 6 176.845 176.845 175.661 1.184 18400
22 1 1 . 1 1 6 6 ALA CA C 6 53.270 53.270 51.075 2.195 18400
23 1 1 . 1 1 6 6 ALA CB C 6 19.045 19.045 19.967 -0.922 18400
24 1 1 . 1 1 6 6 ALA H H 6 8.360 8.360 8.215 0.145 18400
25 1 1 . 1 1 7 7 LYS N N 7 121.074 121.074 120.069 1.005 18400
26 1 1 . 1 1 7 7 LYS HA H 7 4.306 4.306 4.441 -0.135 18400
27 1 1 . 1 1 7 7 LYS C C 7 175.113 175.113 174.308 0.805 18400
28 1 1 . 1 1 7 7 LYS CA C 7 56.621 56.621 55.700 0.921 18400
29 1 1 . 1 1 7 7 LYS CB C 7 36.158 36.158 32.850 3.308 18400
30 1 1 . 1 1 7 7 LYS H H 7 7.691 7.691 7.835 -0.144 18400
31 1 1 . 1 1 8 8 TYR N N 8 117.325 117.325 121.311 -3.986 18400
32 1 1 . 1 1 8 8 TYR HA H 8 5.660 5.660 4.681 0.979 18400
33 1 1 . 1 1 8 8 TYR C C 8 175.278 175.278 174.257 1.021 18400
34 1 1 . 1 1 8 8 TYR CA C 8 56.011 56.011 56.418 -0.407 18400
35 1 1 . 1 1 8 8 TYR CB C 8 42.531 42.531 42.801 -0.270 18400
36 1 1 . 1 1 8 8 TYR H H 8 8.349 8.349 8.242 0.107 18400
37 1 1 . 1 1 9 9 LYS N N 9 120.812 120.812 122.355 -1.543 18400
38 1 1 . 1 1 9 9 LYS HA H 9 5.647 5.647 4.951 0.696 18400
39 1 1 . 1 1 9 9 LYS C C 9 174.978 174.978 175.268 -0.290 18400
40 1 1 . 1 1 9 9 LYS CA C 9 54.767 54.767 55.911 -1.144 18400
41 1 1 . 1 1 9 9 LYS CB C 9 36.033 36.033 34.512 1.521 18400
42 1 1 . 1 1 9 9 LYS H H 9 9.648 9.648 8.918 0.730 18400
43 1 1 . 1 1 10 10 PHE N N 10 118.595 118.595 125.193 -6.598 18400
44 1 1 . 1 1 10 10 PHE HA H 10 5.220 5.220 4.885 0.335 18400
45 1 1 . 1 1 10 10 PHE C C 10 172.698 172.698 172.317 0.381 18400
46 1 1 . 1 1 10 10 PHE CA C 10 55.854 55.854 56.556 -0.702 18400
47 1 1 . 1 1 10 10 PHE CB C 10 40.607 40.607 41.799 -1.192 18400
48 1 1 . 1 1 10 10 PHE H H 10 8.890 8.890 8.519 0.371 18400
49 1 1 . 1 1 11 11 THR N N 11 117.249 117.249 115.819 1.430 18400
50 1 1 . 1 1 11 11 THR HA H 11 4.745 4.745 4.229 0.516 18400
51 1 1 . 1 1 11 11 THR C C 11 175.071 175.071 172.960 2.111 18400
52 1 1 . 1 1 11 11 THR CA C 11 61.667 61.667 59.541 2.126 18400
53 1 1 . 1 1 11 11 THR CB C 11 69.324 69.324 69.480 -0.156 18400
54 1 1 . 1 1 11 11 THR H H 11 8.904 8.904 7.663 1.241 18400
55 1 1 . 1 1 12 12 ASP N N 12 127.813 127.813 127.672 0.141 18400
56 1 1 . 1 1 12 12 ASP HA H 12 4.903 4.903 4.021 0.882 18400
57 1 1 . 1 1 12 12 ASP C C 12 179.041 179.041 177.443 1.598 18400
58 1 1 . 1 1 12 12 ASP CA C 12 52.773 52.773 55.401 -2.628 18400
59 1 1 . 1 1 12 12 ASP CB C 12 38.879 38.879 41.174 -2.295 18400
60 1 1 . 1 1 12 12 ASP H H 12 8.993 8.993 7.956 1.037 18400
61 1 1 . 1 1 13 13 VAL N N 13 117.388 117.388 119.550 -2.162 18400
62 1 1 . 1 1 13 13 VAL HA H 13 3.990 3.990 3.699 0.291 18400
63 1 1 . 1 1 13 13 VAL C C 13 176.796 176.796 176.159 0.637 18400
64 1 1 . 1 1 13 13 VAL CA C 13 64.349 64.349 64.625 -0.276 18400
65 1 1 . 1 1 13 13 VAL CB C 13 31.652 31.652 31.883 -0.231 18400
66 1 1 . 1 1 13 13 VAL H H 13 8.950 8.950 8.477 0.473 18400
67 1 1 . 1 1 14 14 ASN N N 14 117.303 117.303 115.996 1.307 18400
68 1 1 . 1 1 14 14 ASN HA H 14 4.781 4.781 4.636 0.145 18400
69 1 1 . 1 1 14 14 ASN C C 14 176.606 176.606 175.440 1.166 18400
70 1 1 . 1 1 14 14 ASN CB C 14 38.851 38.851 38.986 -0.135 18400
71 1 1 . 1 1 14 14 ASN H H 14 8.011 8.011 8.195 -0.184 18400
72 1 1 . 1 1 15 15 GLY N N 15 108.443 108.443 107.938 0.505 18400
73 1 1 . 1 1 15 15 GLY C C 15 174.799 174.799 174.445 0.354 18400
74 1 1 . 1 1 15 15 GLY CA C 15 45.246 45.246 44.795 0.451 18400
75 1 1 . 1 1 15 15 GLY H H 15 8.288 8.288 7.491 0.797 18400
76 1 1 . 1 1 16 16 GLU N N 16 122.005 122.005 119.669 2.336 18400
77 1 1 . 1 1 16 16 GLU HA H 16 4.373 4.373 4.303 0.070 18400
78 1 1 . 1 1 16 16 GLU C C 16 176.564 176.564 175.451 1.113 18400
79 1 1 . 1 1 16 16 GLU CA C 16 55.798 55.798 56.869 -1.071 18400
80 1 1 . 1 1 16 16 GLU CB C 16 30.932 30.932 30.007 0.925 18400
81 1 1 . 1 1 16 16 GLU H H 16 8.045 8.045 8.155 -0.110 18400
82 1 1 . 1 1 17 17 THR N N 17 120.458 120.458 113.925 6.533 18400
83 1 1 . 1 1 17 17 THR HA H 17 4.583 4.583 5.184 -0.601 18400
84 1 1 . 1 1 17 17 THR C C 17 174.583 174.583 173.766 0.817 18400
85 1 1 . 1 1 17 17 THR CA C 17 63.471 63.471 61.708 1.763 18400
86 1 1 . 1 1 17 17 THR CB C 17 69.004 69.004 69.821 -0.817 18400
87 1 1 . 1 1 17 17 THR H H 17 8.758 8.758 8.307 0.451 18400
88 1 1 . 1 1 18 18 LYS N N 18 129.000 129.000 123.825 5.175 18400
89 1 1 . 1 1 18 18 LYS HA H 18 4.581 4.581 4.840 -0.259 18400
90 1 1 . 1 1 18 18 LYS C C 18 174.995 174.995 174.797 0.198 18400
91 1 1 . 1 1 18 18 LYS CB C 18 36.219 36.219 35.766 0.453 18400
92 1 1 . 1 1 18 18 LYS H H 18 8.848 8.848 8.040 0.808 18400
93 1 1 . 1 1 19 19 THR N N 19 107.308 107.308 113.217 -5.909 18400
94 1 1 . 1 1 19 19 THR HA H 19 5.662 5.662 4.831 0.831 18400
95 1 1 . 1 1 19 19 THR C C 19 175.135 175.135 174.075 1.060 18400
96 1 1 . 1 1 19 19 THR CA C 19 59.541 59.541 62.326 -2.785 18400
97 1 1 . 1 1 19 19 THR CB C 19 72.571 72.571 69.277 3.294 18400
98 1 1 . 1 1 19 19 THR H H 19 8.023 8.023 8.341 -0.318 18400
99 1 1 . 1 1 20 20 TRP N N 20 120.113 120.113 126.965 -6.852 18400
100 1 1 . 1 1 20 20 TRP HA H 20 5.793 5.793 4.506 1.287 18400
101 1 1 . 1 1 20 20 TRP CA C 20 55.233 55.233 57.001 -1.768 18400
102 1 1 . 1 1 20 20 TRP CB C 20 33.193 33.193 30.943 2.250 18400
103 1 1 . 1 1 20 20 TRP H H 20 9.317 9.317 8.279 1.038 18400
104 1 1 . 1 1 21 21 THR HA H 21 4.280 4.280 4.456 -0.176 18400
105 1 1 . 1 1 21 21 THR CA C 21 62.844 62.844 61.492 1.353 18400
106 1 1 . 1 1 21 21 THR CB C 21 70.918 70.918 70.661 0.257 18400
107 1 1 . 1 1 21 21 THR H H 21 8.449 8.449 7.787 0.662 18400
108 1 1 . 1 1 22 22 GLY C C 22 172.841 172.841 173.191 -0.350 18400
109 1 1 . 1 1 22 22 GLY CA C 22 44.229 44.229 44.394 -0.165 18400
110 1 1 . 1 1 22 22 GLY H H 22 7.928 7.928 7.344 0.584 18400
111 1 1 . 1 1 23 23 GLN N N 23 117.973 117.973 120.529 -2.556 18400
112 1 1 . 1 1 23 23 GLN HA H 23 4.533 4.533 4.068 0.465 18400
113 1 1 . 1 1 23 23 GLN C C 23 176.979 176.979 176.230 0.749 18400
114 1 1 . 1 1 23 23 GLN CA C 23 54.099 54.099 58.218 -4.120 18400
115 1 1 . 1 1 23 23 GLN CB C 23 30.565 30.565 29.195 1.370 18400
116 1 1 . 1 1 23 23 GLN H H 23 7.141 7.141 6.980 0.161 18400
117 1 1 . 1 1 24 24 GLY N N 24 111.998 111.998 105.584 6.414 18400
118 1 1 . 1 1 24 24 GLY C C 24 174.510 174.510 173.373 1.137 18400
119 1 1 . 1 1 24 24 GLY CA C 24 44.906 44.906 45.499 -0.593 18400
120 1 1 . 1 1 24 24 GLY H H 24 8.841 8.841 8.324 0.517 18400
121 1 1 . 1 1 25 25 ARG N N 25 121.958 121.958 124.051 -2.093 18400
122 1 1 . 1 1 25 25 ARG HA H 25 4.179 4.179 4.449 -0.270 18400
123 1 1 . 1 1 25 25 ARG C C 25 177.025 177.025 175.220 1.805 18400
124 1 1 . 1 1 25 25 ARG CA C 25 56.285 56.285 56.678 -0.393 18400
125 1 1 . 1 1 25 25 ARG CB C 25 29.885 29.885 30.215 -0.330 18400
126 1 1 . 1 1 25 25 ARG H H 25 8.444 8.444 8.454 -0.010 18400
127 1 1 . 1 1 26 26 THR N N 26 122.468 122.468 119.355 3.113 18400
128 1 1 . 1 1 26 26 THR HA H 26 3.226 3.226 4.780 -1.554 18400
129 1 1 . 1 1 26 26 THR CA C 26 60.422 60.422 59.289 1.133 18400
130 1 1 . 1 1 26 26 THR CB C 26 69.088 69.088 69.022 0.066 18400
131 1 1 . 1 1 26 26 THR H H 26 8.369 8.369 8.370 -0.001 18400
132 1 1 . 1 1 27 27 PRO HA H 27 3.867 3.867 4.165 -0.298 18400
133 1 1 . 1 1 27 27 PRO C C 27 177.571 177.571 178.245 -0.674 18400
134 1 1 . 1 1 27 27 PRO CA C 27 62.174 62.174 62.879 -0.705 18400
135 1 1 . 1 1 27 27 PRO CB C 27 32.818 32.818 31.957 0.861 18400
136 1 1 . 1 1 28 28 LYS N N 28 126.298 126.298 121.533 4.765 18400
137 1 1 . 1 1 28 28 LYS HA H 28 3.925 3.925 3.992 -0.067 18400
138 1 1 . 1 1 28 28 LYS CA C 28 60.815 60.815 60.739 0.076 18400
139 1 1 . 1 1 28 28 LYS H H 28 8.903 8.903 8.869 0.034 18400
140 1 1 . 1 1 29 29 PRO HA H 29 4.289 4.289 4.277 0.012 18400
141 1 1 . 1 1 29 29 PRO C C 29 180.695 180.695 178.872 1.823 18400
142 1 1 . 1 1 29 29 PRO CA C 29 65.875 65.875 65.455 0.420 18400
143 1 1 . 1 1 29 29 PRO CB C 29 31.770 31.770 31.045 0.725 18400
144 1 1 . 1 1 30 30 ILE N N 30 114.387 114.387 118.142 -3.755 18400
145 1 1 . 1 1 30 30 ILE HA H 30 3.021 3.021 4.048 -1.027 18400
146 1 1 . 1 1 30 30 ILE C C 30 176.633 176.633 178.152 -1.519 18400
147 1 1 . 1 1 30 30 ILE CA C 30 63.949 63.949 63.919 0.031 18400
148 1 1 . 1 1 30 30 ILE CB C 30 36.650 36.650 36.792 -0.142 18400
149 1 1 . 1 1 30 30 ILE H H 30 6.051 6.051 7.950 -1.899 18400
150 1 1 . 1 1 31 31 ALA N N 31 123.060 123.060 122.335 0.725 18400
151 1 1 . 1 1 31 31 ALA HA H 31 3.720 3.720 3.990 -0.270 18400
152 1 1 . 1 1 31 31 ALA C C 31 181.571 181.571 179.599 1.972 18400
153 1 1 . 1 1 31 31 ALA CA C 31 55.456 55.456 55.793 -0.337 18400
154 1 1 . 1 1 31 31 ALA CB C 31 17.825 17.825 17.860 -0.035 18400
155 1 1 . 1 1 31 31 ALA H H 31 7.922 7.922 8.838 -0.916 18400
156 1 1 . 1 1 32 32 GLN N N 32 117.568 117.568 119.415 -1.847 18400
157 1 1 . 1 1 32 32 GLN HA H 32 3.934 3.934 4.073 -0.139 18400
158 1 1 . 1 1 32 32 GLN C C 32 178.025 178.025 177.963 0.062 18400
159 1 1 . 1 1 32 32 GLN CA C 32 58.424 58.424 58.831 -0.407 18400
160 1 1 . 1 1 32 32 GLN CB C 32 28.285 28.285 28.595 -0.309 18400
161 1 1 . 1 1 32 32 GLN H H 32 8.438 8.438 7.867 0.571 18400
162 1 1 . 1 1 33 33 ALA N N 33 121.972 121.972 122.665 -0.693 18400
163 1 1 . 1 1 33 33 ALA HA H 33 4.282 4.282 4.139 0.143 18400
164 1 1 . 1 1 33 33 ALA C C 33 181.426 181.426 179.792 1.634 18400
165 1 1 . 1 1 33 33 ALA CA C 33 55.082 55.082 55.090 -0.008 18400
166 1 1 . 1 1 33 33 ALA CB C 33 18.720 18.720 18.620 0.100 18400
167 1 1 . 1 1 33 33 ALA H H 33 7.099 7.099 7.483 -0.384 18400
168 1 1 . 1 1 34 34 LEU N N 34 119.898 119.898 119.069 0.829 18400
169 1 1 . 1 1 34 34 LEU HA H 34 4.297 4.297 4.622 -0.325 18400
170 1 1 . 1 1 34 34 LEU C C 34 182.198 182.198 180.167 2.031 18400
171 1 1 . 1 1 34 34 LEU CA C 34 57.310 57.310 56.874 0.436 18400
172 1 1 . 1 1 34 34 LEU CB C 34 40.490 40.490 42.233 -1.743 18400
173 1 1 . 1 1 34 34 LEU H H 34 8.538 8.538 8.771 -0.233 18400
174 1 1 . 1 1 35 35 ALA N N 35 122.660 122.660 122.139 0.521 18400
175 1 1 . 1 1 35 35 ALA HA H 35 4.222 4.222 4.088 0.134 18400
176 1 1 . 1 1 35 35 ALA C C 35 179.762 179.762 179.246 0.516 18400
177 1 1 . 1 1 35 35 ALA CA C 35 54.226 54.226 54.683 -0.457 18400
178 1 1 . 1 1 35 35 ALA CB C 35 17.744 17.744 18.286 -0.542 18400
179 1 1 . 1 1 35 35 ALA H H 35 7.741 7.741 8.482 -0.741 18400
180 1 1 . 1 1 36 36 GLU N N 36 116.640 116.640 117.065 -0.425 18400
181 1 1 . 1 1 36 36 GLU HA H 36 4.403 4.403 4.279 0.124 18400
182 1 1 . 1 1 36 36 GLU C C 36 177.531 177.531 177.347 0.184 18400
183 1 1 . 1 1 36 36 GLU CA C 36 55.856 55.856 56.707 -0.851 18400
184 1 1 . 1 1 36 36 GLU CB C 36 29.741 29.741 29.982 -0.241 18400
185 1 1 . 1 1 36 36 GLU H H 36 7.496 7.496 7.733 -0.237 18400
186 1 1 . 1 1 37 37 GLY N N 37 106.885 106.885 105.370 1.515 18400
187 1 1 . 1 1 37 37 GLY C C 37 176.072 176.072 174.494 1.578 18400
188 1 1 . 1 1 37 37 GLY CA C 37 45.369 45.369 44.928 0.441 18400
189 1 1 . 1 1 37 37 GLY H H 37 7.802 7.802 8.022 -0.220 18400
190 1 1 . 1 1 38 38 LYS N N 38 120.419 120.419 120.871 -0.452 18400
191 1 1 . 1 1 38 38 LYS HA H 38 4.479 4.479 4.489 -0.010 18400
192 1 1 . 1 1 38 38 LYS C C 38 174.921 174.921 175.607 -0.686 18400
193 1 1 . 1 1 38 38 LYS CA C 38 55.927 55.927 55.311 0.616 18400
194 1 1 . 1 1 38 38 LYS CB C 38 31.850 31.850 33.327 -1.477 18400
195 1 1 . 1 1 38 38 LYS H H 38 7.935 7.935 7.375 0.560 18400
196 1 1 . 1 1 39 39 SER N N 39 114.172 114.172 114.640 -0.468 18400
197 1 1 . 1 1 39 39 SER HA H 39 4.812 4.812 4.513 0.299 18400
198 1 1 . 1 1 39 39 SER C C 39 176.690 176.690 175.879 0.811 18400
199 1 1 . 1 1 39 39 SER CA C 39 56.473 56.473 56.541 -0.068 18400
200 1 1 . 1 1 39 39 SER CB C 39 65.933 65.933 64.114 1.819 18400
201 1 1 . 1 1 39 39 SER H H 39 8.579 8.579 8.634 -0.055 18400
202 1 1 . 1 1 40 40 LEU N N 40 126.212 126.212 122.404 3.808 18400
203 1 1 . 1 1 40 40 LEU HA H 40 4.201 4.201 4.039 0.162 18400
204 1 1 . 1 1 40 40 LEU C C 40 179.329 179.329 177.695 1.634 18400
205 1 1 . 1 1 40 40 LEU CA C 40 58.049 58.049 56.113 1.936 18400
206 1 1 . 1 1 40 40 LEU CB C 40 41.038 41.038 40.946 0.092 18400
207 1 1 . 1 1 40 40 LEU H H 40 9.038 9.038 8.937 0.101 18400
208 1 1 . 1 1 41 41 ASP N N 41 115.700 115.700 118.693 -2.993 18400
209 1 1 . 1 1 41 41 ASP HA H 41 4.580 4.580 3.998 0.582 18400
210 1 1 . 1 1 41 41 ASP C C 41 179.063 179.063 178.131 0.932 18400
211 1 1 . 1 1 41 41 ASP CA C 41 56.353 56.353 56.322 0.031 18400
212 1 1 . 1 1 41 41 ASP CB C 41 40.217 40.217 39.611 0.606 18400
213 1 1 . 1 1 41 41 ASP H H 41 8.217 8.217 8.291 -0.074 18400
214 1 1 . 1 1 42 42 ASP N N 42 119.466 119.466 120.286 -0.820 18400
215 1 1 . 1 1 42 42 ASP HA H 42 4.422 4.422 4.438 -0.016 18400
216 1 1 . 1 1 42 42 ASP C C 42 177.484 177.484 177.250 0.234 18400
217 1 1 . 1 1 42 42 ASP CB C 42 40.234 40.234 40.851 -0.617 18400
218 1 1 . 1 1 42 42 ASP H H 42 7.959 7.959 7.585 0.374 18400
219 1 1 . 1 1 43 43 PHE N N 43 117.109 117.109 116.235 0.874 18400
220 1 1 . 1 1 43 43 PHE HA H 43 4.873 4.873 4.693 0.180 18400
221 1 1 . 1 1 43 43 PHE C C 43 175.641 175.641 174.936 0.705 18400
222 1 1 . 1 1 43 43 PHE CA C 43 58.196 58.196 55.380 2.816 18400
223 1 1 . 1 1 43 43 PHE CB C 43 39.344 39.344 38.407 0.937 18400
224 1 1 . 1 1 43 43 PHE H H 43 8.320 8.320 7.532 0.788 18400
225 1 1 . 1 1 44 44 LEU N N 44 122.188 122.188 119.509 2.679 18400
226 1 1 . 1 1 44 44 LEU HA H 44 4.428 4.428 4.215 0.213 18400
227 1 1 . 1 1 44 44 LEU C C 44 178.294 178.294 177.018 1.276 18400
228 1 1 . 1 1 44 44 LEU CA C 44 56.434 56.434 55.276 1.158 18400
229 1 1 . 1 1 44 44 LEU CB C 44 42.835 42.835 41.551 1.284 18400
230 1 1 . 1 1 44 44 LEU H H 44 7.387 7.387 7.070 0.317 18400
231 1 2 . 1 1 2 2 GLN N N 2 122.420 122.420 119.947 2.473 18400
232 1 2 . 1 1 2 2 GLN HA H 2 4.665 4.665 4.525 0.140 18400
233 1 2 . 1 1 2 2 GLN CA C 2 53.740 53.740 54.117 -0.376 18400
234 1 2 . 1 1 2 2 GLN CB C 2 28.509 28.509 29.074 -0.565 18400
235 1 2 . 1 1 2 2 GLN H H 2 8.573 8.573 7.875 0.698 18400
236 1 2 . 1 1 3 3 PRO HA H 3 4.464 4.464 4.439 0.025 18400
237 1 2 . 1 1 3 3 PRO C C 3 177.173 177.173 176.172 1.001 18400
238 1 2 . 1 1 3 3 PRO CA C 3 62.946 62.946 62.258 0.688 18400
239 1 2 . 1 1 3 3 PRO CB C 3 32.109 32.109 32.618 -0.509 18400
240 1 2 . 1 1 4 4 ARG N N 4 122.684 122.684 120.567 2.117 18400
241 1 2 . 1 1 4 4 ARG HA H 4 4.578 4.578 4.211 0.367 18400
242 1 2 . 1 1 4 4 ARG CA C 4 53.646 53.646 55.697 -2.051 18400
243 1 2 . 1 1 4 4 ARG CB C 4 29.634 29.634 29.412 0.222 18400
244 1 2 . 1 1 4 4 ARG H H 4 8.438 8.438 8.468 -0.030 18400
245 1 2 . 1 1 5 5 PRO HA H 5 4.400 4.400 4.550 -0.150 18400
246 1 2 . 1 1 5 5 PRO C C 5 177.137 177.137 175.783 1.354 18400
247 1 2 . 1 1 5 5 PRO CA C 5 62.490 62.490 62.455 0.035 18400
248 1 2 . 1 1 5 5 PRO CB C 5 31.928 31.928 32.268 -0.340 18400
249 1 2 . 1 1 6 6 ALA N N 6 123.540 123.540 126.518 -2.978 18400
250 1 2 . 1 1 6 6 ALA HA H 6 3.919 3.919 4.324 -0.405 18400
251 1 2 . 1 1 6 6 ALA C C 6 176.845 176.845 176.052 0.793 18400
252 1 2 . 1 1 6 6 ALA CA C 6 53.270 53.270 51.116 2.154 18400
253 1 2 . 1 1 6 6 ALA CB C 6 19.045 19.045 20.039 -0.994 18400
254 1 2 . 1 1 6 6 ALA H H 6 8.360 8.360 8.017 0.343 18400
255 1 2 . 1 1 7 7 LYS N N 7 121.074 121.074 120.196 0.878 18400
256 1 2 . 1 1 7 7 LYS HA H 7 4.306 4.306 4.389 -0.083 18400
257 1 2 . 1 1 7 7 LYS C C 7 175.113 175.113 174.266 0.847 18400
258 1 2 . 1 1 7 7 LYS CA C 7 56.621 56.621 55.753 0.868 18400
259 1 2 . 1 1 7 7 LYS CB C 7 36.158 36.158 32.990 3.168 18400
260 1 2 . 1 1 7 7 LYS H H 7 7.691 7.691 7.825 -0.134 18400
261 1 2 . 1 1 8 8 TYR N N 8 117.325 117.325 121.263 -3.938 18400
262 1 2 . 1 1 8 8 TYR HA H 8 5.660 5.660 4.690 0.970 18400
263 1 2 . 1 1 8 8 TYR C C 8 175.278 175.278 174.261 1.017 18400
264 1 2 . 1 1 8 8 TYR CA C 8 56.011 56.011 56.395 -0.384 18400
265 1 2 . 1 1 8 8 TYR CB C 8 42.531 42.531 42.795 -0.264 18400
266 1 2 . 1 1 8 8 TYR H H 8 8.349 8.349 8.234 0.115 18400
267 1 2 . 1 1 9 9 LYS N N 9 120.812 120.812 122.390 -1.578 18400
268 1 2 . 1 1 9 9 LYS HA H 9 5.647 5.647 4.914 0.733 18400
269 1 2 . 1 1 9 9 LYS C C 9 174.978 174.978 175.146 -0.168 18400
270 1 2 . 1 1 9 9 LYS CA C 9 54.767 54.767 55.888 -1.121 18400
271 1 2 . 1 1 9 9 LYS CB C 9 36.033 36.033 34.583 1.450 18400
272 1 2 . 1 1 9 9 LYS H H 9 9.648 9.648 8.961 0.687 18400
273 1 2 . 1 1 10 10 PHE N N 10 118.595 118.595 124.907 -6.312 18400
274 1 2 . 1 1 10 10 PHE HA H 10 5.220 5.220 4.915 0.305 18400
275 1 2 . 1 1 10 10 PHE C C 10 172.698 172.698 172.322 0.376 18400
276 1 2 . 1 1 10 10 PHE CA C 10 55.854 55.854 56.567 -0.713 18400
277 1 2 . 1 1 10 10 PHE CB C 10 40.607 40.607 42.028 -1.421 18400
278 1 2 . 1 1 10 10 PHE H H 10 8.890 8.890 8.467 0.423 18400
279 1 2 . 1 1 11 11 THR N N 11 117.249 117.249 117.576 -0.327 18400
280 1 2 . 1 1 11 11 THR HA H 11 4.745 4.745 4.350 0.395 18400
281 1 2 . 1 1 11 11 THR C C 11 175.071 175.071 172.807 2.264 18400
282 1 2 . 1 1 11 11 THR CA C 11 61.667 61.667 60.672 0.995 18400
283 1 2 . 1 1 11 11 THR CB C 11 69.324 69.324 69.897 -0.573 18400
284 1 2 . 1 1 11 11 THR H H 11 8.904 8.904 7.661 1.243 18400
285 1 2 . 1 1 12 12 ASP N N 12 127.813 127.813 126.247 1.566 18400
286 1 2 . 1 1 12 12 ASP HA H 12 4.903 4.903 4.077 0.826 18400
287 1 2 . 1 1 12 12 ASP C C 12 179.041 179.041 177.127 1.914 18400
288 1 2 . 1 1 12 12 ASP CA C 12 52.773 52.773 55.013 -2.240 18400
289 1 2 . 1 1 12 12 ASP CB C 12 38.879 38.879 41.317 -2.438 18400
290 1 2 . 1 1 12 12 ASP H H 12 8.993 8.993 7.959 1.034 18400
291 1 2 . 1 1 13 13 VAL N N 13 117.388 117.388 119.601 -2.213 18400
292 1 2 . 1 1 13 13 VAL HA H 13 3.990 3.990 3.823 0.167 18400
293 1 2 . 1 1 13 13 VAL C C 13 176.796 176.796 175.955 0.841 18400
294 1 2 . 1 1 13 13 VAL CA C 13 64.349 64.349 63.998 0.351 18400
295 1 2 . 1 1 13 13 VAL CB C 13 31.652 31.652 31.673 -0.021 18400
296 1 2 . 1 1 13 13 VAL H H 13 8.950 8.950 8.541 0.409 18400
297 1 2 . 1 1 14 14 ASN N N 14 117.303 117.303 116.868 0.435 18400
298 1 2 . 1 1 14 14 ASN HA H 14 4.781 4.781 4.686 0.095 18400
299 1 2 . 1 1 14 14 ASN C C 14 176.606 176.606 175.379 1.227 18400
300 1 2 . 1 1 14 14 ASN CB C 14 38.851 38.851 39.072 -0.221 18400
301 1 2 . 1 1 14 14 ASN H H 14 8.011 8.011 8.166 -0.155 18400
302 1 2 . 1 1 15 15 GLY N N 15 108.443 108.443 107.947 0.496 18400
303 1 2 . 1 1 15 15 GLY C C 15 174.799 174.799 173.523 1.276 18400
304 1 2 . 1 1 15 15 GLY CA C 15 45.246 45.246 44.899 0.347 18400
305 1 2 . 1 1 15 15 GLY H H 15 8.288 8.288 7.510 0.778 18400
306 1 2 . 1 1 16 16 GLU N N 16 122.005 122.005 119.749 2.256 18400
307 1 2 . 1 1 16 16 GLU HA H 16 4.373 4.373 4.375 -0.002 18400
308 1 2 . 1 1 16 16 GLU C C 16 176.564 176.564 175.354 1.210 18400
309 1 2 . 1 1 16 16 GLU CA C 16 55.798 55.798 56.616 -0.818 18400
310 1 2 . 1 1 16 16 GLU CB C 16 30.932 30.932 30.028 0.904 18400
311 1 2 . 1 1 16 16 GLU H H 16 8.045 8.045 8.039 0.006 18400
312 1 2 . 1 1 17 17 THR N N 17 120.458 120.458 115.063 5.395 18400
313 1 2 . 1 1 17 17 THR HA H 17 4.583 4.583 4.983 -0.400 18400
314 1 2 . 1 1 17 17 THR C C 17 174.583 174.583 173.525 1.058 18400
315 1 2 . 1 1 17 17 THR CA C 17 63.471 63.471 61.364 2.107 18400
316 1 2 . 1 1 17 17 THR CB C 17 69.004 69.004 69.535 -0.531 18400
317 1 2 . 1 1 17 17 THR H H 17 8.758 8.758 8.355 0.403 18400
318 1 2 . 1 1 18 18 LYS N N 18 129.000 129.000 125.076 3.924 18400
319 1 2 . 1 1 18 18 LYS HA H 18 4.581 4.581 4.843 -0.262 18400
320 1 2 . 1 1 18 18 LYS C C 18 174.995 174.995 174.868 0.127 18400
321 1 2 . 1 1 18 18 LYS CB C 18 36.219 36.219 36.398 -0.179 18400
322 1 2 . 1 1 18 18 LYS H H 18 8.848 8.848 8.378 0.470 18400
323 1 2 . 1 1 19 19 THR N N 19 107.308 107.308 112.619 -5.311 18400
324 1 2 . 1 1 19 19 THR HA H 19 5.662 5.662 4.832 0.830 18400
325 1 2 . 1 1 19 19 THR C C 19 175.135 175.135 174.032 1.103 18400
326 1 2 . 1 1 19 19 THR CA C 19 59.541 59.541 62.316 -2.775 18400
327 1 2 . 1 1 19 19 THR CB C 19 72.571 72.571 69.389 3.182 18400
328 1 2 . 1 1 19 19 THR H H 19 8.023 8.023 8.307 -0.284 18400
329 1 2 . 1 1 20 20 TRP N N 20 120.113 120.113 127.412 -7.299 18400
330 1 2 . 1 1 20 20 TRP HA H 20 5.793 5.793 4.530 1.263 18400
331 1 2 . 1 1 20 20 TRP CA C 20 55.233 55.233 56.985 -1.752 18400
332 1 2 . 1 1 20 20 TRP CB C 20 33.193 33.193 31.400 1.793 18400
333 1 2 . 1 1 20 20 TRP H H 20 9.317 9.317 8.376 0.941 18400
334 1 2 . 1 1 21 21 THR HA H 21 4.280 4.280 4.379 -0.099 18400
335 1 2 . 1 1 21 21 THR CA C 21 62.844 62.844 61.963 0.881 18400
336 1 2 . 1 1 21 21 THR CB C 21 70.918 70.918 70.441 0.477 18400
337 1 2 . 1 1 21 21 THR H H 21 8.449 8.449 7.772 0.677 18400
338 1 2 . 1 1 22 22 GLY C C 22 172.841 172.841 172.767 0.074 18400
339 1 2 . 1 1 22 22 GLY CA C 22 44.229 44.229 44.490 -0.261 18400
340 1 2 . 1 1 22 22 GLY H H 22 7.928 7.928 7.604 0.324 18400
341 1 2 . 1 1 23 23 GLN N N 23 117.973 117.973 119.828 -1.855 18400
342 1 2 . 1 1 23 23 GLN HA H 23 4.533 4.533 3.973 0.560 18400
343 1 2 . 1 1 23 23 GLN C C 23 176.979 176.979 175.986 0.993 18400
344 1 2 . 1 1 23 23 GLN CA C 23 54.099 54.099 57.852 -3.753 18400
345 1 2 . 1 1 23 23 GLN CB C 23 30.565 30.565 29.463 1.102 18400
346 1 2 . 1 1 23 23 GLN H H 23 7.141 7.141 6.798 0.343 18400
347 1 2 . 1 1 24 24 GLY N N 24 111.998 111.998 105.043 6.955 18400
348 1 2 . 1 1 24 24 GLY C C 24 174.510 174.510 173.228 1.282 18400
349 1 2 . 1 1 24 24 GLY CA C 24 44.906 44.906 45.316 -0.410 18400
350 1 2 . 1 1 24 24 GLY H H 24 8.841 8.841 8.675 0.166 18400
351 1 2 . 1 1 25 25 ARG N N 25 121.958 121.958 123.840 -1.882 18400
352 1 2 . 1 1 25 25 ARG HA H 25 4.179 4.179 4.381 -0.202 18400
353 1 2 . 1 1 25 25 ARG C C 25 177.025 177.025 175.763 1.262 18400
354 1 2 . 1 1 25 25 ARG CA C 25 56.285 56.285 56.794 -0.509 18400
355 1 2 . 1 1 25 25 ARG CB C 25 29.885 29.885 30.378 -0.493 18400
356 1 2 . 1 1 25 25 ARG H H 25 8.444 8.444 8.285 0.159 18400
357 1 2 . 1 1 26 26 THR N N 26 122.468 122.468 119.445 3.023 18400
358 1 2 . 1 1 26 26 THR HA H 26 3.226 3.226 4.727 -1.501 18400
359 1 2 . 1 1 26 26 THR CA C 26 60.422 60.422 58.908 1.514 18400
360 1 2 . 1 1 26 26 THR CB C 26 69.088 69.088 68.540 0.548 18400
361 1 2 . 1 1 26 26 THR H H 26 8.369 8.369 8.373 -0.004 18400
362 1 2 . 1 1 27 27 PRO HA H 27 3.867 3.867 4.205 -0.338 18400
363 1 2 . 1 1 27 27 PRO C C 27 177.571 177.571 178.200 -0.629 18400
364 1 2 . 1 1 27 27 PRO CA C 27 62.174 62.174 62.936 -0.762 18400
365 1 2 . 1 1 27 27 PRO CB C 27 32.818 32.818 31.908 0.910 18400
366 1 2 . 1 1 28 28 LYS N N 28 126.298 126.298 121.617 4.681 18400
367 1 2 . 1 1 28 28 LYS HA H 28 3.925 3.925 3.990 -0.065 18400
368 1 2 . 1 1 28 28 LYS CA C 28 60.815 60.815 60.815 -0.000 18400
369 1 2 . 1 1 28 28 LYS H H 28 8.903 8.903 8.848 0.055 18400
370 1 2 . 1 1 29 29 PRO HA H 29 4.289 4.289 4.429 -0.140 18400
371 1 2 . 1 1 29 29 PRO C C 29 180.695 180.695 179.037 1.658 18400
372 1 2 . 1 1 29 29 PRO CA C 29 65.875 65.875 65.442 0.433 18400
373 1 2 . 1 1 29 29 PRO CB C 29 31.770 31.770 31.299 0.471 18400
374 1 2 . 1 1 30 30 ILE N N 30 114.387 114.387 118.057 -3.670 18400
375 1 2 . 1 1 30 30 ILE HA H 30 3.021 3.021 4.035 -1.014 18400
376 1 2 . 1 1 30 30 ILE C C 30 176.633 176.633 178.135 -1.502 18400
377 1 2 . 1 1 30 30 ILE CA C 30 63.949 63.949 63.971 -0.022 18400
378 1 2 . 1 1 30 30 ILE CB C 30 36.650 36.650 36.774 -0.124 18400
379 1 2 . 1 1 30 30 ILE H H 30 6.051 6.051 7.963 -1.912 18400
380 1 2 . 1 1 31 31 ALA N N 31 123.060 123.060 122.287 0.773 18400
381 1 2 . 1 1 31 31 ALA HA H 31 3.720 3.720 3.971 -0.251 18400
382 1 2 . 1 1 31 31 ALA C C 31 181.571 181.571 179.743 1.828 18400
383 1 2 . 1 1 31 31 ALA CA C 31 55.456 55.456 55.900 -0.444 18400
384 1 2 . 1 1 31 31 ALA CB C 31 17.825 17.825 17.881 -0.056 18400
385 1 2 . 1 1 31 31 ALA H H 31 7.922 7.922 8.856 -0.934 18400
386 1 2 . 1 1 32 32 GLN N N 32 117.568 117.568 118.730 -1.162 18400
387 1 2 . 1 1 32 32 GLN HA H 32 3.934 3.934 3.995 -0.061 18400
388 1 2 . 1 1 32 32 GLN C C 32 178.025 178.025 178.514 -0.489 18400
389 1 2 . 1 1 32 32 GLN CA C 32 58.424 58.424 58.822 -0.398 18400
390 1 2 . 1 1 32 32 GLN CB C 32 28.285 28.285 28.542 -0.257 18400
391 1 2 . 1 1 32 32 GLN H H 32 8.438 8.438 7.885 0.553 18400
392 1 2 . 1 1 33 33 ALA N N 33 121.972 121.972 122.757 -0.785 18400
393 1 2 . 1 1 33 33 ALA HA H 33 4.282 4.282 4.171 0.111 18400
394 1 2 . 1 1 33 33 ALA C C 33 181.426 181.426 179.640 1.786 18400
395 1 2 . 1 1 33 33 ALA CA C 33 55.082 55.082 55.023 0.059 18400
396 1 2 . 1 1 33 33 ALA CB C 33 18.720 18.720 18.555 0.165 18400
397 1 2 . 1 1 33 33 ALA H H 33 7.099 7.099 7.490 -0.391 18400
398 1 2 . 1 1 34 34 LEU N N 34 119.898 119.898 119.307 0.591 18400
399 1 2 . 1 1 34 34 LEU HA H 34 4.297 4.297 4.608 -0.311 18400
400 1 2 . 1 1 34 34 LEU C C 34 182.198 182.198 180.171 2.027 18400
401 1 2 . 1 1 34 34 LEU CA C 34 57.310 57.310 57.019 0.291 18400
402 1 2 . 1 1 34 34 LEU CB C 34 40.490 40.490 42.219 -1.729 18400
403 1 2 . 1 1 34 34 LEU H H 34 8.538 8.538 8.752 -0.214 18400
404 1 2 . 1 1 35 35 ALA N N 35 122.660 122.660 121.619 1.041 18400
405 1 2 . 1 1 35 35 ALA HA H 35 4.222 4.222 4.097 0.125 18400
406 1 2 . 1 1 35 35 ALA C C 35 179.762 179.762 179.109 0.653 18400
407 1 2 . 1 1 35 35 ALA CA C 35 54.226 54.226 54.668 -0.442 18400
408 1 2 . 1 1 35 35 ALA CB C 35 17.744 17.744 18.189 -0.446 18400
409 1 2 . 1 1 35 35 ALA H H 35 7.741 7.741 8.512 -0.771 18400
410 1 2 . 1 1 36 36 GLU N N 36 116.640 116.640 116.973 -0.333 18400
411 1 2 . 1 1 36 36 GLU HA H 36 4.403 4.403 4.269 0.134 18400
412 1 2 . 1 1 36 36 GLU C C 36 177.531 177.531 177.458 0.073 18400
413 1 2 . 1 1 36 36 GLU CA C 36 55.856 55.856 56.574 -0.718 18400
414 1 2 . 1 1 36 36 GLU CB C 36 29.741 29.741 29.960 -0.220 18400
415 1 2 . 1 1 36 36 GLU H H 36 7.496 7.496 7.722 -0.226 18400
416 1 2 . 1 1 37 37 GLY N N 37 106.885 106.885 106.504 0.381 18400
417 1 2 . 1 1 37 37 GLY C C 37 176.072 176.072 174.503 1.569 18400
418 1 2 . 1 1 37 37 GLY CA C 37 45.369 45.369 44.912 0.457 18400
419 1 2 . 1 1 37 37 GLY H H 37 7.802 7.802 8.113 -0.311 18400
420 1 2 . 1 1 38 38 LYS N N 38 120.419 120.419 121.275 -0.856 18400
421 1 2 . 1 1 38 38 LYS HA H 38 4.479 4.479 4.610 -0.131 18400
422 1 2 . 1 1 38 38 LYS C C 38 174.921 174.921 175.684 -0.763 18400
423 1 2 . 1 1 38 38 LYS CA C 38 55.927 55.927 55.074 0.853 18400
424 1 2 . 1 1 38 38 LYS CB C 38 31.850 31.850 33.546 -1.696 18400
425 1 2 . 1 1 38 38 LYS H H 38 7.935 7.935 7.529 0.406 18400
426 1 2 . 1 1 39 39 SER N N 39 114.172 114.172 114.589 -0.417 18400
427 1 2 . 1 1 39 39 SER HA H 39 4.812 4.812 4.458 0.354 18400
428 1 2 . 1 1 39 39 SER C C 39 176.690 176.690 176.241 0.449 18400
429 1 2 . 1 1 39 39 SER CA C 39 56.473 56.473 56.839 -0.366 18400
430 1 2 . 1 1 39 39 SER CB C 39 65.933 65.933 64.157 1.776 18400
431 1 2 . 1 1 39 39 SER H H 39 8.579 8.579 8.507 0.072 18400
432 1 2 . 1 1 40 40 LEU N N 40 126.212 126.212 122.721 3.491 18400
433 1 2 . 1 1 40 40 LEU HA H 40 4.201 4.201 4.050 0.151 18400
434 1 2 . 1 1 40 40 LEU C C 40 179.329 179.329 178.201 1.128 18400
435 1 2 . 1 1 40 40 LEU CA C 40 58.049 58.049 56.045 2.004 18400
436 1 2 . 1 1 40 40 LEU CB C 40 41.038 41.038 41.146 -0.108 18400
437 1 2 . 1 1 40 40 LEU H H 40 9.038 9.038 8.963 0.075 18400
438 1 2 . 1 1 41 41 ASP N N 41 115.700 115.700 118.785 -3.085 18400
439 1 2 . 1 1 41 41 ASP HA H 41 4.580 4.580 4.046 0.534 18400
440 1 2 . 1 1 41 41 ASP C C 41 179.063 179.063 178.257 0.806 18400
441 1 2 . 1 1 41 41 ASP CA C 41 56.353 56.353 57.094 -0.741 18400
442 1 2 . 1 1 41 41 ASP CB C 41 40.217 40.217 40.246 -0.029 18400
443 1 2 . 1 1 41 41 ASP H H 41 8.217 8.217 8.162 0.055 18400
444 1 2 . 1 1 42 42 ASP N N 42 119.466 119.466 119.330 0.136 18400
445 1 2 . 1 1 42 42 ASP HA H 42 4.422 4.422 4.424 -0.002 18400
446 1 2 . 1 1 42 42 ASP C C 42 177.484 177.484 177.045 0.439 18400
447 1 2 . 1 1 42 42 ASP CB C 42 40.234 40.234 40.953 -0.719 18400
448 1 2 . 1 1 42 42 ASP H H 42 7.959 7.959 7.495 0.464 18400
449 1 2 . 1 1 43 43 PHE N N 43 117.109 117.109 117.327 -0.218 18400
450 1 2 . 1 1 43 43 PHE HA H 43 4.873 4.873 4.624 0.249 18400
451 1 2 . 1 1 43 43 PHE C C 43 175.641 175.641 175.420 0.221 18400
452 1 2 . 1 1 43 43 PHE CA C 43 58.196 58.196 56.246 1.950 18400
453 1 2 . 1 1 43 43 PHE CB C 43 39.344 39.344 39.028 0.316 18400
454 1 2 . 1 1 43 43 PHE H H 43 8.320 8.320 7.423 0.897 18400
455 1 2 . 1 1 44 44 LEU N N 44 122.188 122.188 118.023 4.165 18400
456 1 2 . 1 1 44 44 LEU HA H 44 4.428 4.428 4.173 0.255 18400
457 1 2 . 1 1 44 44 LEU C C 44 178.294 178.294 177.180 1.114 18400
458 1 2 . 1 1 44 44 LEU CA C 44 56.434 56.434 55.237 1.197 18400
459 1 2 . 1 1 44 44 LEU CB C 44 42.835 42.835 41.521 1.314 18400
460 1 2 . 1 1 44 44 LEU H H 44 7.387 7.387 7.222 0.165 18400
461 1 3 . 1 1 2 2 GLN N N 2 122.420 122.420 119.932 2.488 18400
462 1 3 . 1 1 2 2 GLN HA H 2 4.665 4.665 5.093 -0.428 18400
463 1 3 . 1 1 2 2 GLN CA C 2 53.740 53.740 53.774 -0.034 18400
464 1 3 . 1 1 2 2 GLN CB C 2 28.509 28.509 29.773 -1.264 18400
465 1 3 . 1 1 2 2 GLN H H 2 8.573 8.573 7.889 0.684 18400
466 1 3 . 1 1 3 3 PRO HA H 3 4.464 4.464 4.534 -0.070 18400
467 1 3 . 1 1 3 3 PRO C C 3 177.173 177.173 176.037 1.136 18400
468 1 3 . 1 1 3 3 PRO CA C 3 62.946 62.946 61.959 0.987 18400
469 1 3 . 1 1 3 3 PRO CB C 3 32.109 32.109 32.332 -0.223 18400
470 1 3 . 1 1 4 4 ARG N N 4 122.684 122.684 120.385 2.299 18400
471 1 3 . 1 1 4 4 ARG HA H 4 4.578 4.578 4.234 0.344 18400
472 1 3 . 1 1 4 4 ARG CA C 4 53.646 53.646 55.402 -1.756 18400
473 1 3 . 1 1 4 4 ARG CB C 4 29.634 29.634 28.954 0.680 18400
474 1 3 . 1 1 4 4 ARG H H 4 8.438 8.438 8.495 -0.057 18400
475 1 3 . 1 1 5 5 PRO HA H 5 4.400 4.400 4.525 -0.125 18400
476 1 3 . 1 1 5 5 PRO C C 5 177.137 177.137 175.829 1.308 18400
477 1 3 . 1 1 5 5 PRO CA C 5 62.490 62.490 62.355 0.135 18400
478 1 3 . 1 1 5 5 PRO CB C 5 31.928 31.928 32.314 -0.386 18400
479 1 3 . 1 1 6 6 ALA N N 6 123.540 123.540 127.032 -3.492 18400
480 1 3 . 1 1 6 6 ALA HA H 6 3.919 3.919 4.203 -0.284 18400
481 1 3 . 1 1 6 6 ALA C C 6 176.845 176.845 176.443 0.402 18400
482 1 3 . 1 1 6 6 ALA CA C 6 53.270 53.270 51.359 1.911 18400
483 1 3 . 1 1 6 6 ALA CB C 6 19.045 19.045 19.578 -0.533 18400
484 1 3 . 1 1 6 6 ALA H H 6 8.360 8.360 8.129 0.231 18400
485 1 3 . 1 1 7 7 LYS N N 7 121.074 121.074 119.831 1.243 18400
486 1 3 . 1 1 7 7 LYS HA H 7 4.306 4.306 4.280 0.026 18400
487 1 3 . 1 1 7 7 LYS C C 7 175.113 175.113 174.535 0.578 18400
488 1 3 . 1 1 7 7 LYS CA C 7 56.621 56.621 55.584 1.038 18400
489 1 3 . 1 1 7 7 LYS CB C 7 36.158 36.158 31.958 4.200 18400
490 1 3 . 1 1 7 7 LYS H H 7 7.691 7.691 7.926 -0.235 18400
491 1 3 . 1 1 8 8 TYR N N 8 117.325 117.325 121.703 -4.378 18400
492 1 3 . 1 1 8 8 TYR HA H 8 5.660 5.660 4.645 1.015 18400
493 1 3 . 1 1 8 8 TYR C C 8 175.278 175.278 174.178 1.100 18400
494 1 3 . 1 1 8 8 TYR CA C 8 56.011 56.011 56.548 -0.537 18400
495 1 3 . 1 1 8 8 TYR CB C 8 42.531 42.531 42.904 -0.373 18400
496 1 3 . 1 1 8 8 TYR H H 8 8.349 8.349 8.255 0.094 18400
497 1 3 . 1 1 9 9 LYS N N 9 120.812 120.812 122.355 -1.543 18400
498 1 3 . 1 1 9 9 LYS HA H 9 5.647 5.647 4.973 0.674 18400
499 1 3 . 1 1 9 9 LYS C C 9 174.978 174.978 175.249 -0.271 18400
500 1 3 . 1 1 9 9 LYS CA C 9 54.767 54.767 55.851 -1.084 18400
501 1 3 . 1 1 9 9 LYS CB C 9 36.033 36.033 34.527 1.506 18400
502 1 3 . 1 1 9 9 LYS H H 9 9.648 9.648 8.890 0.758 18400
503 1 3 . 1 1 10 10 PHE N N 10 118.595 118.595 124.929 -6.334 18400
504 1 3 . 1 1 10 10 PHE HA H 10 5.220 5.220 4.864 0.356 18400
505 1 3 . 1 1 10 10 PHE C C 10 172.698 172.698 172.500 0.198 18400
506 1 3 . 1 1 10 10 PHE CA C 10 55.854 55.854 56.390 -0.536 18400
507 1 3 . 1 1 10 10 PHE CB C 10 40.607 40.607 42.264 -1.657 18400
508 1 3 . 1 1 10 10 PHE H H 10 8.890 8.890 8.498 0.392 18400
509 1 3 . 1 1 11 11 THR N N 11 117.249 117.249 112.358 4.891 18400
510 1 3 . 1 1 11 11 THR HA H 11 4.745 4.745 4.365 0.380 18400
511 1 3 . 1 1 11 11 THR C C 11 175.071 175.071 173.329 1.742 18400
512 1 3 . 1 1 11 11 THR CA C 11 61.667 61.667 60.109 1.558 18400
513 1 3 . 1 1 11 11 THR CB C 11 69.324 69.324 69.800 -0.476 18400
514 1 3 . 1 1 11 11 THR H H 11 8.904 8.904 7.616 1.288 18400
515 1 3 . 1 1 12 12 ASP N N 12 127.813 127.813 126.825 0.988 18400
516 1 3 . 1 1 12 12 ASP HA H 12 4.903 4.903 4.019 0.884 18400
517 1 3 . 1 1 12 12 ASP C C 12 179.041 179.041 177.439 1.602 18400
518 1 3 . 1 1 12 12 ASP CA C 12 52.773 52.773 55.266 -2.493 18400
519 1 3 . 1 1 12 12 ASP CB C 12 38.879 38.879 41.318 -2.439 18400
520 1 3 . 1 1 12 12 ASP H H 12 8.993 8.993 8.457 0.536 18400
521 1 3 . 1 1 13 13 VAL N N 13 117.388 117.388 118.257 -0.869 18400
522 1 3 . 1 1 13 13 VAL HA H 13 3.990 3.990 3.770 0.220 18400
523 1 3 . 1 1 13 13 VAL C C 13 176.796 176.796 176.113 0.683 18400
524 1 3 . 1 1 13 13 VAL CA C 13 64.349 64.349 64.121 0.228 18400
525 1 3 . 1 1 13 13 VAL CB C 13 31.652 31.652 31.710 -0.058 18400
526 1 3 . 1 1 13 13 VAL H H 13 8.950 8.950 8.485 0.465 18400
527 1 3 . 1 1 14 14 ASN N N 14 117.303 117.303 116.257 1.046 18400
528 1 3 . 1 1 14 14 ASN HA H 14 4.781 4.781 4.594 0.187 18400
529 1 3 . 1 1 14 14 ASN C C 14 176.606 176.606 175.767 0.839 18400
530 1 3 . 1 1 14 14 ASN CB C 14 38.851 38.851 38.809 0.042 18400
531 1 3 . 1 1 14 14 ASN H H 14 8.011 8.011 8.282 -0.271 18400
532 1 3 . 1 1 15 15 GLY N N 15 108.443 108.443 108.218 0.225 18400
533 1 3 . 1 1 15 15 GLY C C 15 174.799 174.799 172.781 2.018 18400
534 1 3 . 1 1 15 15 GLY CA C 15 45.246 45.246 44.953 0.293 18400
535 1 3 . 1 1 15 15 GLY H H 15 8.288 8.288 7.409 0.879 18400
536 1 3 . 1 1 16 16 GLU N N 16 122.005 122.005 119.711 2.294 18400
537 1 3 . 1 1 16 16 GLU HA H 16 4.373 4.373 4.250 0.123 18400
538 1 3 . 1 1 16 16 GLU C C 16 176.564 176.564 175.498 1.066 18400
539 1 3 . 1 1 16 16 GLU CA C 16 55.798 55.798 56.312 -0.514 18400
540 1 3 . 1 1 16 16 GLU CB C 16 30.932 30.932 30.108 0.824 18400
541 1 3 . 1 1 16 16 GLU H H 16 8.045 8.045 8.039 0.006 18400
542 1 3 . 1 1 17 17 THR N N 17 120.458 120.458 119.176 1.282 18400
543 1 3 . 1 1 17 17 THR HA H 17 4.583 4.583 5.323 -0.740 18400
544 1 3 . 1 1 17 17 THR C C 17 174.583 174.583 174.655 -0.072 18400
545 1 3 . 1 1 17 17 THR CA C 17 63.471 63.471 61.404 2.067 18400
546 1 3 . 1 1 17 17 THR CB C 17 69.004 69.004 69.668 -0.664 18400
547 1 3 . 1 1 17 17 THR H H 17 8.758 8.758 8.322 0.436 18400
548 1 3 . 1 1 18 18 LYS N N 18 129.000 129.000 125.722 3.278 18400
549 1 3 . 1 1 18 18 LYS HA H 18 4.581 4.581 4.823 -0.242 18400
550 1 3 . 1 1 18 18 LYS C C 18 174.995 174.995 174.955 0.040 18400
551 1 3 . 1 1 18 18 LYS CB C 18 36.219 36.219 36.372 -0.153 18400
552 1 3 . 1 1 18 18 LYS H H 18 8.848 8.848 8.180 0.668 18400
553 1 3 . 1 1 19 19 THR N N 19 107.308 107.308 113.513 -6.205 18400
554 1 3 . 1 1 19 19 THR HA H 19 5.662 5.662 4.798 0.864 18400
555 1 3 . 1 1 19 19 THR C C 19 175.135 175.135 173.907 1.228 18400
556 1 3 . 1 1 19 19 THR CA C 19 59.541 59.541 62.168 -2.627 18400
557 1 3 . 1 1 19 19 THR CB C 19 72.571 72.571 69.043 3.528 18400
558 1 3 . 1 1 19 19 THR H H 19 8.023 8.023 8.327 -0.304 18400
559 1 3 . 1 1 20 20 TRP N N 20 120.113 120.113 127.073 -6.960 18400
560 1 3 . 1 1 20 20 TRP HA H 20 5.793 5.793 4.538 1.255 18400
561 1 3 . 1 1 20 20 TRP CA C 20 55.233 55.233 56.648 -1.415 18400
562 1 3 . 1 1 20 20 TRP CB C 20 33.193 33.193 30.716 2.477 18400
563 1 3 . 1 1 20 20 TRP H H 20 9.317 9.317 8.074 1.243 18400
564 1 3 . 1 1 21 21 THR HA H 21 4.280 4.280 4.238 0.042 18400
565 1 3 . 1 1 21 21 THR CA C 21 62.844 62.844 61.057 1.786 18400
566 1 3 . 1 1 21 21 THR CB C 21 70.918 70.918 69.969 0.949 18400
567 1 3 . 1 1 21 21 THR H H 21 8.449 8.449 7.428 1.021 18400
568 1 3 . 1 1 22 22 GLY C C 22 172.841 172.841 171.888 0.953 18400
569 1 3 . 1 1 22 22 GLY CA C 22 44.229 44.229 44.371 -0.142 18400
570 1 3 . 1 1 22 22 GLY H H 22 7.928 7.928 7.034 0.894 18400
571 1 3 . 1 1 23 23 GLN N N 23 117.973 117.973 124.394 -6.421 18400
572 1 3 . 1 1 23 23 GLN HA H 23 4.533 4.533 4.688 -0.155 18400
573 1 3 . 1 1 23 23 GLN C C 23 176.979 176.979 176.050 0.929 18400
574 1 3 . 1 1 23 23 GLN CA C 23 54.099 54.099 54.818 -0.719 18400
575 1 3 . 1 1 23 23 GLN CB C 23 30.565 30.565 31.511 -0.946 18400
576 1 3 . 1 1 23 23 GLN H H 23 7.141 7.141 7.812 -0.671 18400
577 1 3 . 1 1 24 24 GLY N N 24 111.998 111.998 108.477 3.521 18400
578 1 3 . 1 1 24 24 GLY C C 24 174.510 174.510 174.091 0.419 18400
579 1 3 . 1 1 24 24 GLY CA C 24 44.906 44.906 45.206 -0.300 18400
580 1 3 . 1 1 24 24 GLY H H 24 8.841 8.841 8.762 0.079 18400
581 1 3 . 1 1 25 25 ARG N N 25 121.958 121.958 121.565 0.393 18400
582 1 3 . 1 1 25 25 ARG HA H 25 4.179 4.179 4.538 -0.359 18400
583 1 3 . 1 1 25 25 ARG C C 25 177.025 177.025 175.163 1.862 18400
584 1 3 . 1 1 25 25 ARG CA C 25 56.285 56.285 55.779 0.506 18400
585 1 3 . 1 1 25 25 ARG CB C 25 29.885 29.885 30.944 -1.059 18400
586 1 3 . 1 1 25 25 ARG H H 25 8.444 8.444 8.069 0.375 18400
587 1 3 . 1 1 26 26 THR N N 26 122.468 122.468 120.072 2.396 18400
588 1 3 . 1 1 26 26 THR HA H 26 3.226 3.226 4.699 -1.473 18400
589 1 3 . 1 1 26 26 THR CA C 26 60.422 60.422 58.678 1.744 18400
590 1 3 . 1 1 26 26 THR CB C 26 69.088 69.088 68.406 0.681 18400
591 1 3 . 1 1 26 26 THR H H 26 8.369 8.369 8.487 -0.118 18400
592 1 3 . 1 1 27 27 PRO HA H 27 3.867 3.867 4.185 -0.318 18400
593 1 3 . 1 1 27 27 PRO C C 27 177.571 177.571 178.052 -0.481 18400
594 1 3 . 1 1 27 27 PRO CA C 27 62.174 62.174 63.020 -0.846 18400
595 1 3 . 1 1 27 27 PRO CB C 27 32.818 32.818 31.965 0.853 18400
596 1 3 . 1 1 28 28 LYS N N 28 126.298 126.298 121.902 4.396 18400
597 1 3 . 1 1 28 28 LYS HA H 28 3.925 3.925 3.964 -0.039 18400
598 1 3 . 1 1 28 28 LYS CA C 28 60.815 60.815 61.466 -0.651 18400
599 1 3 . 1 1 28 28 LYS H H 28 8.903 8.903 8.799 0.104 18400
600 1 3 . 1 1 29 29 PRO HA H 29 4.289 4.289 4.243 0.046 18400
601 1 3 . 1 1 29 29 PRO C C 29 180.695 180.695 178.764 1.931 18400
602 1 3 . 1 1 29 29 PRO CA C 29 65.875 65.875 65.402 0.473 18400
603 1 3 . 1 1 29 29 PRO CB C 29 31.770 31.770 31.030 0.740 18400
604 1 3 . 1 1 30 30 ILE N N 30 114.387 114.387 118.177 -3.790 18400
605 1 3 . 1 1 30 30 ILE HA H 30 3.021 3.021 3.948 -0.927 18400
606 1 3 . 1 1 30 30 ILE C C 30 176.633 176.633 178.087 -1.454 18400
607 1 3 . 1 1 30 30 ILE CA C 30 63.949 63.949 63.613 0.336 18400
608 1 3 . 1 1 30 30 ILE CB C 30 36.650 36.650 36.610 0.040 18400
609 1 3 . 1 1 30 30 ILE H H 30 6.051 6.051 7.913 -1.862 18400
610 1 3 . 1 1 31 31 ALA N N 31 123.060 123.060 122.185 0.875 18400
611 1 3 . 1 1 31 31 ALA HA H 31 3.720 3.720 3.982 -0.262 18400
612 1 3 . 1 1 31 31 ALA C C 31 181.571 181.571 179.508 2.063 18400
613 1 3 . 1 1 31 31 ALA CA C 31 55.456 55.456 55.702 -0.246 18400
614 1 3 . 1 1 31 31 ALA CB C 31 17.825 17.825 17.831 -0.006 18400
615 1 3 . 1 1 31 31 ALA H H 31 7.922 7.922 8.810 -0.888 18400
616 1 3 . 1 1 32 32 GLN N N 32 117.568 117.568 119.324 -1.756 18400
617 1 3 . 1 1 32 32 GLN HA H 32 3.934 3.934 4.052 -0.118 18400
618 1 3 . 1 1 32 32 GLN C C 32 178.025 178.025 177.933 0.092 18400
619 1 3 . 1 1 32 32 GLN CA C 32 58.424 58.424 58.798 -0.374 18400
620 1 3 . 1 1 32 32 GLN CB C 32 28.285 28.285 28.325 -0.040 18400
621 1 3 . 1 1 32 32 GLN H H 32 8.438 8.438 7.874 0.564 18400
622 1 3 . 1 1 33 33 ALA N N 33 121.972 121.972 122.580 -0.608 18400
623 1 3 . 1 1 33 33 ALA HA H 33 4.282 4.282 4.166 0.116 18400
624 1 3 . 1 1 33 33 ALA C C 33 181.426 181.426 179.828 1.598 18400
625 1 3 . 1 1 33 33 ALA CA C 33 55.082 55.082 55.191 -0.109 18400
626 1 3 . 1 1 33 33 ALA CB C 33 18.720 18.720 18.500 0.220 18400
627 1 3 . 1 1 33 33 ALA H H 33 7.099 7.099 7.491 -0.392 18400
628 1 3 . 1 1 34 34 LEU N N 34 119.898 119.898 118.620 1.278 18400
629 1 3 . 1 1 34 34 LEU HA H 34 4.297 4.297 4.164 0.133 18400
630 1 3 . 1 1 34 34 LEU C C 34 182.198 182.198 179.501 2.697 18400
631 1 3 . 1 1 34 34 LEU CA C 34 57.310 57.310 58.019 -0.709 18400
632 1 3 . 1 1 34 34 LEU CB C 34 40.490 40.490 41.748 -1.258 18400
633 1 3 . 1 1 34 34 LEU H H 34 8.538 8.538 7.946 0.592 18400
634 1 3 . 1 1 35 35 ALA N N 35 122.660 122.660 121.239 1.421 18400
635 1 3 . 1 1 35 35 ALA HA H 35 4.222 4.222 4.086 0.136 18400
636 1 3 . 1 1 35 35 ALA C C 35 179.762 179.762 179.402 0.360 18400
637 1 3 . 1 1 35 35 ALA CA C 35 54.226 54.226 54.871 -0.645 18400
638 1 3 . 1 1 35 35 ALA CB C 35 17.744 17.744 18.383 -0.639 18400
639 1 3 . 1 1 35 35 ALA H H 35 7.741 7.741 8.005 -0.264 18400
640 1 3 . 1 1 36 36 GLU N N 36 116.640 116.640 116.532 0.108 18400
641 1 3 . 1 1 36 36 GLU HA H 36 4.403 4.403 4.396 0.007 18400
642 1 3 . 1 1 36 36 GLU C C 36 177.531 177.531 177.518 0.013 18400
643 1 3 . 1 1 36 36 GLU CA C 36 55.856 55.856 56.270 -0.414 18400
644 1 3 . 1 1 36 36 GLU CB C 36 29.741 29.741 30.227 -0.486 18400
645 1 3 . 1 1 36 36 GLU H H 36 7.496 7.496 7.859 -0.363 18400
646 1 3 . 1 1 37 37 GLY N N 37 106.885 106.885 107.671 -0.786 18400
647 1 3 . 1 1 37 37 GLY C C 37 176.072 176.072 173.812 2.260 18400
648 1 3 . 1 1 37 37 GLY CA C 37 45.369 45.369 44.768 0.601 18400
649 1 3 . 1 1 37 37 GLY H H 37 7.802 7.802 7.721 0.081 18400
650 1 3 . 1 1 38 38 LYS N N 38 120.419 120.419 122.231 -1.812 18400
651 1 3 . 1 1 38 38 LYS HA H 38 4.479 4.479 4.478 0.001 18400
652 1 3 . 1 1 38 38 LYS C C 38 174.921 174.921 175.387 -0.466 18400
653 1 3 . 1 1 38 38 LYS CA C 38 55.927 55.927 55.721 0.206 18400
654 1 3 . 1 1 38 38 LYS CB C 38 31.850 31.850 33.448 -1.598 18400
655 1 3 . 1 1 38 38 LYS H H 38 7.935 7.935 8.065 -0.130 18400
656 1 3 . 1 1 39 39 SER N N 39 114.172 114.172 118.791 -4.619 18400
657 1 3 . 1 1 39 39 SER HA H 39 4.812 4.812 4.496 0.316 18400
658 1 3 . 1 1 39 39 SER C C 39 176.690 176.690 175.320 1.370 18400
659 1 3 . 1 1 39 39 SER CA C 39 56.473 56.473 57.218 -0.745 18400
660 1 3 . 1 1 39 39 SER CB C 39 65.933 65.933 64.196 1.737 18400
661 1 3 . 1 1 39 39 SER H H 39 8.579 8.579 8.609 -0.030 18400
662 1 3 . 1 1 40 40 LEU N N 40 126.212 126.212 122.569 3.643 18400
663 1 3 . 1 1 40 40 LEU HA H 40 4.201 4.201 4.054 0.147 18400
664 1 3 . 1 1 40 40 LEU C C 40 179.329 179.329 177.529 1.800 18400
665 1 3 . 1 1 40 40 LEU CA C 40 58.049 58.049 55.899 2.150 18400
666 1 3 . 1 1 40 40 LEU CB C 40 41.038 41.038 42.001 -0.963 18400
667 1 3 . 1 1 40 40 LEU H H 40 9.038 9.038 8.855 0.183 18400
668 1 3 . 1 1 41 41 ASP N N 41 115.700 115.700 118.367 -2.667 18400
669 1 3 . 1 1 41 41 ASP HA H 41 4.580 4.580 4.089 0.491 18400
670 1 3 . 1 1 41 41 ASP C C 41 179.063 179.063 177.088 1.975 18400
671 1 3 . 1 1 41 41 ASP CA C 41 56.353 56.353 56.269 0.084 18400
672 1 3 . 1 1 41 41 ASP CB C 41 40.217 40.217 40.410 -0.194 18400
673 1 3 . 1 1 41 41 ASP H H 41 8.217 8.217 8.048 0.169 18400
674 1 3 . 1 1 42 42 ASP N N 42 119.466 119.466 118.075 1.391 18400
675 1 3 . 1 1 42 42 ASP HA H 42 4.422 4.422 4.462 -0.040 18400
676 1 3 . 1 1 42 42 ASP C C 42 177.484 177.484 176.999 0.485 18400
677 1 3 . 1 1 42 42 ASP CB C 42 40.234 40.234 41.465 -1.232 18400
678 1 3 . 1 1 42 42 ASP H H 42 7.959 7.959 7.238 0.721 18400
679 1 3 . 1 1 43 43 PHE N N 43 117.109 117.109 116.466 0.643 18400
680 1 3 . 1 1 43 43 PHE HA H 43 4.873 4.873 4.715 0.158 18400
681 1 3 . 1 1 43 43 PHE C C 43 175.641 175.641 174.511 1.130 18400
682 1 3 . 1 1 43 43 PHE CA C 43 58.196 58.196 54.583 3.613 18400
683 1 3 . 1 1 43 43 PHE CB C 43 39.344 39.344 38.230 1.114 18400
684 1 3 . 1 1 43 43 PHE H H 43 8.320 8.320 6.772 1.548 18400
685 1 3 . 1 1 44 44 LEU N N 44 122.188 122.188 119.712 2.476 18400
686 1 3 . 1 1 44 44 LEU HA H 44 4.428 4.428 4.254 0.174 18400
687 1 3 . 1 1 44 44 LEU C C 44 178.294 178.294 176.899 1.395 18400
688 1 3 . 1 1 44 44 LEU CA C 44 56.434 56.434 54.810 1.624 18400
689 1 3 . 1 1 44 44 LEU CB C 44 42.835 42.835 41.715 1.119 18400
690 1 3 . 1 1 44 44 LEU H H 44 7.387 7.387 7.230 0.157 18400
691 1 4 . 1 1 2 2 GLN N N 2 122.420 122.420 120.330 2.090 18400
692 1 4 . 1 1 2 2 GLN HA H 2 4.665 4.665 4.706 -0.041 18400
693 1 4 . 1 1 2 2 GLN CA C 2 53.740 53.740 54.032 -0.292 18400
694 1 4 . 1 1 2 2 GLN CB C 2 28.509 28.509 29.743 -1.234 18400
695 1 4 . 1 1 2 2 GLN H H 2 8.573 8.573 7.925 0.648 18400
696 1 4 . 1 1 3 3 PRO HA H 3 4.464 4.464 4.559 -0.095 18400
697 1 4 . 1 1 3 3 PRO C C 3 177.173 177.173 175.955 1.218 18400
698 1 4 . 1 1 3 3 PRO CA C 3 62.946 62.946 62.055 0.891 18400
699 1 4 . 1 1 3 3 PRO CB C 3 32.109 32.109 32.383 -0.274 18400
700 1 4 . 1 1 4 4 ARG N N 4 122.684 122.684 120.389 2.295 18400
701 1 4 . 1 1 4 4 ARG HA H 4 4.578 4.578 4.176 0.402 18400
702 1 4 . 1 1 4 4 ARG CA C 4 53.646 53.646 55.489 -1.843 18400
703 1 4 . 1 1 4 4 ARG CB C 4 29.634 29.634 28.767 0.867 18400
704 1 4 . 1 1 4 4 ARG H H 4 8.438 8.438 8.413 0.025 18400
705 1 4 . 1 1 5 5 PRO HA H 5 4.400 4.400 4.499 -0.099 18400
706 1 4 . 1 1 5 5 PRO C C 5 177.137 177.137 175.693 1.444 18400
707 1 4 . 1 1 5 5 PRO CA C 5 62.490 62.490 62.548 -0.058 18400
708 1 4 . 1 1 5 5 PRO CB C 5 31.928 31.928 32.568 -0.640 18400
709 1 4 . 1 1 6 6 ALA N N 6 123.540 123.540 125.625 -2.085 18400
710 1 4 . 1 1 6 6 ALA HA H 6 3.919 3.919 4.354 -0.435 18400
711 1 4 . 1 1 6 6 ALA C C 6 176.845 176.845 175.924 0.921 18400
712 1 4 . 1 1 6 6 ALA CA C 6 53.270 53.270 51.083 2.187 18400
713 1 4 . 1 1 6 6 ALA CB C 6 19.045 19.045 19.757 -0.712 18400
714 1 4 . 1 1 6 6 ALA H H 6 8.360 8.360 8.136 0.224 18400
715 1 4 . 1 1 7 7 LYS N N 7 121.074 121.074 120.027 1.047 18400
716 1 4 . 1 1 7 7 LYS HA H 7 4.306 4.306 4.457 -0.151 18400
717 1 4 . 1 1 7 7 LYS C C 7 175.113 175.113 174.768 0.345 18400
718 1 4 . 1 1 7 7 LYS CA C 7 56.621 56.621 55.560 1.061 18400
719 1 4 . 1 1 7 7 LYS CB C 7 36.158 36.158 33.155 3.003 18400
720 1 4 . 1 1 7 7 LYS H H 7 7.691 7.691 8.010 -0.319 18400
721 1 4 . 1 1 8 8 TYR N N 8 117.325 117.325 121.042 -3.717 18400
722 1 4 . 1 1 8 8 TYR HA H 8 5.660 5.660 4.737 0.923 18400
723 1 4 . 1 1 8 8 TYR C C 8 175.278 175.278 174.340 0.938 18400
724 1 4 . 1 1 8 8 TYR CA C 8 56.011 56.011 55.948 0.063 18400
725 1 4 . 1 1 8 8 TYR CB C 8 42.531 42.531 42.026 0.505 18400
726 1 4 . 1 1 8 8 TYR H H 8 8.349 8.349 8.247 0.102 18400
727 1 4 . 1 1 9 9 LYS N N 9 120.812 120.812 121.787 -0.975 18400
728 1 4 . 1 1 9 9 LYS HA H 9 5.647 5.647 5.033 0.614 18400
729 1 4 . 1 1 9 9 LYS C C 9 174.978 174.978 175.372 -0.394 18400
730 1 4 . 1 1 9 9 LYS CA C 9 54.767 54.767 54.950 -0.183 18400
731 1 4 . 1 1 9 9 LYS CB C 9 36.033 36.033 34.259 1.774 18400
732 1 4 . 1 1 9 9 LYS H H 9 9.648 9.648 8.932 0.716 18400
733 1 4 . 1 1 10 10 PHE N N 10 118.595 118.595 123.883 -5.288 18400
734 1 4 . 1 1 10 10 PHE HA H 10 5.220 5.220 4.957 0.263 18400
735 1 4 . 1 1 10 10 PHE C C 10 172.698 172.698 172.397 0.301 18400
736 1 4 . 1 1 10 10 PHE CA C 10 55.854 55.854 56.267 -0.413 18400
737 1 4 . 1 1 10 10 PHE CB C 10 40.607 40.607 41.467 -0.860 18400
738 1 4 . 1 1 10 10 PHE H H 10 8.890 8.890 8.848 0.042 18400
739 1 4 . 1 1 11 11 THR N N 11 117.249 117.249 116.244 1.005 18400
740 1 4 . 1 1 11 11 THR HA H 11 4.745 4.745 4.209 0.536 18400
741 1 4 . 1 1 11 11 THR C C 11 175.071 175.071 172.631 2.440 18400
742 1 4 . 1 1 11 11 THR CA C 11 61.667 61.667 61.056 0.611 18400
743 1 4 . 1 1 11 11 THR CB C 11 69.324 69.324 68.837 0.487 18400
744 1 4 . 1 1 11 11 THR H H 11 8.904 8.904 7.762 1.142 18400
745 1 4 . 1 1 12 12 ASP N N 12 127.813 127.813 126.542 1.271 18400
746 1 4 . 1 1 12 12 ASP HA H 12 4.903 4.903 3.887 1.016 18400
747 1 4 . 1 1 12 12 ASP C C 12 179.041 179.041 177.929 1.112 18400
748 1 4 . 1 1 12 12 ASP CA C 12 52.773 52.773 54.565 -1.792 18400
749 1 4 . 1 1 12 12 ASP CB C 12 38.879 38.879 42.411 -3.532 18400
750 1 4 . 1 1 12 12 ASP H H 12 8.993 8.993 8.293 0.700 18400
751 1 4 . 1 1 13 13 VAL N N 13 117.388 117.388 120.753 -3.365 18400
752 1 4 . 1 1 13 13 VAL HA H 13 3.990 3.990 3.649 0.341 18400
753 1 4 . 1 1 13 13 VAL C C 13 176.796 176.796 175.676 1.120 18400
754 1 4 . 1 1 13 13 VAL CA C 13 64.349 64.349 64.436 -0.087 18400
755 1 4 . 1 1 13 13 VAL CB C 13 31.652 31.652 31.898 -0.245 18400
756 1 4 . 1 1 13 13 VAL H H 13 8.950 8.950 8.617 0.333 18400
757 1 4 . 1 1 14 14 ASN N N 14 117.303 117.303 115.045 2.258 18400
758 1 4 . 1 1 14 14 ASN HA H 14 4.781 4.781 4.637 0.144 18400
759 1 4 . 1 1 14 14 ASN C C 14 176.606 176.606 175.589 1.017 18400
760 1 4 . 1 1 14 14 ASN CB C 14 38.851 38.851 39.813 -0.962 18400
761 1 4 . 1 1 14 14 ASN H H 14 8.011 8.011 7.697 0.314 18400
762 1 4 . 1 1 15 15 GLY N N 15 108.443 108.443 108.066 0.377 18400
763 1 4 . 1 1 15 15 GLY C C 15 174.799 174.799 173.344 1.455 18400
764 1 4 . 1 1 15 15 GLY CA C 15 45.246 45.246 44.782 0.464 18400
765 1 4 . 1 1 15 15 GLY H H 15 8.288 8.288 7.930 0.358 18400
766 1 4 . 1 1 16 16 GLU N N 16 122.005 122.005 122.418 -0.413 18400
767 1 4 . 1 1 16 16 GLU HA H 16 4.373 4.373 4.210 0.163 18400
768 1 4 . 1 1 16 16 GLU C C 16 176.564 176.564 176.091 0.473 18400
769 1 4 . 1 1 16 16 GLU CA C 16 55.798 55.798 56.264 -0.466 18400
770 1 4 . 1 1 16 16 GLU CB C 16 30.932 30.932 29.324 1.608 18400
771 1 4 . 1 1 16 16 GLU H H 16 8.045 8.045 8.003 0.042 18400
772 1 4 . 1 1 17 17 THR N N 17 120.458 120.458 121.393 -0.935 18400
773 1 4 . 1 1 17 17 THR HA H 17 4.583 4.583 5.214 -0.631 18400
774 1 4 . 1 1 17 17 THR C C 17 174.583 174.583 174.862 -0.279 18400
775 1 4 . 1 1 17 17 THR CA C 17 63.471 63.471 61.274 2.197 18400
776 1 4 . 1 1 17 17 THR CB C 17 69.004 69.004 68.044 0.960 18400
777 1 4 . 1 1 17 17 THR H H 17 8.758 8.758 8.565 0.193 18400
778 1 4 . 1 1 18 18 LYS N N 18 129.000 129.000 125.551 3.449 18400
779 1 4 . 1 1 18 18 LYS HA H 18 4.581 4.581 4.854 -0.273 18400
780 1 4 . 1 1 18 18 LYS C C 18 174.995 174.995 174.620 0.375 18400
781 1 4 . 1 1 18 18 LYS CB C 18 36.219 36.219 36.499 -0.280 18400
782 1 4 . 1 1 18 18 LYS H H 18 8.848 8.848 7.990 0.858 18400
783 1 4 . 1 1 19 19 THR N N 19 107.308 107.308 112.570 -5.262 18400
784 1 4 . 1 1 19 19 THR HA H 19 5.662 5.662 4.800 0.862 18400
785 1 4 . 1 1 19 19 THR C C 19 175.135 175.135 173.762 1.373 18400
786 1 4 . 1 1 19 19 THR CA C 19 59.541 59.541 61.931 -2.390 18400
787 1 4 . 1 1 19 19 THR CB C 19 72.571 72.571 69.454 3.117 18400
788 1 4 . 1 1 19 19 THR H H 19 8.023 8.023 8.335 -0.312 18400
789 1 4 . 1 1 20 20 TRP N N 20 120.113 120.113 128.332 -8.219 18400
790 1 4 . 1 1 20 20 TRP HA H 20 5.793 5.793 4.543 1.250 18400
791 1 4 . 1 1 20 20 TRP CA C 20 55.233 55.233 56.960 -1.727 18400
792 1 4 . 1 1 20 20 TRP CB C 20 33.193 33.193 30.675 2.518 18400
793 1 4 . 1 1 20 20 TRP H H 20 9.317 9.317 8.488 0.829 18400
794 1 4 . 1 1 21 21 THR HA H 21 4.280 4.280 4.180 0.100 18400
795 1 4 . 1 1 21 21 THR CA C 21 62.844 62.844 61.328 1.516 18400
796 1 4 . 1 1 21 21 THR CB C 21 70.918 70.918 69.878 1.040 18400
797 1 4 . 1 1 21 21 THR H H 21 8.449 8.449 7.771 0.678 18400
798 1 4 . 1 1 22 22 GLY C C 22 172.841 172.841 173.032 -0.191 18400
799 1 4 . 1 1 22 22 GLY CA C 22 44.229 44.229 44.150 0.079 18400
800 1 4 . 1 1 22 22 GLY H H 22 7.928 7.928 7.226 0.702 18400
801 1 4 . 1 1 23 23 GLN N N 23 117.973 117.973 121.897 -3.924 18400
802 1 4 . 1 1 23 23 GLN HA H 23 4.533 4.533 4.165 0.368 18400
803 1 4 . 1 1 23 23 GLN C C 23 176.979 176.979 174.815 2.164 18400
804 1 4 . 1 1 23 23 GLN CA C 23 54.099 54.099 58.053 -3.954 18400
805 1 4 . 1 1 23 23 GLN CB C 23 30.565 30.565 29.759 0.806 18400
806 1 4 . 1 1 23 23 GLN H H 23 7.141 7.141 7.380 -0.239 18400
807 1 4 . 1 1 24 24 GLY N N 24 111.998 111.998 105.532 6.466 18400
808 1 4 . 1 1 24 24 GLY C C 24 174.510 174.510 173.864 0.646 18400
809 1 4 . 1 1 24 24 GLY CA C 24 44.906 44.906 44.651 0.255 18400
810 1 4 . 1 1 24 24 GLY H H 24 8.841 8.841 8.880 -0.039 18400
811 1 4 . 1 1 25 25 ARG N N 25 121.958 121.958 121.582 0.376 18400
812 1 4 . 1 1 25 25 ARG HA H 25 4.179 4.179 4.306 -0.127 18400
813 1 4 . 1 1 25 25 ARG C C 25 177.025 177.025 175.424 1.601 18400
814 1 4 . 1 1 25 25 ARG CA C 25 56.285 56.285 55.959 0.326 18400
815 1 4 . 1 1 25 25 ARG CB C 25 29.885 29.885 30.822 -0.937 18400
816 1 4 . 1 1 25 25 ARG H H 25 8.444 8.444 8.493 -0.049 18400
817 1 4 . 1 1 26 26 THR N N 26 122.468 122.468 119.356 3.112 18400
818 1 4 . 1 1 26 26 THR HA H 26 3.226 3.226 4.718 -1.492 18400
819 1 4 . 1 1 26 26 THR CA C 26 60.422 60.422 59.429 0.993 18400
820 1 4 . 1 1 26 26 THR CB C 26 69.088 69.088 68.976 0.112 18400
821 1 4 . 1 1 26 26 THR H H 26 8.369 8.369 8.339 0.030 18400
822 1 4 . 1 1 27 27 PRO HA H 27 3.867 3.867 4.130 -0.263 18400
823 1 4 . 1 1 27 27 PRO C C 27 177.571 177.571 178.034 -0.463 18400
824 1 4 . 1 1 27 27 PRO CA C 27 62.174 62.174 62.803 -0.629 18400
825 1 4 . 1 1 27 27 PRO CB C 27 32.818 32.818 32.063 0.755 18400
826 1 4 . 1 1 28 28 LYS N N 28 126.298 126.298 122.062 4.236 18400
827 1 4 . 1 1 28 28 LYS HA H 28 3.925 3.925 3.969 -0.044 18400
828 1 4 . 1 1 28 28 LYS CA C 28 60.815 60.815 61.801 -0.986 18400
829 1 4 . 1 1 28 28 LYS H H 28 8.903 8.903 8.838 0.065 18400
830 1 4 . 1 1 29 29 PRO HA H 29 4.289 4.289 4.231 0.058 18400
831 1 4 . 1 1 29 29 PRO C C 29 180.695 180.695 178.786 1.909 18400
832 1 4 . 1 1 29 29 PRO CA C 29 65.875 65.875 65.497 0.378 18400
833 1 4 . 1 1 29 29 PRO CB C 29 31.770 31.770 31.028 0.742 18400
834 1 4 . 1 1 30 30 ILE N N 30 114.387 114.387 118.328 -3.941 18400
835 1 4 . 1 1 30 30 ILE HA H 30 3.021 3.021 4.005 -0.984 18400
836 1 4 . 1 1 30 30 ILE C C 30 176.633 176.633 178.126 -1.493 18400
837 1 4 . 1 1 30 30 ILE CA C 30 63.949 63.949 63.379 0.570 18400
838 1 4 . 1 1 30 30 ILE CB C 30 36.650 36.650 36.653 -0.003 18400
839 1 4 . 1 1 30 30 ILE H H 30 6.051 6.051 7.977 -1.926 18400
840 1 4 . 1 1 31 31 ALA N N 31 123.060 123.060 122.504 0.556 18400
841 1 4 . 1 1 31 31 ALA HA H 31 3.720 3.720 4.003 -0.283 18400
842 1 4 . 1 1 31 31 ALA C C 31 181.571 181.571 179.635 1.936 18400
843 1 4 . 1 1 31 31 ALA CA C 31 55.456 55.456 55.779 -0.323 18400
844 1 4 . 1 1 31 31 ALA CB C 31 17.825 17.825 17.854 -0.029 18400
845 1 4 . 1 1 31 31 ALA H H 31 7.922 7.922 8.793 -0.871 18400
846 1 4 . 1 1 32 32 GLN N N 32 117.568 117.568 119.269 -1.701 18400
847 1 4 . 1 1 32 32 GLN HA H 32 3.934 3.934 4.051 -0.117 18400
848 1 4 . 1 1 32 32 GLN C C 32 178.025 178.025 177.994 0.031 18400
849 1 4 . 1 1 32 32 GLN CA C 32 58.424 58.424 58.889 -0.465 18400
850 1 4 . 1 1 32 32 GLN CB C 32 28.285 28.285 28.534 -0.249 18400
851 1 4 . 1 1 32 32 GLN H H 32 8.438 8.438 7.861 0.577 18400
852 1 4 . 1 1 33 33 ALA N N 33 121.972 121.972 122.933 -0.961 18400
853 1 4 . 1 1 33 33 ALA HA H 33 4.282 4.282 4.206 0.076 18400
854 1 4 . 1 1 33 33 ALA C C 33 181.426 181.426 180.036 1.390 18400
855 1 4 . 1 1 33 33 ALA CA C 33 55.082 55.082 55.218 -0.136 18400
856 1 4 . 1 1 33 33 ALA CB C 33 18.720 18.720 18.630 0.090 18400
857 1 4 . 1 1 33 33 ALA H H 33 7.099 7.099 7.531 -0.432 18400
858 1 4 . 1 1 34 34 LEU N N 34 119.898 119.898 118.520 1.378 18400
859 1 4 . 1 1 34 34 LEU HA H 34 4.297 4.297 4.682 -0.385 18400
860 1 4 . 1 1 34 34 LEU C C 34 182.198 182.198 180.388 1.810 18400
861 1 4 . 1 1 34 34 LEU CA C 34 57.310 57.310 57.671 -0.361 18400
862 1 4 . 1 1 34 34 LEU CB C 34 40.490 40.490 41.482 -0.992 18400
863 1 4 . 1 1 34 34 LEU H H 34 8.538 8.538 8.877 -0.339 18400
864 1 4 . 1 1 35 35 ALA N N 35 122.660 122.660 121.599 1.061 18400
865 1 4 . 1 1 35 35 ALA HA H 35 4.222 4.222 4.151 0.071 18400
866 1 4 . 1 1 35 35 ALA C C 35 179.762 179.762 178.775 0.987 18400
867 1 4 . 1 1 35 35 ALA CA C 35 54.226 54.226 54.614 -0.388 18400
868 1 4 . 1 1 35 35 ALA CB C 35 17.744 17.744 18.278 -0.534 18400
869 1 4 . 1 1 35 35 ALA H H 35 7.741 7.741 8.371 -0.630 18400
870 1 4 . 1 1 36 36 GLU N N 36 116.640 116.640 116.291 0.349 18400
871 1 4 . 1 1 36 36 GLU HA H 36 4.403 4.403 4.256 0.147 18400
872 1 4 . 1 1 36 36 GLU C C 36 177.531 177.531 177.671 -0.140 18400
873 1 4 . 1 1 36 36 GLU CA C 36 55.856 55.856 57.106 -1.250 18400
874 1 4 . 1 1 36 36 GLU CB C 36 29.741 29.741 30.202 -0.461 18400
875 1 4 . 1 1 36 36 GLU H H 36 7.496 7.496 7.652 -0.156 18400
876 1 4 . 1 1 37 37 GLY N N 37 106.885 106.885 107.253 -0.368 18400
877 1 4 . 1 1 37 37 GLY C C 37 176.072 176.072 174.338 1.734 18400
878 1 4 . 1 1 37 37 GLY CA C 37 45.369 45.369 45.041 0.328 18400
879 1 4 . 1 1 37 37 GLY H H 37 7.802 7.802 8.161 -0.359 18400
880 1 4 . 1 1 38 38 LYS N N 38 120.419 120.419 121.301 -0.882 18400
881 1 4 . 1 1 38 38 LYS HA H 38 4.479 4.479 4.610 -0.131 18400
882 1 4 . 1 1 38 38 LYS C C 38 174.921 174.921 175.807 -0.886 18400
883 1 4 . 1 1 38 38 LYS CA C 38 55.927 55.927 54.803 1.125 18400
884 1 4 . 1 1 38 38 LYS CB C 38 31.850 31.850 33.190 -1.340 18400
885 1 4 . 1 1 38 38 LYS H H 38 7.935 7.935 7.551 0.384 18400
886 1 4 . 1 1 39 39 SER N N 39 114.172 114.172 115.747 -1.575 18400
887 1 4 . 1 1 39 39 SER HA H 39 4.812 4.812 4.461 0.351 18400
888 1 4 . 1 1 39 39 SER C C 39 176.690 176.690 175.997 0.693 18400
889 1 4 . 1 1 39 39 SER CA C 39 56.473 56.473 56.604 -0.131 18400
890 1 4 . 1 1 39 39 SER CB C 39 65.933 65.933 64.004 1.929 18400
891 1 4 . 1 1 39 39 SER H H 39 8.579 8.579 8.457 0.122 18400
892 1 4 . 1 1 40 40 LEU N N 40 126.212 126.212 122.034 4.178 18400
893 1 4 . 1 1 40 40 LEU HA H 40 4.201 4.201 4.103 0.098 18400
894 1 4 . 1 1 40 40 LEU C C 40 179.329 179.329 177.848 1.481 18400
895 1 4 . 1 1 40 40 LEU CA C 40 58.049 58.049 56.117 1.932 18400
896 1 4 . 1 1 40 40 LEU CB C 40 41.038 41.038 42.000 -0.962 18400
897 1 4 . 1 1 40 40 LEU H H 40 9.038 9.038 8.802 0.236 18400
898 1 4 . 1 1 41 41 ASP N N 41 115.700 115.700 117.912 -2.212 18400
899 1 4 . 1 1 41 41 ASP HA H 41 4.580 4.580 3.847 0.733 18400
900 1 4 . 1 1 41 41 ASP C C 41 179.063 179.063 177.245 1.818 18400
901 1 4 . 1 1 41 41 ASP CA C 41 56.353 56.353 57.106 -0.753 18400
902 1 4 . 1 1 41 41 ASP CB C 41 40.217 40.217 40.131 0.086 18400
903 1 4 . 1 1 41 41 ASP H H 41 8.217 8.217 8.135 0.082 18400
904 1 4 . 1 1 42 42 ASP N N 42 119.466 119.466 118.701 0.765 18400
905 1 4 . 1 1 42 42 ASP HA H 42 4.422 4.422 4.366 0.056 18400
906 1 4 . 1 1 42 42 ASP C C 42 177.484 177.484 176.685 0.799 18400
907 1 4 . 1 1 42 42 ASP CB C 42 40.234 40.234 41.006 -0.772 18400
908 1 4 . 1 1 42 42 ASP H H 42 7.959 7.959 7.386 0.573 18400
909 1 4 . 1 1 43 43 PHE N N 43 117.109 117.109 116.833 0.276 18400
910 1 4 . 1 1 43 43 PHE HA H 43 4.873 4.873 4.720 0.153 18400
911 1 4 . 1 1 43 43 PHE C C 43 175.641 175.641 174.519 1.122 18400
912 1 4 . 1 1 43 43 PHE CA C 43 58.196 58.196 54.904 3.292 18400
913 1 4 . 1 1 43 43 PHE CB C 43 39.344 39.344 38.548 0.796 18400
914 1 4 . 1 1 43 43 PHE H H 43 8.320 8.320 7.138 1.182 18400
915 1 4 . 1 1 44 44 LEU N N 44 122.188 122.188 120.005 2.183 18400
916 1 4 . 1 1 44 44 LEU HA H 44 4.428 4.428 4.263 0.165 18400
917 1 4 . 1 1 44 44 LEU C C 44 178.294 178.294 176.997 1.297 18400
918 1 4 . 1 1 44 44 LEU CA C 44 56.434 56.434 55.146 1.288 18400
919 1 4 . 1 1 44 44 LEU CB C 44 42.835 42.835 40.756 2.079 18400
920 1 4 . 1 1 44 44 LEU H H 44 7.387 7.387 7.117 0.270 18400
921 1 5 . 1 1 2 2 GLN N N 2 122.420 122.420 121.244 1.176 18400
922 1 5 . 1 1 2 2 GLN HA H 2 4.665 4.665 4.556 0.109 18400
923 1 5 . 1 1 2 2 GLN CA C 2 53.740 53.740 54.898 -1.158 18400
924 1 5 . 1 1 2 2 GLN CB C 2 28.509 28.509 30.195 -1.687 18400
925 1 5 . 1 1 2 2 GLN H H 2 8.573 8.573 8.188 0.385 18400
926 1 5 . 1 1 3 3 PRO HA H 3 4.464 4.464 4.628 -0.164 18400
927 1 5 . 1 1 3 3 PRO C C 3 177.173 177.173 175.884 1.289 18400
928 1 5 . 1 1 3 3 PRO CA C 3 62.946 62.946 62.114 0.832 18400
929 1 5 . 1 1 3 3 PRO CB C 3 32.109 32.109 32.456 -0.347 18400
930 1 5 . 1 1 4 4 ARG N N 4 122.684 122.684 120.204 2.480 18400
931 1 5 . 1 1 4 4 ARG HA H 4 4.578 4.578 4.201 0.377 18400
932 1 5 . 1 1 4 4 ARG CA C 4 53.646 53.646 55.832 -2.186 18400
933 1 5 . 1 1 4 4 ARG CB C 4 29.634 29.634 29.299 0.335 18400
934 1 5 . 1 1 4 4 ARG H H 4 8.438 8.438 8.471 -0.033 18400
935 1 5 . 1 1 5 5 PRO HA H 5 4.400 4.400 4.472 -0.072 18400
936 1 5 . 1 1 5 5 PRO C C 5 177.137 177.137 175.812 1.325 18400
937 1 5 . 1 1 5 5 PRO CA C 5 62.490 62.490 62.376 0.114 18400
938 1 5 . 1 1 5 5 PRO CB C 5 31.928 31.928 31.517 0.411 18400
939 1 5 . 1 1 6 6 ALA N N 6 123.540 123.540 127.801 -4.261 18400
940 1 5 . 1 1 6 6 ALA HA H 6 3.919 3.919 4.285 -0.366 18400
941 1 5 . 1 1 6 6 ALA C C 6 176.845 176.845 176.421 0.424 18400
942 1 5 . 1 1 6 6 ALA CA C 6 53.270 53.270 51.173 2.097 18400
943 1 5 . 1 1 6 6 ALA CB C 6 19.045 19.045 19.925 -0.880 18400
944 1 5 . 1 1 6 6 ALA H H 6 8.360 8.360 7.845 0.515 18400
945 1 5 . 1 1 7 7 LYS N N 7 121.074 121.074 120.021 1.053 18400
946 1 5 . 1 1 7 7 LYS HA H 7 4.306 4.306 4.281 0.025 18400
947 1 5 . 1 1 7 7 LYS C C 7 175.113 175.113 174.557 0.556 18400
948 1 5 . 1 1 7 7 LYS CA C 7 56.621 56.621 55.607 1.014 18400
949 1 5 . 1 1 7 7 LYS CB C 7 36.158 36.158 31.850 4.308 18400
950 1 5 . 1 1 7 7 LYS H H 7 7.691 7.691 7.937 -0.246 18400
951 1 5 . 1 1 8 8 TYR N N 8 117.325 117.325 121.866 -4.541 18400
952 1 5 . 1 1 8 8 TYR HA H 8 5.660 5.660 4.632 1.028 18400
953 1 5 . 1 1 8 8 TYR C C 8 175.278 175.278 174.083 1.195 18400
954 1 5 . 1 1 8 8 TYR CA C 8 56.011 56.011 56.590 -0.578 18400
955 1 5 . 1 1 8 8 TYR CB C 8 42.531 42.531 42.929 -0.398 18400
956 1 5 . 1 1 8 8 TYR H H 8 8.349 8.349 8.264 0.085 18400
957 1 5 . 1 1 9 9 LYS N N 9 120.812 120.812 122.302 -1.490 18400
958 1 5 . 1 1 9 9 LYS HA H 9 5.647 5.647 4.895 0.752 18400
959 1 5 . 1 1 9 9 LYS C C 9 174.978 174.978 175.147 -0.169 18400
960 1 5 . 1 1 9 9 LYS CA C 9 54.767 54.767 55.882 -1.115 18400
961 1 5 . 1 1 9 9 LYS CB C 9 36.033 36.033 34.453 1.580 18400
962 1 5 . 1 1 9 9 LYS H H 9 9.648 9.648 8.846 0.802 18400
963 1 5 . 1 1 10 10 PHE N N 10 118.595 118.595 125.401 -6.806 18400
964 1 5 . 1 1 10 10 PHE HA H 10 5.220 5.220 4.937 0.283 18400
965 1 5 . 1 1 10 10 PHE C C 10 172.698 172.698 172.550 0.148 18400
966 1 5 . 1 1 10 10 PHE CA C 10 55.854 55.854 56.397 -0.543 18400
967 1 5 . 1 1 10 10 PHE CB C 10 40.607 40.607 41.864 -1.257 18400
968 1 5 . 1 1 10 10 PHE H H 10 8.890 8.890 8.401 0.489 18400
969 1 5 . 1 1 11 11 THR N N 11 117.249 117.249 115.826 1.423 18400
970 1 5 . 1 1 11 11 THR HA H 11 4.745 4.745 4.446 0.299 18400
971 1 5 . 1 1 11 11 THR C C 11 175.071 175.071 172.896 2.175 18400
972 1 5 . 1 1 11 11 THR CA C 11 61.667 61.667 60.270 1.397 18400
973 1 5 . 1 1 11 11 THR CB C 11 69.324 69.324 69.225 0.099 18400
974 1 5 . 1 1 11 11 THR H H 11 8.904 8.904 7.793 1.111 18400
975 1 5 . 1 1 12 12 ASP N N 12 127.813 127.813 125.209 2.604 18400
976 1 5 . 1 1 12 12 ASP HA H 12 4.903 4.903 3.857 1.046 18400
977 1 5 . 1 1 12 12 ASP C C 12 179.041 179.041 177.601 1.440 18400
978 1 5 . 1 1 12 12 ASP CA C 12 52.773 52.773 53.916 -1.143 18400
979 1 5 . 1 1 12 12 ASP CB C 12 38.879 38.879 42.432 -3.553 18400
980 1 5 . 1 1 12 12 ASP H H 12 8.993 8.993 8.232 0.761 18400
981 1 5 . 1 1 13 13 VAL N N 13 117.388 117.388 120.209 -2.821 18400
982 1 5 . 1 1 13 13 VAL HA H 13 3.990 3.990 3.834 0.156 18400
983 1 5 . 1 1 13 13 VAL C C 13 176.796 176.796 176.118 0.678 18400
984 1 5 . 1 1 13 13 VAL CA C 13 64.349 64.349 64.139 0.210 18400
985 1 5 . 1 1 13 13 VAL CB C 13 31.652 31.652 31.988 -0.336 18400
986 1 5 . 1 1 13 13 VAL H H 13 8.950 8.950 8.666 0.284 18400
987 1 5 . 1 1 14 14 ASN N N 14 117.303 117.303 116.339 0.964 18400
988 1 5 . 1 1 14 14 ASN HA H 14 4.781 4.781 4.652 0.129 18400
989 1 5 . 1 1 14 14 ASN C C 14 176.606 176.606 175.567 1.039 18400
990 1 5 . 1 1 14 14 ASN CB C 14 38.851 38.851 39.194 -0.343 18400
991 1 5 . 1 1 14 14 ASN H H 14 8.011 8.011 8.024 -0.013 18400
992 1 5 . 1 1 15 15 GLY N N 15 108.443 108.443 108.259 0.184 18400
993 1 5 . 1 1 15 15 GLY C C 15 174.799 174.799 173.690 1.109 18400
994 1 5 . 1 1 15 15 GLY CA C 15 45.246 45.246 44.938 0.308 18400
995 1 5 . 1 1 15 15 GLY H H 15 8.288 8.288 7.746 0.542 18400
996 1 5 . 1 1 16 16 GLU N N 16 122.005 122.005 119.820 2.185 18400
997 1 5 . 1 1 16 16 GLU HA H 16 4.373 4.373 4.261 0.112 18400
998 1 5 . 1 1 16 16 GLU C C 16 176.564 176.564 174.690 1.874 18400
999 1 5 . 1 1 16 16 GLU CA C 16 55.798 55.798 56.046 -0.248 18400
1000 1 5 . 1 1 16 16 GLU CB C 16 30.932 30.932 30.435 0.497 18400
1001 1 5 . 1 1 16 16 GLU H H 16 8.045 8.045 7.854 0.191 18400
1002 1 5 . 1 1 17 17 THR N N 17 120.458 120.458 115.888 4.570 18400
1003 1 5 . 1 1 17 17 THR HA H 17 4.583 4.583 5.257 -0.674 18400
1004 1 5 . 1 1 17 17 THR C C 17 174.583 174.583 173.595 0.988 18400
1005 1 5 . 1 1 17 17 THR CA C 17 63.471 63.471 60.985 2.486 18400
1006 1 5 . 1 1 17 17 THR CB C 17 69.004 69.004 69.599 -0.595 18400
1007 1 5 . 1 1 17 17 THR H H 17 8.758 8.758 8.311 0.447 18400
1008 1 5 . 1 1 18 18 LYS N N 18 129.000 129.000 125.775 3.225 18400
1009 1 5 . 1 1 18 18 LYS HA H 18 4.581 4.581 4.764 -0.183 18400
1010 1 5 . 1 1 18 18 LYS C C 18 174.995 174.995 175.244 -0.249 18400
1011 1 5 . 1 1 18 18 LYS CB C 18 36.219 36.219 36.472 -0.253 18400
1012 1 5 . 1 1 18 18 LYS H H 18 8.848 8.848 8.154 0.694 18400
1013 1 5 . 1 1 19 19 THR N N 19 107.308 107.308 113.513 -6.205 18400
1014 1 5 . 1 1 19 19 THR HA H 19 5.662 5.662 4.673 0.989 18400
1015 1 5 . 1 1 19 19 THR C C 19 175.135 175.135 173.909 1.226 18400
1016 1 5 . 1 1 19 19 THR CA C 19 59.541 59.541 62.340 -2.799 18400
1017 1 5 . 1 1 19 19 THR CB C 19 72.571 72.571 69.252 3.318 18400
1018 1 5 . 1 1 19 19 THR H H 19 8.023 8.023 8.364 -0.341 18400
1019 1 5 . 1 1 20 20 TRP N N 20 120.113 120.113 127.466 -7.353 18400
1020 1 5 . 1 1 20 20 TRP HA H 20 5.793 5.793 4.577 1.216 18400
1021 1 5 . 1 1 20 20 TRP CA C 20 55.233 55.233 56.887 -1.654 18400
1022 1 5 . 1 1 20 20 TRP CB C 20 33.193 33.193 30.867 2.326 18400
1023 1 5 . 1 1 20 20 TRP H H 20 9.317 9.317 8.011 1.306 18400
1024 1 5 . 1 1 21 21 THR HA H 21 4.280 4.280 4.046 0.234 18400
1025 1 5 . 1 1 21 21 THR CA C 21 62.844 62.844 61.212 1.632 18400
1026 1 5 . 1 1 21 21 THR CB C 21 70.918 70.918 70.212 0.706 18400
1027 1 5 . 1 1 21 21 THR H H 21 8.449 8.449 7.479 0.970 18400
1028 1 5 . 1 1 22 22 GLY C C 22 172.841 172.841 173.138 -0.297 18400
1029 1 5 . 1 1 22 22 GLY CA C 22 44.229 44.229 44.442 -0.213 18400
1030 1 5 . 1 1 22 22 GLY H H 22 7.928 7.928 7.236 0.692 18400
1031 1 5 . 1 1 23 23 GLN N N 23 117.973 117.973 121.570 -3.597 18400
1032 1 5 . 1 1 23 23 GLN HA H 23 4.533 4.533 4.131 0.402 18400
1033 1 5 . 1 1 23 23 GLN C C 23 176.979 176.979 175.412 1.567 18400
1034 1 5 . 1 1 23 23 GLN CA C 23 54.099 54.099 57.994 -3.895 18400
1035 1 5 . 1 1 23 23 GLN CB C 23 30.565 30.565 29.690 0.875 18400
1036 1 5 . 1 1 23 23 GLN H H 23 7.141 7.141 7.575 -0.434 18400
1037 1 5 . 1 1 24 24 GLY N N 24 111.998 111.998 107.077 4.921 18400
1038 1 5 . 1 1 24 24 GLY C C 24 174.510 174.510 173.680 0.830 18400
1039 1 5 . 1 1 24 24 GLY CA C 24 44.906 44.906 44.999 -0.093 18400
1040 1 5 . 1 1 24 24 GLY H H 24 8.841 8.841 8.788 0.053 18400
1041 1 5 . 1 1 25 25 ARG N N 25 121.958 121.958 121.637 0.321 18400
1042 1 5 . 1 1 25 25 ARG HA H 25 4.179 4.179 4.356 -0.177 18400
1043 1 5 . 1 1 25 25 ARG C C 25 177.025 177.025 175.426 1.599 18400
1044 1 5 . 1 1 25 25 ARG CA C 25 56.285 56.285 55.838 0.447 18400
1045 1 5 . 1 1 25 25 ARG CB C 25 29.885 29.885 30.946 -1.061 18400
1046 1 5 . 1 1 25 25 ARG H H 25 8.444 8.444 8.340 0.104 18400
1047 1 5 . 1 1 26 26 THR N N 26 122.468 122.468 119.721 2.747 18400
1048 1 5 . 1 1 26 26 THR HA H 26 3.226 3.226 4.765 -1.539 18400
1049 1 5 . 1 1 26 26 THR CA C 26 60.422 60.422 59.666 0.756 18400
1050 1 5 . 1 1 26 26 THR CB C 26 69.088 69.088 69.110 -0.022 18400
1051 1 5 . 1 1 26 26 THR H H 26 8.369 8.369 8.395 -0.026 18400
1052 1 5 . 1 1 27 27 PRO HA H 27 3.867 3.867 4.226 -0.359 18400
1053 1 5 . 1 1 27 27 PRO C C 27 177.571 177.571 178.174 -0.603 18400
1054 1 5 . 1 1 27 27 PRO CA C 27 62.174 62.174 62.990 -0.816 18400
1055 1 5 . 1 1 27 27 PRO CB C 27 32.818 32.818 32.017 0.801 18400
1056 1 5 . 1 1 28 28 LYS N N 28 126.298 126.298 121.525 4.773 18400
1057 1 5 . 1 1 28 28 LYS HA H 28 3.925 3.925 3.970 -0.045 18400
1058 1 5 . 1 1 28 28 LYS CA C 28 60.815 60.815 61.671 -0.856 18400
1059 1 5 . 1 1 28 28 LYS H H 28 8.903 8.903 8.822 0.081 18400
1060 1 5 . 1 1 29 29 PRO HA H 29 4.289 4.289 4.365 -0.076 18400
1061 1 5 . 1 1 29 29 PRO C C 29 180.695 180.695 178.933 1.762 18400
1062 1 5 . 1 1 29 29 PRO CA C 29 65.875 65.875 65.414 0.461 18400
1063 1 5 . 1 1 29 29 PRO CB C 29 31.770 31.770 31.241 0.530 18400
1064 1 5 . 1 1 30 30 ILE N N 30 114.387 114.387 118.133 -3.746 18400
1065 1 5 . 1 1 30 30 ILE HA H 30 3.021 3.021 4.027 -1.006 18400
1066 1 5 . 1 1 30 30 ILE C C 30 176.633 176.633 178.099 -1.466 18400
1067 1 5 . 1 1 30 30 ILE CA C 30 63.949 63.949 63.219 0.730 18400
1068 1 5 . 1 1 30 30 ILE CB C 30 36.650 36.650 36.535 0.115 18400
1069 1 5 . 1 1 30 30 ILE H H 30 6.051 6.051 7.939 -1.888 18400
1070 1 5 . 1 1 31 31 ALA N N 31 123.060 123.060 122.349 0.711 18400
1071 1 5 . 1 1 31 31 ALA HA H 31 3.720 3.720 3.972 -0.252 18400
1072 1 5 . 1 1 31 31 ALA C C 31 181.571 181.571 179.815 1.756 18400
1073 1 5 . 1 1 31 31 ALA CA C 31 55.456 55.456 55.881 -0.425 18400
1074 1 5 . 1 1 31 31 ALA CB C 31 17.825 17.825 17.919 -0.094 18400
1075 1 5 . 1 1 31 31 ALA H H 31 7.922 7.922 8.866 -0.944 18400
1076 1 5 . 1 1 32 32 GLN N N 32 117.568 117.568 118.182 -0.614 18400
1077 1 5 . 1 1 32 32 GLN HA H 32 3.934 3.934 4.045 -0.111 18400
1078 1 5 . 1 1 32 32 GLN C C 32 178.025 178.025 178.414 -0.389 18400
1079 1 5 . 1 1 32 32 GLN CA C 32 58.424 58.424 58.725 -0.301 18400
1080 1 5 . 1 1 32 32 GLN CB C 32 28.285 28.285 28.584 -0.299 18400
1081 1 5 . 1 1 32 32 GLN H H 32 8.438 8.438 7.862 0.576 18400
1082 1 5 . 1 1 33 33 ALA N N 33 121.972 121.972 123.333 -1.361 18400
1083 1 5 . 1 1 33 33 ALA HA H 33 4.282 4.282 4.239 0.043 18400
1084 1 5 . 1 1 33 33 ALA C C 33 181.426 181.426 179.493 1.933 18400
1085 1 5 . 1 1 33 33 ALA CA C 33 55.082 55.082 55.081 0.001 18400
1086 1 5 . 1 1 33 33 ALA CB C 33 18.720 18.720 18.710 0.010 18400
1087 1 5 . 1 1 33 33 ALA H H 33 7.099 7.099 7.504 -0.405 18400
1088 1 5 . 1 1 34 34 LEU N N 34 119.898 119.898 119.151 0.747 18400
1089 1 5 . 1 1 34 34 LEU HA H 34 4.297 4.297 4.587 -0.290 18400
1090 1 5 . 1 1 34 34 LEU C C 34 182.198 182.198 180.335 1.863 18400
1091 1 5 . 1 1 34 34 LEU CA C 34 57.310 57.310 57.106 0.204 18400
1092 1 5 . 1 1 34 34 LEU CB C 34 40.490 40.490 42.194 -1.704 18400
1093 1 5 . 1 1 34 34 LEU H H 34 8.538 8.538 8.883 -0.345 18400
1094 1 5 . 1 1 35 35 ALA N N 35 122.660 122.660 122.042 0.618 18400
1095 1 5 . 1 1 35 35 ALA HA H 35 4.222 4.222 4.099 0.123 18400
1096 1 5 . 1 1 35 35 ALA C C 35 179.762 179.762 179.116 0.646 18400
1097 1 5 . 1 1 35 35 ALA CA C 35 54.226 54.226 54.763 -0.537 18400
1098 1 5 . 1 1 35 35 ALA CB C 35 17.744 17.744 18.243 -0.499 18400
1099 1 5 . 1 1 35 35 ALA H H 35 7.741 7.741 8.257 -0.516 18400
1100 1 5 . 1 1 36 36 GLU N N 36 116.640 116.640 116.790 -0.150 18400
1101 1 5 . 1 1 36 36 GLU HA H 36 4.403 4.403 4.291 0.112 18400
1102 1 5 . 1 1 36 36 GLU C C 36 177.531 177.531 177.400 0.131 18400
1103 1 5 . 1 1 36 36 GLU CA C 36 55.856 55.856 56.617 -0.761 18400
1104 1 5 . 1 1 36 36 GLU CB C 36 29.741 29.741 29.997 -0.256 18400
1105 1 5 . 1 1 36 36 GLU H H 36 7.496 7.496 7.756 -0.260 18400
1106 1 5 . 1 1 37 37 GLY N N 37 106.885 106.885 106.766 0.119 18400
1107 1 5 . 1 1 37 37 GLY C C 37 176.072 176.072 174.315 1.757 18400
1108 1 5 . 1 1 37 37 GLY CA C 37 45.369 45.369 44.914 0.455 18400
1109 1 5 . 1 1 37 37 GLY H H 37 7.802 7.802 8.074 -0.272 18400
1110 1 5 . 1 1 38 38 LYS N N 38 120.419 120.419 121.600 -1.181 18400
1111 1 5 . 1 1 38 38 LYS HA H 38 4.479 4.479 4.546 -0.067 18400
1112 1 5 . 1 1 38 38 LYS C C 38 174.921 174.921 175.695 -0.774 18400
1113 1 5 . 1 1 38 38 LYS CA C 38 55.927 55.927 55.328 0.599 18400
1114 1 5 . 1 1 38 38 LYS CB C 38 31.850 31.850 33.528 -1.678 18400
1115 1 5 . 1 1 38 38 LYS H H 38 7.935 7.935 7.588 0.347 18400
1116 1 5 . 1 1 39 39 SER N N 39 114.172 114.172 115.025 -0.853 18400
1117 1 5 . 1 1 39 39 SER HA H 39 4.812 4.812 4.487 0.325 18400
1118 1 5 . 1 1 39 39 SER C C 39 176.690 176.690 176.087 0.603 18400
1119 1 5 . 1 1 39 39 SER CA C 39 56.473 56.473 57.505 -1.032 18400
1120 1 5 . 1 1 39 39 SER CB C 39 65.933 65.933 64.083 1.850 18400
1121 1 5 . 1 1 39 39 SER H H 39 8.579 8.579 8.488 0.091 18400
1122 1 5 . 1 1 40 40 LEU N N 40 126.212 126.212 122.722 3.490 18400
1123 1 5 . 1 1 40 40 LEU HA H 40 4.201 4.201 4.188 0.013 18400
1124 1 5 . 1 1 40 40 LEU C C 40 179.329 179.329 177.682 1.647 18400
1125 1 5 . 1 1 40 40 LEU CA C 40 58.049 58.049 56.267 1.782 18400
1126 1 5 . 1 1 40 40 LEU CB C 40 41.038 41.038 42.286 -1.248 18400
1127 1 5 . 1 1 40 40 LEU H H 40 9.038 9.038 8.892 0.146 18400
1128 1 5 . 1 1 41 41 ASP N N 41 115.700 115.700 118.806 -3.106 18400
1129 1 5 . 1 1 41 41 ASP HA H 41 4.580 4.580 3.987 0.593 18400
1130 1 5 . 1 1 41 41 ASP C C 41 179.063 179.063 178.082 0.981 18400
1131 1 5 . 1 1 41 41 ASP CA C 41 56.353 56.353 57.543 -1.190 18400
1132 1 5 . 1 1 41 41 ASP CB C 41 40.217 40.217 40.156 0.062 18400
1133 1 5 . 1 1 41 41 ASP H H 41 8.217 8.217 8.180 0.037 18400
1134 1 5 . 1 1 42 42 ASP N N 42 119.466 119.466 119.177 0.289 18400
1135 1 5 . 1 1 42 42 ASP HA H 42 4.422 4.422 4.302 0.120 18400
1136 1 5 . 1 1 42 42 ASP C C 42 177.484 177.484 176.726 0.758 18400
1137 1 5 . 1 1 42 42 ASP CB C 42 40.234 40.234 40.806 -0.572 18400
1138 1 5 . 1 1 42 42 ASP H H 42 7.959 7.959 7.418 0.541 18400
1139 1 5 . 1 1 43 43 PHE N N 43 117.109 117.109 116.200 0.909 18400
1140 1 5 . 1 1 43 43 PHE HA H 43 4.873 4.873 4.732 0.141 18400
1141 1 5 . 1 1 43 43 PHE C C 43 175.641 175.641 174.666 0.975 18400
1142 1 5 . 1 1 43 43 PHE CA C 43 58.196 58.196 55.533 2.663 18400
1143 1 5 . 1 1 43 43 PHE CB C 43 39.344 39.344 38.573 0.771 18400
1144 1 5 . 1 1 43 43 PHE H H 43 8.320 8.320 7.097 1.223 18400
1145 1 5 . 1 1 44 44 LEU N N 44 122.188 122.188 119.835 2.353 18400
1146 1 5 . 1 1 44 44 LEU HA H 44 4.428 4.428 4.162 0.266 18400
1147 1 5 . 1 1 44 44 LEU C C 44 178.294 178.294 176.992 1.302 18400
1148 1 5 . 1 1 44 44 LEU CA C 44 56.434 56.434 55.322 1.112 18400
1149 1 5 . 1 1 44 44 LEU CB C 44 42.835 42.835 41.208 1.627 18400
1150 1 5 . 1 1 44 44 LEU H H 44 7.387 7.387 7.047 0.340 18400
1151 1 6 . 1 1 2 2 GLN N N 2 122.420 122.420 123.625 -1.205 18400
1152 1 6 . 1 1 2 2 GLN HA H 2 4.665 4.665 4.220 0.445 18400
1153 1 6 . 1 1 2 2 GLN CA C 2 53.740 53.740 54.891 -1.151 18400
1154 1 6 . 1 1 2 2 GLN CB C 2 28.509 28.509 29.166 -0.657 18400
1155 1 6 . 1 1 2 2 GLN H H 2 8.573 8.573 8.307 0.266 18400
1156 1 6 . 1 1 3 3 PRO HA H 3 4.464 4.464 4.521 -0.057 18400
1157 1 6 . 1 1 3 3 PRO C C 3 177.173 177.173 175.521 1.652 18400
1158 1 6 . 1 1 3 3 PRO CA C 3 62.946 62.946 62.124 0.822 18400
1159 1 6 . 1 1 3 3 PRO CB C 3 32.109 32.109 32.503 -0.394 18400
1160 1 6 . 1 1 4 4 ARG N N 4 122.684 122.684 121.268 1.416 18400
1161 1 6 . 1 1 4 4 ARG HA H 4 4.578 4.578 4.182 0.396 18400
1162 1 6 . 1 1 4 4 ARG CA C 4 53.646 53.646 55.693 -2.047 18400
1163 1 6 . 1 1 4 4 ARG CB C 4 29.634 29.634 29.975 -0.341 18400
1164 1 6 . 1 1 4 4 ARG H H 4 8.438 8.438 8.487 -0.049 18400
1165 1 6 . 1 1 5 5 PRO HA H 5 4.400 4.400 4.487 -0.087 18400
1166 1 6 . 1 1 5 5 PRO C C 5 177.137 177.137 175.449 1.688 18400
1167 1 6 . 1 1 5 5 PRO CA C 5 62.490 62.490 62.401 0.089 18400
1168 1 6 . 1 1 5 5 PRO CB C 5 31.928 31.928 32.954 -1.026 18400
1169 1 6 . 1 1 6 6 ALA N N 6 123.540 123.540 126.947 -3.407 18400
1170 1 6 . 1 1 6 6 ALA HA H 6 3.919 3.919 4.354 -0.435 18400
1171 1 6 . 1 1 6 6 ALA C C 6 176.845 176.845 175.756 1.089 18400
1172 1 6 . 1 1 6 6 ALA CA C 6 53.270 53.270 50.890 2.380 18400
1173 1 6 . 1 1 6 6 ALA CB C 6 19.045 19.045 19.975 -0.930 18400
1174 1 6 . 1 1 6 6 ALA H H 6 8.360 8.360 8.271 0.089 18400
1175 1 6 . 1 1 7 7 LYS N N 7 121.074 121.074 120.225 0.849 18400
1176 1 6 . 1 1 7 7 LYS HA H 7 4.306 4.306 4.381 -0.075 18400
1177 1 6 . 1 1 7 7 LYS C C 7 175.113 175.113 174.258 0.855 18400
1178 1 6 . 1 1 7 7 LYS CA C 7 56.621 56.621 55.672 0.949 18400
1179 1 6 . 1 1 7 7 LYS CB C 7 36.158 36.158 32.700 3.458 18400
1180 1 6 . 1 1 7 7 LYS H H 7 7.691 7.691 7.836 -0.145 18400
1181 1 6 . 1 1 8 8 TYR N N 8 117.325 117.325 121.245 -3.920 18400
1182 1 6 . 1 1 8 8 TYR HA H 8 5.660 5.660 4.692 0.968 18400
1183 1 6 . 1 1 8 8 TYR C C 8 175.278 175.278 174.255 1.023 18400
1184 1 6 . 1 1 8 8 TYR CA C 8 56.011 56.011 56.439 -0.428 18400
1185 1 6 . 1 1 8 8 TYR CB C 8 42.531 42.531 42.597 -0.066 18400
1186 1 6 . 1 1 8 8 TYR H H 8 8.349 8.349 8.239 0.110 18400
1187 1 6 . 1 1 9 9 LYS N N 9 120.812 120.812 122.344 -1.532 18400
1188 1 6 . 1 1 9 9 LYS HA H 9 5.647 5.647 4.753 0.894 18400
1189 1 6 . 1 1 9 9 LYS C C 9 174.978 174.978 175.139 -0.161 18400
1190 1 6 . 1 1 9 9 LYS CA C 9 54.767 54.767 55.358 -0.591 18400
1191 1 6 . 1 1 9 9 LYS CB C 9 36.033 36.033 33.803 2.230 18400
1192 1 6 . 1 1 9 9 LYS H H 9 9.648 9.648 8.997 0.651 18400
1193 1 6 . 1 1 10 10 PHE N N 10 118.595 118.595 123.738 -5.143 18400
1194 1 6 . 1 1 10 10 PHE HA H 10 5.220 5.220 4.840 0.380 18400
1195 1 6 . 1 1 10 10 PHE C C 10 172.698 172.698 172.454 0.244 18400
1196 1 6 . 1 1 10 10 PHE CA C 10 55.854 55.854 56.457 -0.603 18400
1197 1 6 . 1 1 10 10 PHE CB C 10 40.607 40.607 42.062 -1.455 18400
1198 1 6 . 1 1 10 10 PHE H H 10 8.890 8.890 8.391 0.499 18400
1199 1 6 . 1 1 11 11 THR N N 11 117.249 117.249 116.260 0.989 18400
1200 1 6 . 1 1 11 11 THR HA H 11 4.745 4.745 4.334 0.411 18400
1201 1 6 . 1 1 11 11 THR C C 11 175.071 175.071 173.004 2.067 18400
1202 1 6 . 1 1 11 11 THR CA C 11 61.667 61.667 60.959 0.708 18400
1203 1 6 . 1 1 11 11 THR CB C 11 69.324 69.324 69.210 0.114 18400
1204 1 6 . 1 1 11 11 THR H H 11 8.904 8.904 7.795 1.109 18400
1205 1 6 . 1 1 12 12 ASP N N 12 127.813 127.813 125.899 1.914 18400
1206 1 6 . 1 1 12 12 ASP HA H 12 4.903 4.903 3.829 1.074 18400
1207 1 6 . 1 1 12 12 ASP C C 12 179.041 179.041 177.270 1.771 18400
1208 1 6 . 1 1 12 12 ASP CA C 12 52.773 52.773 53.653 -0.880 18400
1209 1 6 . 1 1 12 12 ASP CB C 12 38.879 38.879 41.626 -2.747 18400
1210 1 6 . 1 1 12 12 ASP H H 12 8.993 8.993 7.785 1.208 18400
1211 1 6 . 1 1 13 13 VAL N N 13 117.388 117.388 120.809 -3.421 18400
1212 1 6 . 1 1 13 13 VAL HA H 13 3.990 3.990 3.772 0.218 18400
1213 1 6 . 1 1 13 13 VAL C C 13 176.796 176.796 176.288 0.508 18400
1214 1 6 . 1 1 13 13 VAL CA C 13 64.349 64.349 64.822 -0.473 18400
1215 1 6 . 1 1 13 13 VAL CB C 13 31.652 31.652 31.998 -0.346 18400
1216 1 6 . 1 1 13 13 VAL H H 13 8.950 8.950 8.408 0.542 18400
1217 1 6 . 1 1 14 14 ASN N N 14 117.303 117.303 116.991 0.312 18400
1218 1 6 . 1 1 14 14 ASN HA H 14 4.781 4.781 4.637 0.144 18400
1219 1 6 . 1 1 14 14 ASN C C 14 176.606 176.606 175.268 1.338 18400
1220 1 6 . 1 1 14 14 ASN CB C 14 38.851 38.851 38.316 0.535 18400
1221 1 6 . 1 1 14 14 ASN H H 14 8.011 8.011 8.319 -0.308 18400
1222 1 6 . 1 1 15 15 GLY N N 15 108.443 108.443 107.968 0.475 18400
1223 1 6 . 1 1 15 15 GLY C C 15 174.799 174.799 174.068 0.731 18400
1224 1 6 . 1 1 15 15 GLY CA C 15 45.246 45.246 45.165 0.081 18400
1225 1 6 . 1 1 15 15 GLY H H 15 8.288 8.288 7.544 0.744 18400
1226 1 6 . 1 1 16 16 GLU N N 16 122.005 122.005 119.343 2.662 18400
1227 1 6 . 1 1 16 16 GLU HA H 16 4.373 4.373 4.363 0.010 18400
1228 1 6 . 1 1 16 16 GLU C C 16 176.564 176.564 175.709 0.855 18400
1229 1 6 . 1 1 16 16 GLU CA C 16 55.798 55.798 56.876 -1.078 18400
1230 1 6 . 1 1 16 16 GLU CB C 16 30.932 30.932 29.922 1.010 18400
1231 1 6 . 1 1 16 16 GLU H H 16 8.045 8.045 8.011 0.034 18400
1232 1 6 . 1 1 17 17 THR N N 17 120.458 120.458 114.134 6.324 18400
1233 1 6 . 1 1 17 17 THR HA H 17 4.583 4.583 4.800 -0.217 18400
1234 1 6 . 1 1 17 17 THR C C 17 174.583 174.583 173.696 0.887 18400
1235 1 6 . 1 1 17 17 THR CA C 17 63.471 63.471 61.834 1.637 18400
1236 1 6 . 1 1 17 17 THR CB C 17 69.004 69.004 69.630 -0.626 18400
1237 1 6 . 1 1 17 17 THR H H 17 8.758 8.758 8.329 0.429 18400
1238 1 6 . 1 1 18 18 LYS N N 18 129.000 129.000 123.783 5.217 18400
1239 1 6 . 1 1 18 18 LYS HA H 18 4.581 4.581 4.829 -0.248 18400
1240 1 6 . 1 1 18 18 LYS C C 18 174.995 174.995 175.578 -0.583 18400
1241 1 6 . 1 1 18 18 LYS CB C 18 36.219 36.219 36.020 0.199 18400
1242 1 6 . 1 1 18 18 LYS H H 18 8.848 8.848 8.135 0.713 18400
1243 1 6 . 1 1 19 19 THR N N 19 107.308 107.308 112.939 -5.631 18400
1244 1 6 . 1 1 19 19 THR HA H 19 5.662 5.662 4.659 1.003 18400
1245 1 6 . 1 1 19 19 THR C C 19 175.135 175.135 174.046 1.089 18400
1246 1 6 . 1 1 19 19 THR CA C 19 59.541 59.541 62.645 -3.104 18400
1247 1 6 . 1 1 19 19 THR CB C 19 72.571 72.571 69.284 3.287 18400
1248 1 6 . 1 1 19 19 THR H H 19 8.023 8.023 8.315 -0.292 18400
1249 1 6 . 1 1 20 20 TRP N N 20 120.113 120.113 127.339 -7.226 18400
1250 1 6 . 1 1 20 20 TRP HA H 20 5.793 5.793 4.614 1.179 18400
1251 1 6 . 1 1 20 20 TRP CA C 20 55.233 55.233 56.699 -1.466 18400
1252 1 6 . 1 1 20 20 TRP CB C 20 33.193 33.193 31.538 1.655 18400
1253 1 6 . 1 1 20 20 TRP H H 20 9.317 9.317 8.000 1.317 18400
1254 1 6 . 1 1 21 21 THR HA H 21 4.280 4.280 4.239 0.041 18400
1255 1 6 . 1 1 21 21 THR CA C 21 62.844 62.844 62.073 0.771 18400
1256 1 6 . 1 1 21 21 THR CB C 21 70.918 70.918 70.907 0.011 18400
1257 1 6 . 1 1 21 21 THR H H 21 8.449 8.449 7.579 0.870 18400
1258 1 6 . 1 1 22 22 GLY C C 22 172.841 172.841 173.601 -0.760 18400
1259 1 6 . 1 1 22 22 GLY CA C 22 44.229 44.229 44.881 -0.652 18400
1260 1 6 . 1 1 22 22 GLY H H 22 7.928 7.928 7.618 0.310 18400
1261 1 6 . 1 1 23 23 GLN N N 23 117.973 117.973 122.067 -4.094 18400
1262 1 6 . 1 1 23 23 GLN HA H 23 4.533 4.533 4.240 0.293 18400
1263 1 6 . 1 1 23 23 GLN C C 23 176.979 176.979 176.848 0.131 18400
1264 1 6 . 1 1 23 23 GLN CA C 23 54.099 54.099 54.325 -0.226 18400
1265 1 6 . 1 1 23 23 GLN CB C 23 30.565 30.565 27.437 3.128 18400
1266 1 6 . 1 1 23 23 GLN H H 23 7.141 7.141 7.458 -0.317 18400
1267 1 6 . 1 1 24 24 GLY N N 24 111.998 111.998 111.174 0.824 18400
1268 1 6 . 1 1 24 24 GLY C C 24 174.510 174.510 174.715 -0.205 18400
1269 1 6 . 1 1 24 24 GLY CA C 24 44.906 44.906 45.946 -1.040 18400
1270 1 6 . 1 1 24 24 GLY H H 24 8.841 8.841 8.152 0.689 18400
1271 1 6 . 1 1 25 25 ARG N N 25 121.958 121.958 124.988 -3.030 18400
1272 1 6 . 1 1 25 25 ARG HA H 25 4.179 4.179 4.223 -0.044 18400
1273 1 6 . 1 1 25 25 ARG C C 25 177.025 177.025 175.159 1.866 18400
1274 1 6 . 1 1 25 25 ARG CA C 25 56.285 56.285 57.017 -0.732 18400
1275 1 6 . 1 1 25 25 ARG CB C 25 29.885 29.885 30.114 -0.229 18400
1276 1 6 . 1 1 25 25 ARG H H 25 8.444 8.444 8.282 0.162 18400
1277 1 6 . 1 1 26 26 THR N N 26 122.468 122.468 119.810 2.658 18400
1278 1 6 . 1 1 26 26 THR HA H 26 3.226 3.226 4.825 -1.599 18400
1279 1 6 . 1 1 26 26 THR CA C 26 60.422 60.422 59.094 1.328 18400
1280 1 6 . 1 1 26 26 THR CB C 26 69.088 69.088 68.819 0.269 18400
1281 1 6 . 1 1 26 26 THR H H 26 8.369 8.369 8.398 -0.029 18400
1282 1 6 . 1 1 27 27 PRO HA H 27 3.867 3.867 4.153 -0.286 18400
1283 1 6 . 1 1 27 27 PRO C C 27 177.571 177.571 178.121 -0.550 18400
1284 1 6 . 1 1 27 27 PRO CA C 27 62.174 62.174 62.903 -0.729 18400
1285 1 6 . 1 1 27 27 PRO CB C 27 32.818 32.818 31.970 0.848 18400
1286 1 6 . 1 1 28 28 LYS N N 28 126.298 126.298 122.471 3.827 18400
1287 1 6 . 1 1 28 28 LYS HA H 28 3.925 3.925 3.958 -0.033 18400
1288 1 6 . 1 1 28 28 LYS CA C 28 60.815 60.815 61.822 -1.007 18400
1289 1 6 . 1 1 28 28 LYS H H 28 8.903 8.903 8.842 0.061 18400
1290 1 6 . 1 1 29 29 PRO HA H 29 4.289 4.289 4.212 0.077 18400
1291 1 6 . 1 1 29 29 PRO C C 29 180.695 180.695 178.801 1.894 18400
1292 1 6 . 1 1 29 29 PRO CA C 29 65.875 65.875 65.414 0.461 18400
1293 1 6 . 1 1 29 29 PRO CB C 29 31.770 31.770 31.020 0.750 18400
1294 1 6 . 1 1 30 30 ILE N N 30 114.387 114.387 118.051 -3.664 18400
1295 1 6 . 1 1 30 30 ILE HA H 30 3.021 3.021 3.786 -0.765 18400
1296 1 6 . 1 1 30 30 ILE C C 30 176.633 176.633 178.126 -1.493 18400
1297 1 6 . 1 1 30 30 ILE CA C 30 63.949 63.949 63.882 0.067 18400
1298 1 6 . 1 1 30 30 ILE CB C 30 36.650 36.650 36.800 -0.150 18400
1299 1 6 . 1 1 30 30 ILE H H 30 6.051 6.051 7.910 -1.859 18400
1300 1 6 . 1 1 31 31 ALA N N 31 123.060 123.060 122.938 0.122 18400
1301 1 6 . 1 1 31 31 ALA HA H 31 3.720 3.720 3.930 -0.210 18400
1302 1 6 . 1 1 31 31 ALA C C 31 181.571 181.571 179.222 2.349 18400
1303 1 6 . 1 1 31 31 ALA CA C 31 55.456 55.456 55.948 -0.492 18400
1304 1 6 . 1 1 31 31 ALA CB C 31 17.825 17.825 17.838 -0.013 18400
1305 1 6 . 1 1 31 31 ALA H H 31 7.922 7.922 8.928 -1.006 18400
1306 1 6 . 1 1 32 32 GLN N N 32 117.568 117.568 119.195 -1.627 18400
1307 1 6 . 1 1 32 32 GLN HA H 32 3.934 3.934 4.059 -0.125 18400
1308 1 6 . 1 1 32 32 GLN C C 32 178.025 178.025 178.164 -0.139 18400
1309 1 6 . 1 1 32 32 GLN CA C 32 58.424 58.424 58.838 -0.414 18400
1310 1 6 . 1 1 32 32 GLN CB C 32 28.285 28.285 28.517 -0.232 18400
1311 1 6 . 1 1 32 32 GLN H H 32 8.438 8.438 7.927 0.511 18400
1312 1 6 . 1 1 33 33 ALA N N 33 121.972 121.972 122.856 -0.884 18400
1313 1 6 . 1 1 33 33 ALA HA H 33 4.282 4.282 4.228 0.054 18400
1314 1 6 . 1 1 33 33 ALA C C 33 181.426 181.426 179.960 1.466 18400
1315 1 6 . 1 1 33 33 ALA CA C 33 55.082 55.082 55.133 -0.051 18400
1316 1 6 . 1 1 33 33 ALA CB C 33 18.720 18.720 18.559 0.161 18400
1317 1 6 . 1 1 33 33 ALA H H 33 7.099 7.099 7.425 -0.326 18400
1318 1 6 . 1 1 34 34 LEU N N 34 119.898 119.898 119.472 0.426 18400
1319 1 6 . 1 1 34 34 LEU HA H 34 4.297 4.297 4.654 -0.357 18400
1320 1 6 . 1 1 34 34 LEU C C 34 182.198 182.198 180.295 1.903 18400
1321 1 6 . 1 1 34 34 LEU CA C 34 57.310 57.310 57.197 0.113 18400
1322 1 6 . 1 1 34 34 LEU CB C 34 40.490 40.490 42.135 -1.645 18400
1323 1 6 . 1 1 34 34 LEU H H 34 8.538 8.538 8.762 -0.224 18400
1324 1 6 . 1 1 35 35 ALA N N 35 122.660 122.660 121.172 1.488 18400
1325 1 6 . 1 1 35 35 ALA HA H 35 4.222 4.222 4.132 0.090 18400
1326 1 6 . 1 1 35 35 ALA C C 35 179.762 179.762 178.773 0.989 18400
1327 1 6 . 1 1 35 35 ALA CA C 35 54.226 54.226 54.621 -0.395 18400
1328 1 6 . 1 1 35 35 ALA CB C 35 17.744 17.744 18.219 -0.475 18400
1329 1 6 . 1 1 35 35 ALA H H 35 7.741 7.741 8.537 -0.796 18400
1330 1 6 . 1 1 36 36 GLU N N 36 116.640 116.640 116.413 0.227 18400
1331 1 6 . 1 1 36 36 GLU HA H 36 4.403 4.403 4.242 0.161 18400
1332 1 6 . 1 1 36 36 GLU C C 36 177.531 177.531 177.288 0.243 18400
1333 1 6 . 1 1 36 36 GLU CA C 36 55.856 55.856 57.139 -1.283 18400
1334 1 6 . 1 1 36 36 GLU CB C 36 29.741 29.741 30.261 -0.520 18400
1335 1 6 . 1 1 36 36 GLU H H 36 7.496 7.496 7.675 -0.179 18400
1336 1 6 . 1 1 37 37 GLY N N 37 106.885 106.885 106.498 0.387 18400
1337 1 6 . 1 1 37 37 GLY C C 37 176.072 176.072 174.444 1.628 18400
1338 1 6 . 1 1 37 37 GLY CA C 37 45.369 45.369 45.028 0.341 18400
1339 1 6 . 1 1 37 37 GLY H H 37 7.802 7.802 8.183 -0.381 18400
1340 1 6 . 1 1 38 38 LYS N N 38 120.419 120.419 121.934 -1.515 18400
1341 1 6 . 1 1 38 38 LYS HA H 38 4.479 4.479 4.503 -0.024 18400
1342 1 6 . 1 1 38 38 LYS C C 38 174.921 174.921 176.110 -1.189 18400
1343 1 6 . 1 1 38 38 LYS CA C 38 55.927 55.927 55.385 0.542 18400
1344 1 6 . 1 1 38 38 LYS CB C 38 31.850 31.850 33.455 -1.605 18400
1345 1 6 . 1 1 38 38 LYS H H 38 7.935 7.935 7.549 0.386 18400
1346 1 6 . 1 1 39 39 SER N N 39 114.172 114.172 115.841 -1.669 18400
1347 1 6 . 1 1 39 39 SER HA H 39 4.812 4.812 4.529 0.283 18400
1348 1 6 . 1 1 39 39 SER C C 39 176.690 176.690 175.972 0.718 18400
1349 1 6 . 1 1 39 39 SER CA C 39 56.473 56.473 57.449 -0.976 18400
1350 1 6 . 1 1 39 39 SER CB C 39 65.933 65.933 64.196 1.737 18400
1351 1 6 . 1 1 39 39 SER H H 39 8.579 8.579 8.517 0.062 18400
1352 1 6 . 1 1 40 40 LEU N N 40 126.212 126.212 121.663 4.549 18400
1353 1 6 . 1 1 40 40 LEU HA H 40 4.201 4.201 4.154 0.047 18400
1354 1 6 . 1 1 40 40 LEU C C 40 179.329 179.329 178.175 1.154 18400
1355 1 6 . 1 1 40 40 LEU CA C 40 58.049 58.049 55.848 2.201 18400
1356 1 6 . 1 1 40 40 LEU CB C 40 41.038 41.038 40.948 0.090 18400
1357 1 6 . 1 1 40 40 LEU H H 40 9.038 9.038 8.865 0.173 18400
1358 1 6 . 1 1 41 41 ASP N N 41 115.700 115.700 118.628 -2.928 18400
1359 1 6 . 1 1 41 41 ASP HA H 41 4.580 4.580 4.001 0.579 18400
1360 1 6 . 1 1 41 41 ASP C C 41 179.063 179.063 177.529 1.534 18400
1361 1 6 . 1 1 41 41 ASP CA C 41 56.353 56.353 57.054 -0.701 18400
1362 1 6 . 1 1 41 41 ASP CB C 41 40.217 40.217 40.219 -0.002 18400
1363 1 6 . 1 1 41 41 ASP H H 41 8.217 8.217 8.243 -0.026 18400
1364 1 6 . 1 1 42 42 ASP N N 42 119.466 119.466 119.149 0.317 18400
1365 1 6 . 1 1 42 42 ASP HA H 42 4.422 4.422 4.339 0.083 18400
1366 1 6 . 1 1 42 42 ASP C C 42 177.484 177.484 176.808 0.676 18400
1367 1 6 . 1 1 42 42 ASP CB C 42 40.234 40.234 40.726 -0.492 18400
1368 1 6 . 1 1 42 42 ASP H H 42 7.959 7.959 7.353 0.606 18400
1369 1 6 . 1 1 43 43 PHE N N 43 117.109 117.109 116.351 0.758 18400
1370 1 6 . 1 1 43 43 PHE HA H 43 4.873 4.873 4.727 0.146 18400
1371 1 6 . 1 1 43 43 PHE C C 43 175.641 175.641 174.832 0.809 18400
1372 1 6 . 1 1 43 43 PHE CA C 43 58.196 58.196 56.018 2.178 18400
1373 1 6 . 1 1 43 43 PHE CB C 43 39.344 39.344 38.864 0.480 18400
1374 1 6 . 1 1 43 43 PHE H H 43 8.320 8.320 7.268 1.052 18400
1375 1 6 . 1 1 44 44 LEU N N 44 122.188 122.188 119.190 2.998 18400
1376 1 6 . 1 1 44 44 LEU HA H 44 4.428 4.428 4.221 0.207 18400
1377 1 6 . 1 1 44 44 LEU C C 44 178.294 178.294 177.171 1.123 18400
1378 1 6 . 1 1 44 44 LEU CA C 44 56.434 56.434 55.324 1.110 18400
1379 1 6 . 1 1 44 44 LEU CB C 44 42.835 42.835 41.550 1.285 18400
1380 1 6 . 1 1 44 44 LEU H H 44 7.387 7.387 7.005 0.382 18400
1381 1 7 . 1 1 2 2 GLN N N 2 122.420 122.420 120.556 1.864 18400
1382 1 7 . 1 1 2 2 GLN HA H 2 4.665 4.665 4.730 -0.065 18400
1383 1 7 . 1 1 2 2 GLN CA C 2 53.740 53.740 54.295 -0.555 18400
1384 1 7 . 1 1 2 2 GLN CB C 2 28.509 28.509 29.136 -0.627 18400
1385 1 7 . 1 1 2 2 GLN H H 2 8.573 8.573 8.364 0.209 18400
1386 1 7 . 1 1 3 3 PRO HA H 3 4.464 4.464 4.534 -0.070 18400
1387 1 7 . 1 1 3 3 PRO C C 3 177.173 177.173 175.865 1.308 18400
1388 1 7 . 1 1 3 3 PRO CA C 3 62.946 62.946 62.105 0.841 18400
1389 1 7 . 1 1 3 3 PRO CB C 3 32.109 32.109 32.599 -0.490 18400
1390 1 7 . 1 1 4 4 ARG N N 4 122.684 122.684 121.801 0.883 18400
1391 1 7 . 1 1 4 4 ARG HA H 4 4.578 4.578 4.312 0.266 18400
1392 1 7 . 1 1 4 4 ARG CA C 4 53.646 53.646 55.797 -2.151 18400
1393 1 7 . 1 1 4 4 ARG CB C 4 29.634 29.634 28.638 0.996 18400
1394 1 7 . 1 1 4 4 ARG H H 4 8.438 8.438 8.497 -0.059 18400
1395 1 7 . 1 1 5 5 PRO HA H 5 4.400 4.400 4.715 -0.315 18400
1396 1 7 . 1 1 5 5 PRO C C 5 177.137 177.137 175.268 1.869 18400
1397 1 7 . 1 1 5 5 PRO CA C 5 62.490 62.490 62.219 0.271 18400
1398 1 7 . 1 1 5 5 PRO CB C 5 31.928 31.928 33.115 -1.187 18400
1399 1 7 . 1 1 6 6 ALA N N 6 123.540 123.540 121.677 1.863 18400
1400 1 7 . 1 1 6 6 ALA HA H 6 3.919 3.919 4.273 -0.354 18400
1401 1 7 . 1 1 6 6 ALA C C 6 176.845 176.845 176.144 0.701 18400
1402 1 7 . 1 1 6 6 ALA CA C 6 53.270 53.270 51.276 1.994 18400
1403 1 7 . 1 1 6 6 ALA CB C 6 19.045 19.045 20.071 -1.026 18400
1404 1 7 . 1 1 6 6 ALA H H 6 8.360 8.360 8.027 0.333 18400
1405 1 7 . 1 1 7 7 LYS N N 7 121.074 121.074 119.873 1.201 18400
1406 1 7 . 1 1 7 7 LYS HA H 7 4.306 4.306 4.450 -0.144 18400
1407 1 7 . 1 1 7 7 LYS C C 7 175.113 175.113 174.328 0.785 18400
1408 1 7 . 1 1 7 7 LYS CA C 7 56.621 56.621 55.643 0.978 18400
1409 1 7 . 1 1 7 7 LYS CB C 7 36.158 36.158 32.910 3.248 18400
1410 1 7 . 1 1 7 7 LYS H H 7 7.691 7.691 7.912 -0.221 18400
1411 1 7 . 1 1 8 8 TYR N N 8 117.325 117.325 121.843 -4.518 18400
1412 1 7 . 1 1 8 8 TYR HA H 8 5.660 5.660 4.609 1.051 18400
1413 1 7 . 1 1 8 8 TYR C C 8 175.278 175.278 174.101 1.177 18400
1414 1 7 . 1 1 8 8 TYR CA C 8 56.011 56.011 56.594 -0.583 18400
1415 1 7 . 1 1 8 8 TYR CB C 8 42.531 42.531 42.842 -0.311 18400
1416 1 7 . 1 1 8 8 TYR H H 8 8.349 8.349 8.232 0.117 18400
1417 1 7 . 1 1 9 9 LYS N N 9 120.812 120.812 122.234 -1.422 18400
1418 1 7 . 1 1 9 9 LYS HA H 9 5.647 5.647 4.943 0.704 18400
1419 1 7 . 1 1 9 9 LYS C C 9 174.978 174.978 175.284 -0.306 18400
1420 1 7 . 1 1 9 9 LYS CA C 9 54.767 54.767 55.981 -1.214 18400
1421 1 7 . 1 1 9 9 LYS CB C 9 36.033 36.033 34.293 1.740 18400
1422 1 7 . 1 1 9 9 LYS H H 9 9.648 9.648 8.772 0.876 18400
1423 1 7 . 1 1 10 10 PHE N N 10 118.595 118.595 125.137 -6.542 18400
1424 1 7 . 1 1 10 10 PHE HA H 10 5.220 5.220 4.902 0.318 18400
1425 1 7 . 1 1 10 10 PHE C C 10 172.698 172.698 172.577 0.121 18400
1426 1 7 . 1 1 10 10 PHE CA C 10 55.854 55.854 56.527 -0.673 18400
1427 1 7 . 1 1 10 10 PHE CB C 10 40.607 40.607 42.168 -1.561 18400
1428 1 7 . 1 1 10 10 PHE H H 10 8.890 8.890 8.596 0.294 18400
1429 1 7 . 1 1 11 11 THR N N 11 117.249 117.249 112.430 4.819 18400
1430 1 7 . 1 1 11 11 THR HA H 11 4.745 4.745 4.281 0.464 18400
1431 1 7 . 1 1 11 11 THR C C 11 175.071 175.071 172.847 2.224 18400
1432 1 7 . 1 1 11 11 THR CA C 11 61.667 61.667 60.217 1.450 18400
1433 1 7 . 1 1 11 11 THR CB C 11 69.324 69.324 70.162 -0.839 18400
1434 1 7 . 1 1 11 11 THR H H 11 8.904 8.904 7.533 1.371 18400
1435 1 7 . 1 1 12 12 ASP N N 12 127.813 127.813 124.478 3.335 18400
1436 1 7 . 1 1 12 12 ASP HA H 12 4.903 4.903 3.915 0.988 18400
1437 1 7 . 1 1 12 12 ASP C C 12 179.041 179.041 177.683 1.358 18400
1438 1 7 . 1 1 12 12 ASP CA C 12 52.773 52.773 55.417 -2.644 18400
1439 1 7 . 1 1 12 12 ASP CB C 12 38.879 38.879 41.290 -2.411 18400
1440 1 7 . 1 1 12 12 ASP H H 12 8.993 8.993 7.984 1.009 18400
1441 1 7 . 1 1 13 13 VAL N N 13 117.388 117.388 119.298 -1.910 18400
1442 1 7 . 1 1 13 13 VAL HA H 13 3.990 3.990 3.774 0.216 18400
1443 1 7 . 1 1 13 13 VAL C C 13 176.796 176.796 175.919 0.877 18400
1444 1 7 . 1 1 13 13 VAL CA C 13 64.349 64.349 64.313 0.036 18400
1445 1 7 . 1 1 13 13 VAL CB C 13 31.652 31.652 32.053 -0.401 18400
1446 1 7 . 1 1 13 13 VAL H H 13 8.950 8.950 8.151 0.799 18400
1447 1 7 . 1 1 14 14 ASN N N 14 117.303 117.303 116.077 1.226 18400
1448 1 7 . 1 1 14 14 ASN HA H 14 4.781 4.781 4.684 0.097 18400
1449 1 7 . 1 1 14 14 ASN C C 14 176.606 176.606 175.229 1.377 18400
1450 1 7 . 1 1 14 14 ASN CB C 14 38.851 38.851 38.990 -0.139 18400
1451 1 7 . 1 1 14 14 ASN H H 14 8.011 8.011 8.215 -0.204 18400
1452 1 7 . 1 1 15 15 GLY N N 15 108.443 108.443 107.873 0.570 18400
1453 1 7 . 1 1 15 15 GLY C C 15 174.799 174.799 174.030 0.769 18400
1454 1 7 . 1 1 15 15 GLY CA C 15 45.246 45.246 44.908 0.338 18400
1455 1 7 . 1 1 15 15 GLY H H 15 8.288 8.288 7.415 0.873 18400
1456 1 7 . 1 1 16 16 GLU N N 16 122.005 122.005 119.299 2.706 18400
1457 1 7 . 1 1 16 16 GLU HA H 16 4.373 4.373 4.278 0.095 18400
1458 1 7 . 1 1 16 16 GLU C C 16 176.564 176.564 175.474 1.090 18400
1459 1 7 . 1 1 16 16 GLU CA C 16 55.798 55.798 56.164 -0.366 18400
1460 1 7 . 1 1 16 16 GLU CB C 16 30.932 30.932 30.033 0.899 18400
1461 1 7 . 1 1 16 16 GLU H H 16 8.045 8.045 8.047 -0.002 18400
1462 1 7 . 1 1 17 17 THR N N 17 120.458 120.458 113.450 7.008 18400
1463 1 7 . 1 1 17 17 THR HA H 17 4.583 4.583 5.142 -0.559 18400
1464 1 7 . 1 1 17 17 THR C C 17 174.583 174.583 173.378 1.205 18400
1465 1 7 . 1 1 17 17 THR CA C 17 63.471 63.471 61.355 2.116 18400
1466 1 7 . 1 1 17 17 THR CB C 17 69.004 69.004 69.568 -0.564 18400
1467 1 7 . 1 1 17 17 THR H H 17 8.758 8.758 8.269 0.489 18400
1468 1 7 . 1 1 18 18 LYS N N 18 129.000 129.000 122.613 6.387 18400
1469 1 7 . 1 1 18 18 LYS HA H 18 4.581 4.581 4.767 -0.186 18400
1470 1 7 . 1 1 18 18 LYS C C 18 174.995 174.995 174.931 0.064 18400
1471 1 7 . 1 1 18 18 LYS CB C 18 36.219 36.219 36.348 -0.129 18400
1472 1 7 . 1 1 18 18 LYS H H 18 8.848 8.848 8.131 0.717 18400
1473 1 7 . 1 1 19 19 THR N N 19 107.308 107.308 112.960 -5.652 18400
1474 1 7 . 1 1 19 19 THR HA H 19 5.662 5.662 4.754 0.908 18400
1475 1 7 . 1 1 19 19 THR C C 19 175.135 175.135 173.872 1.263 18400
1476 1 7 . 1 1 19 19 THR CA C 19 59.541 59.541 61.985 -2.444 18400
1477 1 7 . 1 1 19 19 THR CB C 19 72.571 72.571 69.447 3.124 18400
1478 1 7 . 1 1 19 19 THR H H 19 8.023 8.023 8.369 -0.346 18400
1479 1 7 . 1 1 20 20 TRP N N 20 120.113 120.113 127.966 -7.853 18400
1480 1 7 . 1 1 20 20 TRP HA H 20 5.793 5.793 4.559 1.234 18400
1481 1 7 . 1 1 20 20 TRP CA C 20 55.233 55.233 56.540 -1.307 18400
1482 1 7 . 1 1 20 20 TRP CB C 20 33.193 33.193 30.201 2.992 18400
1483 1 7 . 1 1 20 20 TRP H H 20 9.317 9.317 8.278 1.039 18400
1484 1 7 . 1 1 21 21 THR HA H 21 4.280 4.280 4.264 0.016 18400
1485 1 7 . 1 1 21 21 THR CA C 21 62.844 62.844 62.004 0.841 18400
1486 1 7 . 1 1 21 21 THR CB C 21 70.918 70.918 70.152 0.766 18400
1487 1 7 . 1 1 21 21 THR H H 21 8.449 8.449 7.714 0.735 18400
1488 1 7 . 1 1 22 22 GLY C C 22 172.841 172.841 173.414 -0.573 18400
1489 1 7 . 1 1 22 22 GLY CA C 22 44.229 44.229 44.522 -0.293 18400
1490 1 7 . 1 1 22 22 GLY H H 22 7.928 7.928 7.128 0.800 18400
1491 1 7 . 1 1 23 23 GLN N N 23 117.973 117.973 119.774 -1.801 18400
1492 1 7 . 1 1 23 23 GLN HA H 23 4.533 4.533 4.115 0.418 18400
1493 1 7 . 1 1 23 23 GLN C C 23 176.979 176.979 175.640 1.339 18400
1494 1 7 . 1 1 23 23 GLN CA C 23 54.099 54.099 57.542 -3.443 18400
1495 1 7 . 1 1 23 23 GLN CB C 23 30.565 30.565 29.515 1.050 18400
1496 1 7 . 1 1 23 23 GLN H H 23 7.141 7.141 6.964 0.177 18400
1497 1 7 . 1 1 24 24 GLY N N 24 111.998 111.998 106.718 5.280 18400
1498 1 7 . 1 1 24 24 GLY C C 24 174.510 174.510 173.344 1.166 18400
1499 1 7 . 1 1 24 24 GLY CA C 24 44.906 44.906 45.307 -0.401 18400
1500 1 7 . 1 1 24 24 GLY H H 24 8.841 8.841 8.530 0.311 18400
1501 1 7 . 1 1 25 25 ARG N N 25 121.958 121.958 123.264 -1.306 18400
1502 1 7 . 1 1 25 25 ARG HA H 25 4.179 4.179 4.365 -0.186 18400
1503 1 7 . 1 1 25 25 ARG C C 25 177.025 177.025 175.760 1.265 18400
1504 1 7 . 1 1 25 25 ARG CA C 25 56.285 56.285 56.514 -0.229 18400
1505 1 7 . 1 1 25 25 ARG CB C 25 29.885 29.885 30.177 -0.292 18400
1506 1 7 . 1 1 25 25 ARG H H 25 8.444 8.444 8.338 0.106 18400
1507 1 7 . 1 1 26 26 THR N N 26 122.468 122.468 119.278 3.190 18400
1508 1 7 . 1 1 26 26 THR HA H 26 3.226 3.226 4.793 -1.567 18400
1509 1 7 . 1 1 26 26 THR CA C 26 60.422 60.422 59.101 1.321 18400
1510 1 7 . 1 1 26 26 THR CB C 26 69.088 69.088 68.898 0.190 18400
1511 1 7 . 1 1 26 26 THR H H 26 8.369 8.369 8.411 -0.042 18400
1512 1 7 . 1 1 27 27 PRO HA H 27 3.867 3.867 4.155 -0.288 18400
1513 1 7 . 1 1 27 27 PRO C C 27 177.571 177.571 178.118 -0.547 18400
1514 1 7 . 1 1 27 27 PRO CA C 27 62.174 62.174 62.902 -0.728 18400
1515 1 7 . 1 1 27 27 PRO CB C 27 32.818 32.818 31.920 0.898 18400
1516 1 7 . 1 1 28 28 LYS N N 28 126.298 126.298 121.903 4.395 18400
1517 1 7 . 1 1 28 28 LYS HA H 28 3.925 3.925 3.969 -0.044 18400
1518 1 7 . 1 1 28 28 LYS CA C 28 60.815 60.815 60.682 0.133 18400
1519 1 7 . 1 1 28 28 LYS H H 28 8.903 8.903 8.845 0.058 18400
1520 1 7 . 1 1 29 29 PRO HA H 29 4.289 4.289 4.200 0.089 18400
1521 1 7 . 1 1 29 29 PRO C C 29 180.695 180.695 178.768 1.927 18400
1522 1 7 . 1 1 29 29 PRO CA C 29 65.875 65.875 65.338 0.537 18400
1523 1 7 . 1 1 29 29 PRO CB C 29 31.770 31.770 31.003 0.767 18400
1524 1 7 . 1 1 30 30 ILE N N 30 114.387 114.387 117.973 -3.586 18400
1525 1 7 . 1 1 30 30 ILE HA H 30 3.021 3.021 3.639 -0.618 18400
1526 1 7 . 1 1 30 30 ILE C C 30 176.633 176.633 178.120 -1.487 18400
1527 1 7 . 1 1 30 30 ILE CA C 30 63.949 63.949 63.955 -0.006 18400
1528 1 7 . 1 1 30 30 ILE CB C 30 36.650 36.650 36.837 -0.187 18400
1529 1 7 . 1 1 30 30 ILE H H 30 6.051 6.051 7.887 -1.836 18400
1530 1 7 . 1 1 31 31 ALA N N 31 123.060 123.060 122.264 0.796 18400
1531 1 7 . 1 1 31 31 ALA HA H 31 3.720 3.720 4.013 -0.293 18400
1532 1 7 . 1 1 31 31 ALA C C 31 181.571 181.571 179.633 1.938 18400
1533 1 7 . 1 1 31 31 ALA CA C 31 55.456 55.456 55.672 -0.216 18400
1534 1 7 . 1 1 31 31 ALA CB C 31 17.825 17.825 17.875 -0.050 18400
1535 1 7 . 1 1 31 31 ALA H H 31 7.922 7.922 8.832 -0.910 18400
1536 1 7 . 1 1 32 32 GLN N N 32 117.568 117.568 119.177 -1.609 18400
1537 1 7 . 1 1 32 32 GLN HA H 32 3.934 3.934 4.025 -0.091 18400
1538 1 7 . 1 1 32 32 GLN C C 32 178.025 178.025 177.920 0.105 18400
1539 1 7 . 1 1 32 32 GLN CA C 32 58.424 58.424 58.829 -0.405 18400
1540 1 7 . 1 1 32 32 GLN CB C 32 28.285 28.285 28.546 -0.261 18400
1541 1 7 . 1 1 32 32 GLN H H 32 8.438 8.438 7.667 0.771 18400
1542 1 7 . 1 1 33 33 ALA N N 33 121.972 121.972 122.611 -0.639 18400
1543 1 7 . 1 1 33 33 ALA HA H 33 4.282 4.282 4.069 0.213 18400
1544 1 7 . 1 1 33 33 ALA C C 33 181.426 181.426 179.999 1.427 18400
1545 1 7 . 1 1 33 33 ALA CA C 33 55.082 55.082 54.889 0.193 18400
1546 1 7 . 1 1 33 33 ALA CB C 33 18.720 18.720 17.931 0.789 18400
1547 1 7 . 1 1 33 33 ALA H H 33 7.099 7.099 7.377 -0.278 18400
1548 1 7 . 1 1 34 34 LEU N N 34 119.898 119.898 118.821 1.077 18400
1549 1 7 . 1 1 34 34 LEU HA H 34 4.297 4.297 4.801 -0.504 18400
1550 1 7 . 1 1 34 34 LEU C C 34 182.198 182.198 180.076 2.122 18400
1551 1 7 . 1 1 34 34 LEU CA C 34 57.310 57.310 56.858 0.452 18400
1552 1 7 . 1 1 34 34 LEU CB C 34 40.490 40.490 42.308 -1.818 18400
1553 1 7 . 1 1 34 34 LEU H H 34 8.538 8.538 8.828 -0.290 18400
1554 1 7 . 1 1 35 35 ALA N N 35 122.660 122.660 122.269 0.391 18400
1555 1 7 . 1 1 35 35 ALA HA H 35 4.222 4.222 4.112 0.110 18400
1556 1 7 . 1 1 35 35 ALA C C 35 179.762 179.762 179.128 0.634 18400
1557 1 7 . 1 1 35 35 ALA CA C 35 54.226 54.226 54.715 -0.489 18400
1558 1 7 . 1 1 35 35 ALA CB C 35 17.744 17.744 18.164 -0.420 18400
1559 1 7 . 1 1 35 35 ALA H H 35 7.741 7.741 8.300 -0.559 18400
1560 1 7 . 1 1 36 36 GLU N N 36 116.640 116.640 115.888 0.752 18400
1561 1 7 . 1 1 36 36 GLU HA H 36 4.403 4.403 4.290 0.113 18400
1562 1 7 . 1 1 36 36 GLU C C 36 177.531 177.531 177.620 -0.089 18400
1563 1 7 . 1 1 36 36 GLU CA C 36 55.856 55.856 56.619 -0.763 18400
1564 1 7 . 1 1 36 36 GLU CB C 36 29.741 29.741 30.033 -0.292 18400
1565 1 7 . 1 1 36 36 GLU H H 36 7.496 7.496 7.705 -0.209 18400
1566 1 7 . 1 1 37 37 GLY N N 37 106.885 106.885 107.177 -0.292 18400
1567 1 7 . 1 1 37 37 GLY C C 37 176.072 176.072 174.554 1.518 18400
1568 1 7 . 1 1 37 37 GLY CA C 37 45.369 45.369 44.936 0.433 18400
1569 1 7 . 1 1 37 37 GLY H H 37 7.802 7.802 8.196 -0.394 18400
1570 1 7 . 1 1 38 38 LYS N N 38 120.419 120.419 121.268 -0.849 18400
1571 1 7 . 1 1 38 38 LYS HA H 38 4.479 4.479 4.584 -0.105 18400
1572 1 7 . 1 1 38 38 LYS C C 38 174.921 174.921 175.962 -1.041 18400
1573 1 7 . 1 1 38 38 LYS CA C 38 55.927 55.927 55.478 0.449 18400
1574 1 7 . 1 1 38 38 LYS CB C 38 31.850 31.850 33.973 -2.123 18400
1575 1 7 . 1 1 38 38 LYS H H 38 7.935 7.935 7.775 0.160 18400
1576 1 7 . 1 1 39 39 SER N N 39 114.172 114.172 114.734 -0.562 18400
1577 1 7 . 1 1 39 39 SER HA H 39 4.812 4.812 4.516 0.296 18400
1578 1 7 . 1 1 39 39 SER C C 39 176.690 176.690 175.850 0.840 18400
1579 1 7 . 1 1 39 39 SER CA C 39 56.473 56.473 57.910 -1.437 18400
1580 1 7 . 1 1 39 39 SER CB C 39 65.933 65.933 64.532 1.401 18400
1581 1 7 . 1 1 39 39 SER H H 39 8.579 8.579 8.493 0.086 18400
1582 1 7 . 1 1 40 40 LEU N N 40 126.212 126.212 122.022 4.190 18400
1583 1 7 . 1 1 40 40 LEU HA H 40 4.201 4.201 2.926 1.275 18400
1584 1 7 . 1 1 40 40 LEU C C 40 179.329 179.329 177.687 1.642 18400
1585 1 7 . 1 1 40 40 LEU CA C 40 58.049 58.049 56.257 1.792 18400
1586 1 7 . 1 1 40 40 LEU CB C 40 41.038 41.038 41.684 -0.646 18400
1587 1 7 . 1 1 40 40 LEU H H 40 9.038 9.038 8.957 0.081 18400
1588 1 7 . 1 1 41 41 ASP N N 41 115.700 115.700 119.230 -3.530 18400
1589 1 7 . 1 1 41 41 ASP HA H 41 4.580 4.580 4.024 0.556 18400
1590 1 7 . 1 1 41 41 ASP C C 41 179.063 179.063 177.337 1.726 18400
1591 1 7 . 1 1 41 41 ASP CA C 41 56.353 56.353 56.637 -0.284 18400
1592 1 7 . 1 1 41 41 ASP CB C 41 40.217 40.217 40.021 0.196 18400
1593 1 7 . 1 1 41 41 ASP H H 41 8.217 8.217 8.036 0.181 18400
1594 1 7 . 1 1 42 42 ASP N N 42 119.466 119.466 118.394 1.072 18400
1595 1 7 . 1 1 42 42 ASP HA H 42 4.422 4.422 4.503 -0.081 18400
1596 1 7 . 1 1 42 42 ASP C C 42 177.484 177.484 177.115 0.369 18400
1597 1 7 . 1 1 42 42 ASP CB C 42 40.234 40.234 41.351 -1.117 18400
1598 1 7 . 1 1 42 42 ASP H H 42 7.959 7.959 7.157 0.802 18400
1599 1 7 . 1 1 43 43 PHE N N 43 117.109 117.109 115.458 1.651 18400
1600 1 7 . 1 1 43 43 PHE HA H 43 4.873 4.873 4.745 0.128 18400
1601 1 7 . 1 1 43 43 PHE C C 43 175.641 175.641 174.315 1.326 18400
1602 1 7 . 1 1 43 43 PHE CA C 43 58.196 58.196 54.711 3.485 18400
1603 1 7 . 1 1 43 43 PHE CB C 43 39.344 39.344 37.834 1.510 18400
1604 1 7 . 1 1 43 43 PHE H H 43 8.320 8.320 6.636 1.684 18400
1605 1 7 . 1 1 44 44 LEU N N 44 122.188 122.188 120.089 2.099 18400
1606 1 7 . 1 1 44 44 LEU HA H 44 4.428 4.428 4.090 0.338 18400
1607 1 7 . 1 1 44 44 LEU C C 44 178.294 178.294 176.775 1.519 18400
1608 1 7 . 1 1 44 44 LEU CA C 44 56.434 56.434 54.614 1.820 18400
1609 1 7 . 1 1 44 44 LEU CB C 44 42.835 42.835 41.927 0.908 18400
1610 1 7 . 1 1 44 44 LEU H H 44 7.387 7.387 7.056 0.331 18400
1611 1 8 . 1 1 2 2 GLN N N 2 122.420 122.420 123.072 -0.652 18400
1612 1 8 . 1 1 2 2 GLN HA H 2 4.665 4.665 4.197 0.468 18400
1613 1 8 . 1 1 2 2 GLN CA C 2 53.740 53.740 55.138 -1.398 18400
1614 1 8 . 1 1 2 2 GLN CB C 2 28.509 28.509 28.909 -0.400 18400
1615 1 8 . 1 1 2 2 GLN H H 2 8.573 8.573 8.121 0.452 18400
1616 1 8 . 1 1 3 3 PRO HA H 3 4.464 4.464 4.491 -0.027 18400
1617 1 8 . 1 1 3 3 PRO C C 3 177.173 177.173 175.379 1.794 18400
1618 1 8 . 1 1 3 3 PRO CA C 3 62.946 62.946 62.075 0.871 18400
1619 1 8 . 1 1 3 3 PRO CB C 3 32.109 32.109 32.611 -0.502 18400
1620 1 8 . 1 1 4 4 ARG N N 4 122.684 122.684 120.998 1.686 18400
1621 1 8 . 1 1 4 4 ARG HA H 4 4.578 4.578 4.180 0.398 18400
1622 1 8 . 1 1 4 4 ARG CA C 4 53.646 53.646 55.789 -2.143 18400
1623 1 8 . 1 1 4 4 ARG CB C 4 29.634 29.634 29.731 -0.097 18400
1624 1 8 . 1 1 4 4 ARG H H 4 8.438 8.438 8.544 -0.106 18400
1625 1 8 . 1 1 5 5 PRO HA H 5 4.400 4.400 4.547 -0.147 18400
1626 1 8 . 1 1 5 5 PRO C C 5 177.137 177.137 175.637 1.500 18400
1627 1 8 . 1 1 5 5 PRO CA C 5 62.490 62.490 62.066 0.424 18400
1628 1 8 . 1 1 5 5 PRO CB C 5 31.928 31.928 32.120 -0.192 18400
1629 1 8 . 1 1 6 6 ALA N N 6 123.540 123.540 127.188 -3.648 18400
1630 1 8 . 1 1 6 6 ALA HA H 6 3.919 3.919 4.268 -0.349 18400
1631 1 8 . 1 1 6 6 ALA C C 6 176.845 176.845 176.370 0.475 18400
1632 1 8 . 1 1 6 6 ALA CA C 6 53.270 53.270 51.186 2.084 18400
1633 1 8 . 1 1 6 6 ALA CB C 6 19.045 19.045 19.823 -0.778 18400
1634 1 8 . 1 1 6 6 ALA H H 6 8.360 8.360 7.755 0.605 18400
1635 1 8 . 1 1 7 7 LYS N N 7 121.074 121.074 120.095 0.979 18400
1636 1 8 . 1 1 7 7 LYS HA H 7 4.306 4.306 4.258 0.048 18400
1637 1 8 . 1 1 7 7 LYS C C 7 175.113 175.113 174.520 0.593 18400
1638 1 8 . 1 1 7 7 LYS CA C 7 56.621 56.621 55.604 1.017 18400
1639 1 8 . 1 1 7 7 LYS CB C 7 36.158 36.158 31.861 4.297 18400
1640 1 8 . 1 1 7 7 LYS H H 7 7.691 7.691 7.923 -0.232 18400
1641 1 8 . 1 1 8 8 TYR N N 8 117.325 117.325 121.823 -4.498 18400
1642 1 8 . 1 1 8 8 TYR HA H 8 5.660 5.660 4.629 1.031 18400
1643 1 8 . 1 1 8 8 TYR C C 8 175.278 175.278 174.106 1.172 18400
1644 1 8 . 1 1 8 8 TYR CA C 8 56.011 56.011 56.569 -0.557 18400
1645 1 8 . 1 1 8 8 TYR CB C 8 42.531 42.531 42.931 -0.400 18400
1646 1 8 . 1 1 8 8 TYR H H 8 8.349 8.349 8.241 0.108 18400
1647 1 8 . 1 1 9 9 LYS N N 9 120.812 120.812 122.394 -1.582 18400
1648 1 8 . 1 1 9 9 LYS HA H 9 5.647 5.647 4.911 0.736 18400
1649 1 8 . 1 1 9 9 LYS C C 9 174.978 174.978 175.172 -0.194 18400
1650 1 8 . 1 1 9 9 LYS CA C 9 54.767 54.767 55.913 -1.146 18400
1651 1 8 . 1 1 9 9 LYS CB C 9 36.033 36.033 34.454 1.579 18400
1652 1 8 . 1 1 9 9 LYS H H 9 9.648 9.648 8.873 0.775 18400
1653 1 8 . 1 1 10 10 PHE N N 10 118.595 118.595 124.988 -6.393 18400
1654 1 8 . 1 1 10 10 PHE HA H 10 5.220 5.220 4.912 0.308 18400
1655 1 8 . 1 1 10 10 PHE C C 10 172.698 172.698 172.584 0.114 18400
1656 1 8 . 1 1 10 10 PHE CA C 10 55.854 55.854 56.095 -0.241 18400
1657 1 8 . 1 1 10 10 PHE CB C 10 40.607 40.607 41.467 -0.860 18400
1658 1 8 . 1 1 10 10 PHE H H 10 8.890 8.890 8.499 0.391 18400
1659 1 8 . 1 1 11 11 THR N N 11 117.249 117.249 116.246 1.003 18400
1660 1 8 . 1 1 11 11 THR HA H 11 4.745 4.745 4.131 0.614 18400
1661 1 8 . 1 1 11 11 THR C C 11 175.071 175.071 172.939 2.132 18400
1662 1 8 . 1 1 11 11 THR CA C 11 61.667 61.667 60.916 0.751 18400
1663 1 8 . 1 1 11 11 THR CB C 11 69.324 69.324 68.434 0.889 18400
1664 1 8 . 1 1 11 11 THR H H 11 8.904 8.904 7.812 1.092 18400
1665 1 8 . 1 1 12 12 ASP N N 12 127.813 127.813 125.864 1.949 18400
1666 1 8 . 1 1 12 12 ASP HA H 12 4.903 4.903 3.850 1.053 18400
1667 1 8 . 1 1 12 12 ASP C C 12 179.041 179.041 177.536 1.505 18400
1668 1 8 . 1 1 12 12 ASP CA C 12 52.773 52.773 53.984 -1.211 18400
1669 1 8 . 1 1 12 12 ASP CB C 12 38.879 38.879 42.944 -4.066 18400
1670 1 8 . 1 1 12 12 ASP H H 12 8.993 8.993 8.259 0.734 18400
1671 1 8 . 1 1 13 13 VAL N N 13 117.388 117.388 121.880 -4.492 18400
1672 1 8 . 1 1 13 13 VAL HA H 13 3.990 3.990 3.750 0.240 18400
1673 1 8 . 1 1 13 13 VAL C C 13 176.796 176.796 175.935 0.861 18400
1674 1 8 . 1 1 13 13 VAL CA C 13 64.349 64.349 64.248 0.101 18400
1675 1 8 . 1 1 13 13 VAL CB C 13 31.652 31.652 32.233 -0.581 18400
1676 1 8 . 1 1 13 13 VAL H H 13 8.950 8.950 8.605 0.345 18400
1677 1 8 . 1 1 14 14 ASN N N 14 117.303 117.303 116.147 1.156 18400
1678 1 8 . 1 1 14 14 ASN HA H 14 4.781 4.781 4.636 0.145 18400
1679 1 8 . 1 1 14 14 ASN C C 14 176.606 176.606 175.798 0.808 18400
1680 1 8 . 1 1 14 14 ASN CB C 14 38.851 38.851 39.720 -0.869 18400
1681 1 8 . 1 1 14 14 ASN H H 14 8.011 8.011 7.674 0.337 18400
1682 1 8 . 1 1 15 15 GLY N N 15 108.443 108.443 108.244 0.199 18400
1683 1 8 . 1 1 15 15 GLY C C 15 174.799 174.799 173.096 1.703 18400
1684 1 8 . 1 1 15 15 GLY CA C 15 45.246 45.246 44.907 0.339 18400
1685 1 8 . 1 1 15 15 GLY H H 15 8.288 8.288 7.705 0.583 18400
1686 1 8 . 1 1 16 16 GLU N N 16 122.005 122.005 119.394 2.611 18400
1687 1 8 . 1 1 16 16 GLU HA H 16 4.373 4.373 4.216 0.157 18400
1688 1 8 . 1 1 16 16 GLU C C 16 176.564 176.564 175.643 0.921 18400
1689 1 8 . 1 1 16 16 GLU CA C 16 55.798 55.798 56.236 -0.438 18400
1690 1 8 . 1 1 16 16 GLU CB C 16 30.932 30.932 29.843 1.089 18400
1691 1 8 . 1 1 16 16 GLU H H 16 8.045 8.045 8.059 -0.014 18400
1692 1 8 . 1 1 17 17 THR N N 17 120.458 120.458 119.708 0.750 18400
1693 1 8 . 1 1 17 17 THR HA H 17 4.583 4.583 5.065 -0.482 18400
1694 1 8 . 1 1 17 17 THR C C 17 174.583 174.583 174.099 0.484 18400
1695 1 8 . 1 1 17 17 THR CA C 17 63.471 63.471 61.192 2.279 18400
1696 1 8 . 1 1 17 17 THR CB C 17 69.004 69.004 69.307 -0.303 18400
1697 1 8 . 1 1 17 17 THR H H 17 8.758 8.758 8.406 0.352 18400
1698 1 8 . 1 1 18 18 LYS N N 18 129.000 129.000 126.397 2.603 18400
1699 1 8 . 1 1 18 18 LYS HA H 18 4.581 4.581 4.703 -0.122 18400
1700 1 8 . 1 1 18 18 LYS C C 18 174.995 174.995 175.238 -0.243 18400
1701 1 8 . 1 1 18 18 LYS CB C 18 36.219 36.219 36.589 -0.370 18400
1702 1 8 . 1 1 18 18 LYS H H 18 8.848 8.848 8.348 0.500 18400
1703 1 8 . 1 1 19 19 THR N N 19 107.308 107.308 113.451 -6.143 18400
1704 1 8 . 1 1 19 19 THR HA H 19 5.662 5.662 4.617 1.045 18400
1705 1 8 . 1 1 19 19 THR C C 19 175.135 175.135 173.832 1.303 18400
1706 1 8 . 1 1 19 19 THR CA C 19 59.541 59.541 62.440 -2.899 18400
1707 1 8 . 1 1 19 19 THR CB C 19 72.571 72.571 69.279 3.292 18400
1708 1 8 . 1 1 19 19 THR H H 19 8.023 8.023 8.366 -0.343 18400
1709 1 8 . 1 1 20 20 TRP N N 20 120.113 120.113 127.036 -6.923 18400
1710 1 8 . 1 1 20 20 TRP HA H 20 5.793 5.793 4.556 1.238 18400
1711 1 8 . 1 1 20 20 TRP CA C 20 55.233 55.233 56.754 -1.520 18400
1712 1 8 . 1 1 20 20 TRP CB C 20 33.193 33.193 30.865 2.328 18400
1713 1 8 . 1 1 20 20 TRP H H 20 9.317 9.317 8.065 1.252 18400
1714 1 8 . 1 1 21 21 THR HA H 21 4.280 4.280 4.222 0.058 18400
1715 1 8 . 1 1 21 21 THR CA C 21 62.844 62.844 61.183 1.661 18400
1716 1 8 . 1 1 21 21 THR CB C 21 70.918 70.918 69.707 1.211 18400
1717 1 8 . 1 1 21 21 THR H H 21 8.449 8.449 7.528 0.921 18400
1718 1 8 . 1 1 22 22 GLY C C 22 172.841 172.841 173.575 -0.734 18400
1719 1 8 . 1 1 22 22 GLY CA C 22 44.229 44.229 44.653 -0.424 18400
1720 1 8 . 1 1 22 22 GLY H H 22 7.928 7.928 7.423 0.505 18400
1721 1 8 . 1 1 23 23 GLN N N 23 117.973 117.973 121.489 -3.516 18400
1722 1 8 . 1 1 23 23 GLN HA H 23 4.533 4.533 4.153 0.380 18400
1723 1 8 . 1 1 23 23 GLN C C 23 176.979 176.979 176.839 0.140 18400
1724 1 8 . 1 1 23 23 GLN CA C 23 54.099 54.099 54.569 -0.470 18400
1725 1 8 . 1 1 23 23 GLN CB C 23 30.565 30.565 26.834 3.731 18400
1726 1 8 . 1 1 23 23 GLN H H 23 7.141 7.141 7.435 -0.294 18400
1727 1 8 . 1 1 24 24 GLY N N 24 111.998 111.998 110.648 1.350 18400
1728 1 8 . 1 1 24 24 GLY C C 24 174.510 174.510 174.637 -0.127 18400
1729 1 8 . 1 1 24 24 GLY CA C 24 44.906 44.906 45.809 -0.903 18400
1730 1 8 . 1 1 24 24 GLY H H 24 8.841 8.841 8.428 0.413 18400
1731 1 8 . 1 1 25 25 ARG N N 25 121.958 121.958 124.346 -2.388 18400
1732 1 8 . 1 1 25 25 ARG HA H 25 4.179 4.179 4.244 -0.065 18400
1733 1 8 . 1 1 25 25 ARG C C 25 177.025 177.025 175.401 1.624 18400
1734 1 8 . 1 1 25 25 ARG CA C 25 56.285 56.285 57.030 -0.745 18400
1735 1 8 . 1 1 25 25 ARG CB C 25 29.885 29.885 30.559 -0.674 18400
1736 1 8 . 1 1 25 25 ARG H H 25 8.444 8.444 8.367 0.077 18400
1737 1 8 . 1 1 26 26 THR N N 26 122.468 122.468 118.986 3.482 18400
1738 1 8 . 1 1 26 26 THR HA H 26 3.226 3.226 4.746 -1.520 18400
1739 1 8 . 1 1 26 26 THR CA C 26 60.422 60.422 59.045 1.377 18400
1740 1 8 . 1 1 26 26 THR CB C 26 69.088 69.088 68.737 0.351 18400
1741 1 8 . 1 1 26 26 THR H H 26 8.369 8.369 8.443 -0.074 18400
1742 1 8 . 1 1 27 27 PRO HA H 27 3.867 3.867 4.206 -0.339 18400
1743 1 8 . 1 1 27 27 PRO C C 27 177.571 177.571 178.300 -0.729 18400
1744 1 8 . 1 1 27 27 PRO CA C 27 62.174 62.174 62.858 -0.684 18400
1745 1 8 . 1 1 27 27 PRO CB C 27 32.818 32.818 32.031 0.788 18400
1746 1 8 . 1 1 28 28 LYS N N 28 126.298 126.298 121.739 4.559 18400
1747 1 8 . 1 1 28 28 LYS HA H 28 3.925 3.925 3.976 -0.051 18400
1748 1 8 . 1 1 28 28 LYS CA C 28 60.815 60.815 61.617 -0.803 18400
1749 1 8 . 1 1 28 28 LYS H H 28 8.903 8.903 8.834 0.069 18400
1750 1 8 . 1 1 29 29 PRO HA H 29 4.289 4.289 4.243 0.046 18400
1751 1 8 . 1 1 29 29 PRO C C 29 180.695 180.695 178.849 1.846 18400
1752 1 8 . 1 1 29 29 PRO CA C 29 65.875 65.875 65.492 0.383 18400
1753 1 8 . 1 1 29 29 PRO CB C 29 31.770 31.770 31.037 0.733 18400
1754 1 8 . 1 1 30 30 ILE N N 30 114.387 114.387 118.126 -3.739 18400
1755 1 8 . 1 1 30 30 ILE HA H 30 3.021 3.021 4.008 -0.987 18400
1756 1 8 . 1 1 30 30 ILE C C 30 176.633 176.633 178.119 -1.486 18400
1757 1 8 . 1 1 30 30 ILE CA C 30 63.949 63.949 63.361 0.588 18400
1758 1 8 . 1 1 30 30 ILE CB C 30 36.650 36.650 36.505 0.145 18400
1759 1 8 . 1 1 30 30 ILE H H 30 6.051 6.051 7.947 -1.896 18400
1760 1 8 . 1 1 31 31 ALA N N 31 123.060 123.060 122.540 0.520 18400
1761 1 8 . 1 1 31 31 ALA HA H 31 3.720 3.720 3.978 -0.258 18400
1762 1 8 . 1 1 31 31 ALA C C 31 181.571 181.571 179.587 1.984 18400
1763 1 8 . 1 1 31 31 ALA CA C 31 55.456 55.456 55.822 -0.366 18400
1764 1 8 . 1 1 31 31 ALA CB C 31 17.825 17.825 17.826 -0.001 18400
1765 1 8 . 1 1 31 31 ALA H H 31 7.922 7.922 8.830 -0.908 18400
1766 1 8 . 1 1 32 32 GLN N N 32 117.568 117.568 119.061 -1.493 18400
1767 1 8 . 1 1 32 32 GLN HA H 32 3.934 3.934 4.089 -0.155 18400
1768 1 8 . 1 1 32 32 GLN C C 32 178.025 178.025 178.177 -0.152 18400
1769 1 8 . 1 1 32 32 GLN CA C 32 58.424 58.424 58.834 -0.409 18400
1770 1 8 . 1 1 32 32 GLN CB C 32 28.285 28.285 28.570 -0.285 18400
1771 1 8 . 1 1 32 32 GLN H H 32 8.438 8.438 7.922 0.516 18400
1772 1 8 . 1 1 33 33 ALA N N 33 121.972 121.972 122.700 -0.728 18400
1773 1 8 . 1 1 33 33 ALA HA H 33 4.282 4.282 4.387 -0.105 18400
1774 1 8 . 1 1 33 33 ALA C C 33 181.426 181.426 179.622 1.804 18400
1775 1 8 . 1 1 33 33 ALA CA C 33 55.082 55.082 54.910 0.173 18400
1776 1 8 . 1 1 33 33 ALA CB C 33 18.720 18.720 18.747 -0.027 18400
1777 1 8 . 1 1 33 33 ALA H H 33 7.099 7.099 7.447 -0.348 18400
1778 1 8 . 1 1 34 34 LEU N N 34 119.898 119.898 119.252 0.646 18400
1779 1 8 . 1 1 34 34 LEU HA H 34 4.297 4.297 4.612 -0.315 18400
1780 1 8 . 1 1 34 34 LEU C C 34 182.198 182.198 180.341 1.857 18400
1781 1 8 . 1 1 34 34 LEU CA C 34 57.310 57.310 57.064 0.246 18400
1782 1 8 . 1 1 34 34 LEU CB C 34 40.490 40.490 42.180 -1.690 18400
1783 1 8 . 1 1 34 34 LEU H H 34 8.538 8.538 8.828 -0.290 18400
1784 1 8 . 1 1 35 35 ALA N N 35 122.660 122.660 122.027 0.633 18400
1785 1 8 . 1 1 35 35 ALA HA H 35 4.222 4.222 4.104 0.118 18400
1786 1 8 . 1 1 35 35 ALA C C 35 179.762 179.762 179.050 0.712 18400
1787 1 8 . 1 1 35 35 ALA CA C 35 54.226 54.226 54.598 -0.372 18400
1788 1 8 . 1 1 35 35 ALA CB C 35 17.744 17.744 18.287 -0.543 18400
1789 1 8 . 1 1 35 35 ALA H H 35 7.741 7.741 8.517 -0.776 18400
1790 1 8 . 1 1 36 36 GLU N N 36 116.640 116.640 115.810 0.830 18400
1791 1 8 . 1 1 36 36 GLU HA H 36 4.403 4.403 4.254 0.149 18400
1792 1 8 . 1 1 36 36 GLU C C 36 177.531 177.531 177.095 0.436 18400
1793 1 8 . 1 1 36 36 GLU CA C 36 55.856 55.856 56.872 -1.016 18400
1794 1 8 . 1 1 36 36 GLU CB C 36 29.741 29.741 30.041 -0.300 18400
1795 1 8 . 1 1 36 36 GLU H H 36 7.496 7.496 7.652 -0.156 18400
1796 1 8 . 1 1 37 37 GLY N N 37 106.885 106.885 106.558 0.327 18400
1797 1 8 . 1 1 37 37 GLY C C 37 176.072 176.072 174.589 1.483 18400
1798 1 8 . 1 1 37 37 GLY CA C 37 45.369 45.369 44.840 0.529 18400
1799 1 8 . 1 1 37 37 GLY H H 37 7.802 7.802 8.011 -0.209 18400
1800 1 8 . 1 1 38 38 LYS N N 38 120.419 120.419 121.228 -0.809 18400
1801 1 8 . 1 1 38 38 LYS HA H 38 4.479 4.479 4.558 -0.079 18400
1802 1 8 . 1 1 38 38 LYS C C 38 174.921 174.921 175.562 -0.641 18400
1803 1 8 . 1 1 38 38 LYS CA C 38 55.927 55.927 55.281 0.646 18400
1804 1 8 . 1 1 38 38 LYS CB C 38 31.850 31.850 33.704 -1.854 18400
1805 1 8 . 1 1 38 38 LYS H H 38 7.935 7.935 7.570 0.365 18400
1806 1 8 . 1 1 39 39 SER N N 39 114.172 114.172 114.363 -0.191 18400
1807 1 8 . 1 1 39 39 SER HA H 39 4.812 4.812 4.462 0.350 18400
1808 1 8 . 1 1 39 39 SER C C 39 176.690 176.690 175.903 0.787 18400
1809 1 8 . 1 1 39 39 SER CA C 39 56.473 56.473 57.148 -0.675 18400
1810 1 8 . 1 1 39 39 SER CB C 39 65.933 65.933 64.250 1.683 18400
1811 1 8 . 1 1 39 39 SER H H 39 8.579 8.579 8.451 0.128 18400
1812 1 8 . 1 1 40 40 LEU N N 40 126.212 126.212 123.389 2.823 18400
1813 1 8 . 1 1 40 40 LEU HA H 40 4.201 4.201 4.004 0.197 18400
1814 1 8 . 1 1 40 40 LEU C C 40 179.329 179.329 177.473 1.856 18400
1815 1 8 . 1 1 40 40 LEU CA C 40 58.049 58.049 55.496 2.553 18400
1816 1 8 . 1 1 40 40 LEU CB C 40 41.038 41.038 42.211 -1.173 18400
1817 1 8 . 1 1 40 40 LEU H H 40 9.038 9.038 9.067 -0.029 18400
1818 1 8 . 1 1 41 41 ASP N N 41 115.700 115.700 119.333 -3.633 18400
1819 1 8 . 1 1 41 41 ASP HA H 41 4.580 4.580 4.006 0.574 18400
1820 1 8 . 1 1 41 41 ASP C C 41 179.063 179.063 177.948 1.115 18400
1821 1 8 . 1 1 41 41 ASP CA C 41 56.353 56.353 57.474 -1.121 18400
1822 1 8 . 1 1 41 41 ASP CB C 41 40.217 40.217 40.214 0.003 18400
1823 1 8 . 1 1 41 41 ASP H H 41 8.217 8.217 8.203 0.014 18400
1824 1 8 . 1 1 42 42 ASP N N 42 119.466 119.466 119.101 0.365 18400
1825 1 8 . 1 1 42 42 ASP HA H 42 4.422 4.422 4.421 0.001 18400
1826 1 8 . 1 1 42 42 ASP C C 42 177.484 177.484 176.988 0.496 18400
1827 1 8 . 1 1 42 42 ASP CB C 42 40.234 40.234 40.947 -0.713 18400
1828 1 8 . 1 1 42 42 ASP H H 42 7.959 7.959 7.370 0.589 18400
1829 1 8 . 1 1 43 43 PHE N N 43 117.109 117.109 115.654 1.455 18400
1830 1 8 . 1 1 43 43 PHE HA H 43 4.873 4.873 4.750 0.123 18400
1831 1 8 . 1 1 43 43 PHE C C 43 175.641 175.641 174.632 1.009 18400
1832 1 8 . 1 1 43 43 PHE CA C 43 58.196 58.196 54.855 3.341 18400
1833 1 8 . 1 1 43 43 PHE CB C 43 39.344 39.344 38.503 0.841 18400
1834 1 8 . 1 1 43 43 PHE H H 43 8.320 8.320 7.278 1.042 18400
1835 1 8 . 1 1 44 44 LEU N N 44 122.188 122.188 119.946 2.242 18400
1836 1 8 . 1 1 44 44 LEU HA H 44 4.428 4.428 4.193 0.235 18400
1837 1 8 . 1 1 44 44 LEU C C 44 178.294 178.294 176.883 1.411 18400
1838 1 8 . 1 1 44 44 LEU CA C 44 56.434 56.434 54.734 1.700 18400
1839 1 8 . 1 1 44 44 LEU CB C 44 42.835 42.835 40.887 1.948 18400
1840 1 8 . 1 1 44 44 LEU H H 44 7.387 7.387 7.020 0.367 18400
1841 1 9 . 1 1 2 2 GLN N N 2 122.420 122.420 120.574 1.846 18400
1842 1 9 . 1 1 2 2 GLN HA H 2 4.665 4.665 4.493 0.172 18400
1843 1 9 . 1 1 2 2 GLN CA C 2 53.740 53.740 54.822 -1.082 18400
1844 1 9 . 1 1 2 2 GLN CB C 2 28.509 28.509 30.027 -1.518 18400
1845 1 9 . 1 1 2 2 GLN H H 2 8.573 8.573 7.899 0.674 18400
1846 1 9 . 1 1 3 3 PRO HA H 3 4.464 4.464 4.593 -0.129 18400
1847 1 9 . 1 1 3 3 PRO C C 3 177.173 177.173 175.874 1.299 18400
1848 1 9 . 1 1 3 3 PRO CA C 3 62.946 62.946 62.212 0.734 18400
1849 1 9 . 1 1 3 3 PRO CB C 3 32.109 32.109 32.588 -0.479 18400
1850 1 9 . 1 1 4 4 ARG N N 4 122.684 122.684 120.958 1.726 18400
1851 1 9 . 1 1 4 4 ARG HA H 4 4.578 4.578 4.218 0.360 18400
1852 1 9 . 1 1 4 4 ARG CA C 4 53.646 53.646 55.657 -2.011 18400
1853 1 9 . 1 1 4 4 ARG CB C 4 29.634 29.634 29.560 0.074 18400
1854 1 9 . 1 1 4 4 ARG H H 4 8.438 8.438 8.529 -0.091 18400
1855 1 9 . 1 1 5 5 PRO HA H 5 4.400 4.400 4.510 -0.110 18400
1856 1 9 . 1 1 5 5 PRO C C 5 177.137 177.137 175.958 1.179 18400
1857 1 9 . 1 1 5 5 PRO CA C 5 62.490 62.490 62.263 0.227 18400
1858 1 9 . 1 1 5 5 PRO CB C 5 31.928 31.928 32.728 -0.800 18400
1859 1 9 . 1 1 6 6 ALA N N 6 123.540 123.540 127.397 -3.857 18400
1860 1 9 . 1 1 6 6 ALA HA H 6 3.919 3.919 4.235 -0.316 18400
1861 1 9 . 1 1 6 6 ALA C C 6 176.845 176.845 176.118 0.727 18400
1862 1 9 . 1 1 6 6 ALA CA C 6 53.270 53.270 51.403 1.867 18400
1863 1 9 . 1 1 6 6 ALA CB C 6 19.045 19.045 19.780 -0.735 18400
1864 1 9 . 1 1 6 6 ALA H H 6 8.360 8.360 8.187 0.173 18400
1865 1 9 . 1 1 7 7 LYS N N 7 121.074 121.074 119.486 1.588 18400
1866 1 9 . 1 1 7 7 LYS HA H 7 4.306 4.306 4.290 0.016 18400
1867 1 9 . 1 1 7 7 LYS C C 7 175.113 175.113 174.470 0.643 18400
1868 1 9 . 1 1 7 7 LYS CA C 7 56.621 56.621 55.495 1.127 18400
1869 1 9 . 1 1 7 7 LYS CB C 7 36.158 36.158 32.141 4.017 18400
1870 1 9 . 1 1 7 7 LYS H H 7 7.691 7.691 7.886 -0.195 18400
1871 1 9 . 1 1 8 8 TYR N N 8 117.325 117.325 121.451 -4.126 18400
1872 1 9 . 1 1 8 8 TYR HA H 8 5.660 5.660 4.676 0.984 18400
1873 1 9 . 1 1 8 8 TYR C C 8 175.278 175.278 174.225 1.053 18400
1874 1 9 . 1 1 8 8 TYR CA C 8 56.011 56.011 56.538 -0.527 18400
1875 1 9 . 1 1 8 8 TYR CB C 8 42.531 42.531 42.919 -0.388 18400
1876 1 9 . 1 1 8 8 TYR H H 8 8.349 8.349 8.275 0.074 18400
1877 1 9 . 1 1 9 9 LYS N N 9 120.812 120.812 122.470 -1.658 18400
1878 1 9 . 1 1 9 9 LYS HA H 9 5.647 5.647 4.962 0.685 18400
1879 1 9 . 1 1 9 9 LYS C C 9 174.978 174.978 175.101 -0.123 18400
1880 1 9 . 1 1 9 9 LYS CA C 9 54.767 54.767 55.858 -1.091 18400
1881 1 9 . 1 1 9 9 LYS CB C 9 36.033 36.033 34.645 1.388 18400
1882 1 9 . 1 1 9 9 LYS H H 9 9.648 9.648 8.954 0.694 18400
1883 1 9 . 1 1 10 10 PHE N N 10 118.595 118.595 124.486 -5.891 18400
1884 1 9 . 1 1 10 10 PHE HA H 10 5.220 5.220 4.893 0.327 18400
1885 1 9 . 1 1 10 10 PHE C C 10 172.698 172.698 172.425 0.273 18400
1886 1 9 . 1 1 10 10 PHE CA C 10 55.854 55.854 56.380 -0.526 18400
1887 1 9 . 1 1 10 10 PHE CB C 10 40.607 40.607 41.784 -1.177 18400
1888 1 9 . 1 1 10 10 PHE H H 10 8.890 8.890 8.459 0.431 18400
1889 1 9 . 1 1 11 11 THR N N 11 117.249 117.249 116.036 1.213 18400
1890 1 9 . 1 1 11 11 THR HA H 11 4.745 4.745 4.090 0.655 18400
1891 1 9 . 1 1 11 11 THR C C 11 175.071 175.071 172.510 2.561 18400
1892 1 9 . 1 1 11 11 THR CA C 11 61.667 61.667 60.708 0.959 18400
1893 1 9 . 1 1 11 11 THR CB C 11 69.324 69.324 69.263 0.061 18400
1894 1 9 . 1 1 11 11 THR H H 11 8.904 8.904 7.604 1.300 18400
1895 1 9 . 1 1 12 12 ASP N N 12 127.813 127.813 126.075 1.738 18400
1896 1 9 . 1 1 12 12 ASP HA H 12 4.903 4.903 3.980 0.923 18400
1897 1 9 . 1 1 12 12 ASP C C 12 179.041 179.041 177.628 1.413 18400
1898 1 9 . 1 1 12 12 ASP CA C 12 52.773 52.773 55.630 -2.857 18400
1899 1 9 . 1 1 12 12 ASP CB C 12 38.879 38.879 41.773 -2.894 18400
1900 1 9 . 1 1 12 12 ASP H H 12 8.993 8.993 8.288 0.705 18400
1901 1 9 . 1 1 13 13 VAL N N 13 117.388 117.388 118.767 -1.379 18400
1902 1 9 . 1 1 13 13 VAL HA H 13 3.990 3.990 3.789 0.201 18400
1903 1 9 . 1 1 13 13 VAL C C 13 176.796 176.796 176.200 0.596 18400
1904 1 9 . 1 1 13 13 VAL CA C 13 64.349 64.349 64.476 -0.127 18400
1905 1 9 . 1 1 13 13 VAL CB C 13 31.652 31.652 32.184 -0.532 18400
1906 1 9 . 1 1 13 13 VAL H H 13 8.950 8.950 8.584 0.366 18400
1907 1 9 . 1 1 14 14 ASN N N 14 117.303 117.303 116.257 1.046 18400
1908 1 9 . 1 1 14 14 ASN HA H 14 4.781 4.781 4.642 0.139 18400
1909 1 9 . 1 1 14 14 ASN C C 14 176.606 176.606 175.483 1.123 18400
1910 1 9 . 1 1 14 14 ASN CB C 14 38.851 38.851 38.885 -0.034 18400
1911 1 9 . 1 1 14 14 ASN H H 14 8.011 8.011 8.109 -0.098 18400
1912 1 9 . 1 1 15 15 GLY N N 15 108.443 108.443 107.742 0.701 18400
1913 1 9 . 1 1 15 15 GLY C C 15 174.799 174.799 173.200 1.599 18400
1914 1 9 . 1 1 15 15 GLY CA C 15 45.246 45.246 44.864 0.382 18400
1915 1 9 . 1 1 15 15 GLY H H 15 8.288 8.288 7.391 0.897 18400
1916 1 9 . 1 1 16 16 GLU N N 16 122.005 122.005 122.433 -0.428 18400
1917 1 9 . 1 1 16 16 GLU HA H 16 4.373 4.373 4.193 0.180 18400
1918 1 9 . 1 1 16 16 GLU C C 16 176.564 176.564 175.777 0.787 18400
1919 1 9 . 1 1 16 16 GLU CA C 16 55.798 55.798 56.394 -0.596 18400
1920 1 9 . 1 1 16 16 GLU CB C 16 30.932 30.932 29.482 1.450 18400
1921 1 9 . 1 1 16 16 GLU H H 16 8.045 8.045 8.317 -0.272 18400
1922 1 9 . 1 1 17 17 THR N N 17 120.458 120.458 122.942 -2.484 18400
1923 1 9 . 1 1 17 17 THR HA H 17 4.583 4.583 4.797 -0.214 18400
1924 1 9 . 1 1 17 17 THR C C 17 174.583 174.583 174.036 0.547 18400
1925 1 9 . 1 1 17 17 THR CA C 17 63.471 63.471 63.431 0.040 18400
1926 1 9 . 1 1 17 17 THR CB C 17 69.004 69.004 69.045 -0.041 18400
1927 1 9 . 1 1 17 17 THR H H 17 8.758 8.758 8.349 0.409 18400
1928 1 9 . 1 1 18 18 LYS N N 18 129.000 129.000 125.127 3.873 18400
1929 1 9 . 1 1 18 18 LYS HA H 18 4.581 4.581 4.730 -0.149 18400
1930 1 9 . 1 1 18 18 LYS C C 18 174.995 174.995 175.159 -0.164 18400
1931 1 9 . 1 1 18 18 LYS CB C 18 36.219 36.219 35.883 0.336 18400
1932 1 9 . 1 1 18 18 LYS H H 18 8.848 8.848 8.228 0.620 18400
1933 1 9 . 1 1 19 19 THR N N 19 107.308 107.308 113.475 -6.167 18400
1934 1 9 . 1 1 19 19 THR HA H 19 5.662 5.662 4.894 0.768 18400
1935 1 9 . 1 1 19 19 THR C C 19 175.135 175.135 174.131 1.004 18400
1936 1 9 . 1 1 19 19 THR CA C 19 59.541 59.541 62.463 -2.922 18400
1937 1 9 . 1 1 19 19 THR CB C 19 72.571 72.571 69.070 3.501 18400
1938 1 9 . 1 1 19 19 THR H H 19 8.023 8.023 8.341 -0.318 18400
1939 1 9 . 1 1 20 20 TRP N N 20 120.113 120.113 127.525 -7.412 18400
1940 1 9 . 1 1 20 20 TRP HA H 20 5.793 5.793 4.550 1.243 18400
1941 1 9 . 1 1 20 20 TRP CA C 20 55.233 55.233 57.110 -1.877 18400
1942 1 9 . 1 1 20 20 TRP CB C 20 33.193 33.193 31.162 2.031 18400
1943 1 9 . 1 1 20 20 TRP H H 20 9.317 9.317 8.304 1.013 18400
1944 1 9 . 1 1 21 21 THR HA H 21 4.280 4.280 4.399 -0.119 18400
1945 1 9 . 1 1 21 21 THR CA C 21 62.844 62.844 61.910 0.934 18400
1946 1 9 . 1 1 21 21 THR CB C 21 70.918 70.918 70.493 0.425 18400
1947 1 9 . 1 1 21 21 THR H H 21 8.449 8.449 7.733 0.716 18400
1948 1 9 . 1 1 22 22 GLY C C 22 172.841 172.841 171.726 1.115 18400
1949 1 9 . 1 1 22 22 GLY CA C 22 44.229 44.229 44.488 -0.259 18400
1950 1 9 . 1 1 22 22 GLY H H 22 7.928 7.928 7.381 0.547 18400
1951 1 9 . 1 1 23 23 GLN N N 23 117.973 117.973 122.072 -4.099 18400
1952 1 9 . 1 1 23 23 GLN HA H 23 4.533 4.533 4.470 0.063 18400
1953 1 9 . 1 1 23 23 GLN C C 23 176.979 176.979 175.717 1.262 18400
1954 1 9 . 1 1 23 23 GLN CA C 23 54.099 54.099 54.918 -0.819 18400
1955 1 9 . 1 1 23 23 GLN CB C 23 30.565 30.565 30.677 -0.112 18400
1956 1 9 . 1 1 23 23 GLN H H 23 7.141 7.141 7.065 0.076 18400
1957 1 9 . 1 1 24 24 GLY N N 24 111.998 111.998 108.806 3.192 18400
1958 1 9 . 1 1 24 24 GLY C C 24 174.510 174.510 174.131 0.379 18400
1959 1 9 . 1 1 24 24 GLY CA C 24 44.906 44.906 45.331 -0.425 18400
1960 1 9 . 1 1 24 24 GLY H H 24 8.841 8.841 8.779 0.062 18400
1961 1 9 . 1 1 25 25 ARG N N 25 121.958 121.958 123.160 -1.202 18400
1962 1 9 . 1 1 25 25 ARG HA H 25 4.179 4.179 4.316 -0.137 18400
1963 1 9 . 1 1 25 25 ARG C C 25 177.025 177.025 175.387 1.638 18400
1964 1 9 . 1 1 25 25 ARG CA C 25 56.285 56.285 56.606 -0.321 18400
1965 1 9 . 1 1 25 25 ARG CB C 25 29.885 29.885 30.347 -0.462 18400
1966 1 9 . 1 1 25 25 ARG H H 25 8.444 8.444 8.180 0.264 18400
1967 1 9 . 1 1 26 26 THR N N 26 122.468 122.468 119.980 2.488 18400
1968 1 9 . 1 1 26 26 THR HA H 26 3.226 3.226 4.822 -1.596 18400
1969 1 9 . 1 1 26 26 THR CA C 26 60.422 60.422 59.319 1.103 18400
1970 1 9 . 1 1 26 26 THR CB C 26 69.088 69.088 69.045 0.043 18400
1971 1 9 . 1 1 26 26 THR H H 26 8.369 8.369 8.388 -0.019 18400
1972 1 9 . 1 1 27 27 PRO HA H 27 3.867 3.867 4.187 -0.320 18400
1973 1 9 . 1 1 27 27 PRO C C 27 177.571 177.571 178.172 -0.601 18400
1974 1 9 . 1 1 27 27 PRO CA C 27 62.174 62.174 62.953 -0.779 18400
1975 1 9 . 1 1 27 27 PRO CB C 27 32.818 32.818 32.001 0.817 18400
1976 1 9 . 1 1 28 28 LYS N N 28 126.298 126.298 122.735 3.563 18400
1977 1 9 . 1 1 28 28 LYS HA H 28 3.925 3.925 4.006 -0.081 18400
1978 1 9 . 1 1 28 28 LYS CA C 28 60.815 60.815 61.666 -0.851 18400
1979 1 9 . 1 1 28 28 LYS H H 28 8.903 8.903 8.887 0.016 18400
1980 1 9 . 1 1 29 29 PRO HA H 29 4.289 4.289 4.230 0.059 18400
1981 1 9 . 1 1 29 29 PRO C C 29 180.695 180.695 178.880 1.815 18400
1982 1 9 . 1 1 29 29 PRO CA C 29 65.875 65.875 65.526 0.349 18400
1983 1 9 . 1 1 29 29 PRO CB C 29 31.770 31.770 31.088 0.682 18400
1984 1 9 . 1 1 30 30 ILE N N 30 114.387 114.387 117.098 -2.711 18400
1985 1 9 . 1 1 30 30 ILE HA H 30 3.021 3.021 3.980 -0.959 18400
1986 1 9 . 1 1 30 30 ILE C C 30 176.633 176.633 177.997 -1.364 18400
1987 1 9 . 1 1 30 30 ILE CA C 30 63.949 63.949 63.521 0.428 18400
1988 1 9 . 1 1 30 30 ILE CB C 30 36.650 36.650 36.730 -0.080 18400
1989 1 9 . 1 1 30 30 ILE H H 30 6.051 6.051 7.897 -1.846 18400
1990 1 9 . 1 1 31 31 ALA N N 31 123.060 123.060 123.006 0.054 18400
1991 1 9 . 1 1 31 31 ALA HA H 31 3.720 3.720 3.982 -0.262 18400
1992 1 9 . 1 1 31 31 ALA C C 31 181.571 181.571 179.719 1.852 18400
1993 1 9 . 1 1 31 31 ALA CA C 31 55.456 55.456 55.740 -0.284 18400
1994 1 9 . 1 1 31 31 ALA CB C 31 17.825 17.825 17.873 -0.048 18400
1995 1 9 . 1 1 31 31 ALA H H 31 7.922 7.922 8.837 -0.915 18400
1996 1 9 . 1 1 32 32 GLN N N 32 117.568 117.568 119.109 -1.541 18400
1997 1 9 . 1 1 32 32 GLN HA H 32 3.934 3.934 4.077 -0.143 18400
1998 1 9 . 1 1 32 32 GLN C C 32 178.025 178.025 178.218 -0.193 18400
1999 1 9 . 1 1 32 32 GLN CA C 32 58.424 58.424 58.913 -0.489 18400
2000 1 9 . 1 1 32 32 GLN CB C 32 28.285 28.285 28.656 -0.371 18400
2001 1 9 . 1 1 32 32 GLN H H 32 8.438 8.438 7.825 0.613 18400
2002 1 9 . 1 1 33 33 ALA N N 33 121.972 121.972 122.826 -0.854 18400
2003 1 9 . 1 1 33 33 ALA HA H 33 4.282 4.282 4.167 0.115 18400
2004 1 9 . 1 1 33 33 ALA C C 33 181.426 181.426 179.807 1.619 18400
2005 1 9 . 1 1 33 33 ALA CA C 33 55.082 55.082 55.003 0.079 18400
2006 1 9 . 1 1 33 33 ALA CB C 33 18.720 18.720 18.549 0.171 18400
2007 1 9 . 1 1 33 33 ALA H H 33 7.099 7.099 7.523 -0.424 18400
2008 1 9 . 1 1 34 34 LEU N N 34 119.898 119.898 119.284 0.614 18400
2009 1 9 . 1 1 34 34 LEU HA H 34 4.297 4.297 4.656 -0.359 18400
2010 1 9 . 1 1 34 34 LEU C C 34 182.198 182.198 180.182 2.016 18400
2011 1 9 . 1 1 34 34 LEU CA C 34 57.310 57.310 56.971 0.340 18400
2012 1 9 . 1 1 34 34 LEU CB C 34 40.490 40.490 42.279 -1.789 18400
2013 1 9 . 1 1 34 34 LEU H H 34 8.538 8.538 8.832 -0.294 18400
2014 1 9 . 1 1 35 35 ALA N N 35 122.660 122.660 121.649 1.011 18400
2015 1 9 . 1 1 35 35 ALA HA H 35 4.222 4.222 4.107 0.115 18400
2016 1 9 . 1 1 35 35 ALA C C 35 179.762 179.762 179.030 0.732 18400
2017 1 9 . 1 1 35 35 ALA CA C 35 54.226 54.226 54.586 -0.360 18400
2018 1 9 . 1 1 35 35 ALA CB C 35 17.744 17.744 18.190 -0.446 18400
2019 1 9 . 1 1 35 35 ALA H H 35 7.741 7.741 8.449 -0.708 18400
2020 1 9 . 1 1 36 36 GLU N N 36 116.640 116.640 115.849 0.791 18400
2021 1 9 . 1 1 36 36 GLU HA H 36 4.403 4.403 4.265 0.138 18400
2022 1 9 . 1 1 36 36 GLU C C 36 177.531 177.531 177.439 0.092 18400
2023 1 9 . 1 1 36 36 GLU CA C 36 55.856 55.856 56.918 -1.062 18400
2024 1 9 . 1 1 36 36 GLU CB C 36 29.741 29.741 30.100 -0.359 18400
2025 1 9 . 1 1 36 36 GLU H H 36 7.496 7.496 7.669 -0.173 18400
2026 1 9 . 1 1 37 37 GLY N N 37 106.885 106.885 107.451 -0.566 18400
2027 1 9 . 1 1 37 37 GLY C C 37 176.072 176.072 174.344 1.728 18400
2028 1 9 . 1 1 37 37 GLY CA C 37 45.369 45.369 44.903 0.466 18400
2029 1 9 . 1 1 37 37 GLY H H 37 7.802 7.802 8.059 -0.257 18400
2030 1 9 . 1 1 38 38 LYS N N 38 120.419 120.419 121.015 -0.596 18400
2031 1 9 . 1 1 38 38 LYS HA H 38 4.479 4.479 4.531 -0.052 18400
2032 1 9 . 1 1 38 38 LYS C C 38 174.921 174.921 175.835 -0.914 18400
2033 1 9 . 1 1 38 38 LYS CA C 38 55.927 55.927 55.209 0.717 18400
2034 1 9 . 1 1 38 38 LYS CB C 38 31.850 31.850 33.447 -1.597 18400
2035 1 9 . 1 1 38 38 LYS H H 38 7.935 7.935 7.537 0.398 18400
2036 1 9 . 1 1 39 39 SER N N 39 114.172 114.172 115.468 -1.296 18400
2037 1 9 . 1 1 39 39 SER HA H 39 4.812 4.812 4.475 0.337 18400
2038 1 9 . 1 1 39 39 SER C C 39 176.690 176.690 175.901 0.789 18400
2039 1 9 . 1 1 39 39 SER CA C 39 56.473 56.473 57.358 -0.885 18400
2040 1 9 . 1 1 39 39 SER CB C 39 65.933 65.933 64.248 1.685 18400
2041 1 9 . 1 1 39 39 SER H H 39 8.579 8.579 8.519 0.060 18400
2042 1 9 . 1 1 40 40 LEU N N 40 126.212 126.212 122.427 3.785 18400
2043 1 9 . 1 1 40 40 LEU HA H 40 4.201 4.201 4.098 0.103 18400
2044 1 9 . 1 1 40 40 LEU C C 40 179.329 179.329 178.204 1.125 18400
2045 1 9 . 1 1 40 40 LEU CA C 40 58.049 58.049 56.042 2.007 18400
2046 1 9 . 1 1 40 40 LEU CB C 40 41.038 41.038 41.109 -0.071 18400
2047 1 9 . 1 1 40 40 LEU H H 40 9.038 9.038 9.005 0.033 18400
2048 1 9 . 1 1 41 41 ASP N N 41 115.700 115.700 119.280 -3.580 18400
2049 1 9 . 1 1 41 41 ASP HA H 41 4.580 4.580 4.027 0.553 18400
2050 1 9 . 1 1 41 41 ASP C C 41 179.063 179.063 178.267 0.796 18400
2051 1 9 . 1 1 41 41 ASP CA C 41 56.353 56.353 57.001 -0.648 18400
2052 1 9 . 1 1 41 41 ASP CB C 41 40.217 40.217 39.959 0.258 18400
2053 1 9 . 1 1 41 41 ASP H H 41 8.217 8.217 8.263 -0.046 18400
2054 1 9 . 1 1 42 42 ASP N N 42 119.466 119.466 119.990 -0.524 18400
2055 1 9 . 1 1 42 42 ASP HA H 42 4.422 4.422 4.393 0.029 18400
2056 1 9 . 1 1 42 42 ASP C C 42 177.484 177.484 177.145 0.339 18400
2057 1 9 . 1 1 42 42 ASP CB C 42 40.234 40.234 40.732 -0.498 18400
2058 1 9 . 1 1 42 42 ASP H H 42 7.959 7.959 7.514 0.445 18400
2059 1 9 . 1 1 43 43 PHE N N 43 117.109 117.109 116.160 0.949 18400
2060 1 9 . 1 1 43 43 PHE HA H 43 4.873 4.873 4.719 0.154 18400
2061 1 9 . 1 1 43 43 PHE C C 43 175.641 175.641 174.740 0.901 18400
2062 1 9 . 1 1 43 43 PHE CA C 43 58.196 58.196 55.260 2.936 18400
2063 1 9 . 1 1 43 43 PHE CB C 43 39.344 39.344 38.331 1.012 18400
2064 1 9 . 1 1 43 43 PHE H H 43 8.320 8.320 7.531 0.789 18400
2065 1 9 . 1 1 44 44 LEU N N 44 122.188 122.188 118.894 3.294 18400
2066 1 9 . 1 1 44 44 LEU HA H 44 4.428 4.428 4.263 0.165 18400
2067 1 9 . 1 1 44 44 LEU C C 44 178.294 178.294 177.277 1.017 18400
2068 1 9 . 1 1 44 44 LEU CA C 44 56.434 56.434 55.223 1.211 18400
2069 1 9 . 1 1 44 44 LEU CB C 44 42.835 42.835 41.697 1.138 18400
2070 1 9 . 1 1 44 44 LEU H H 44 7.387 7.387 7.082 0.305 18400
2071 1 10 . 1 1 2 2 GLN N N 2 122.420 122.420 123.026 -0.606 18400
2072 1 10 . 1 1 2 2 GLN HA H 2 4.665 4.665 4.796 -0.131 18400
2073 1 10 . 1 1 2 2 GLN CA C 2 53.740 53.740 54.085 -0.345 18400
2074 1 10 . 1 1 2 2 GLN CB C 2 28.509 28.509 29.273 -0.764 18400
2075 1 10 . 1 1 2 2 GLN H H 2 8.573 8.573 8.077 0.496 18400
2076 1 10 . 1 1 3 3 PRO HA H 3 4.464 4.464 4.441 0.023 18400
2077 1 10 . 1 1 3 3 PRO C C 3 177.173 177.173 176.220 0.953 18400
2078 1 10 . 1 1 3 3 PRO CA C 3 62.946 62.946 62.215 0.731 18400
2079 1 10 . 1 1 3 3 PRO CB C 3 32.109 32.109 32.526 -0.417 18400
2080 1 10 . 1 1 4 4 ARG N N 4 122.684 122.684 120.773 1.911 18400
2081 1 10 . 1 1 4 4 ARG HA H 4 4.578 4.578 4.249 0.329 18400
2082 1 10 . 1 1 4 4 ARG CA C 4 53.646 53.646 55.462 -1.816 18400
2083 1 10 . 1 1 4 4 ARG CB C 4 29.634 29.634 29.191 0.443 18400
2084 1 10 . 1 1 4 4 ARG H H 4 8.438 8.438 8.502 -0.064 18400
2085 1 10 . 1 1 5 5 PRO HA H 5 4.400 4.400 4.546 -0.146 18400
2086 1 10 . 1 1 5 5 PRO C C 5 177.137 177.137 175.525 1.612 18400
2087 1 10 . 1 1 5 5 PRO CA C 5 62.490 62.490 62.583 -0.093 18400
2088 1 10 . 1 1 5 5 PRO CB C 5 31.928 31.928 32.783 -0.855 18400
2089 1 10 . 1 1 6 6 ALA N N 6 123.540 123.540 126.552 -3.012 18400
2090 1 10 . 1 1 6 6 ALA HA H 6 3.919 3.919 4.412 -0.493 18400
2091 1 10 . 1 1 6 6 ALA C C 6 176.845 176.845 175.798 1.047 18400
2092 1 10 . 1 1 6 6 ALA CA C 6 53.270 53.270 51.100 2.170 18400
2093 1 10 . 1 1 6 6 ALA CB C 6 19.045 19.045 19.910 -0.865 18400
2094 1 10 . 1 1 6 6 ALA H H 6 8.360 8.360 8.182 0.178 18400
2095 1 10 . 1 1 7 7 LYS N N 7 121.074 121.074 120.036 1.038 18400
2096 1 10 . 1 1 7 7 LYS HA H 7 4.306 4.306 4.499 -0.193 18400
2097 1 10 . 1 1 7 7 LYS C C 7 175.113 175.113 174.348 0.765 18400
2098 1 10 . 1 1 7 7 LYS CA C 7 56.621 56.621 55.771 0.850 18400
2099 1 10 . 1 1 7 7 LYS CB C 7 36.158 36.158 32.868 3.290 18400
2100 1 10 . 1 1 7 7 LYS H H 7 7.691 7.691 7.855 -0.164 18400
2101 1 10 . 1 1 8 8 TYR N N 8 117.325 117.325 121.228 -3.903 18400
2102 1 10 . 1 1 8 8 TYR HA H 8 5.660 5.660 4.632 1.028 18400
2103 1 10 . 1 1 8 8 TYR C C 8 175.278 175.278 174.268 1.010 18400
2104 1 10 . 1 1 8 8 TYR CA C 8 56.011 56.011 56.578 -0.567 18400
2105 1 10 . 1 1 8 8 TYR CB C 8 42.531 42.531 42.501 0.030 18400
2106 1 10 . 1 1 8 8 TYR H H 8 8.349 8.349 8.314 0.035 18400
2107 1 10 . 1 1 9 9 LYS N N 9 120.812 120.812 121.760 -0.948 18400
2108 1 10 . 1 1 9 9 LYS HA H 9 5.647 5.647 5.041 0.606 18400
2109 1 10 . 1 1 9 9 LYS C C 9 174.978 174.978 175.413 -0.435 18400
2110 1 10 . 1 1 9 9 LYS CA C 9 54.767 54.767 55.151 -0.384 18400
2111 1 10 . 1 1 9 9 LYS CB C 9 36.033 36.033 34.215 1.818 18400
2112 1 10 . 1 1 9 9 LYS H H 9 9.648 9.648 8.876 0.772 18400
2113 1 10 . 1 1 10 10 PHE N N 10 118.595 118.595 123.986 -5.391 18400
2114 1 10 . 1 1 10 10 PHE HA H 10 5.220 5.220 4.819 0.401 18400
2115 1 10 . 1 1 10 10 PHE C C 10 172.698 172.698 172.610 0.088 18400
2116 1 10 . 1 1 10 10 PHE CA C 10 55.854 55.854 56.381 -0.527 18400
2117 1 10 . 1 1 10 10 PHE CB C 10 40.607 40.607 41.704 -1.097 18400
2118 1 10 . 1 1 10 10 PHE H H 10 8.890 8.890 8.911 -0.021 18400
2119 1 10 . 1 1 11 11 THR N N 11 117.249 117.249 111.836 5.413 18400
2120 1 10 . 1 1 11 11 THR HA H 11 4.745 4.745 4.228 0.517 18400
2121 1 10 . 1 1 11 11 THR C C 11 175.071 175.071 172.902 2.169 18400
2122 1 10 . 1 1 11 11 THR CA C 11 61.667 61.667 59.998 1.669 18400
2123 1 10 . 1 1 11 11 THR CB C 11 69.324 69.324 70.193 -0.869 18400
2124 1 10 . 1 1 11 11 THR H H 11 8.904 8.904 7.435 1.469 18400
2125 1 10 . 1 1 12 12 ASP N N 12 127.813 127.813 125.796 2.017 18400
2126 1 10 . 1 1 12 12 ASP HA H 12 4.903 4.903 3.997 0.906 18400
2127 1 10 . 1 1 12 12 ASP C C 12 179.041 179.041 177.243 1.798 18400
2128 1 10 . 1 1 12 12 ASP CA C 12 52.773 52.773 55.360 -2.587 18400
2129 1 10 . 1 1 12 12 ASP CB C 12 38.879 38.879 41.000 -2.121 18400
2130 1 10 . 1 1 12 12 ASP H H 12 8.993 8.993 7.962 1.031 18400
2131 1 10 . 1 1 13 13 VAL N N 13 117.388 117.388 118.964 -1.576 18400
2132 1 10 . 1 1 13 13 VAL HA H 13 3.990 3.990 3.745 0.245 18400
2133 1 10 . 1 1 13 13 VAL C C 13 176.796 176.796 175.923 0.873 18400
2134 1 10 . 1 1 13 13 VAL CA C 13 64.349 64.349 64.342 0.007 18400
2135 1 10 . 1 1 13 13 VAL CB C 13 31.652 31.652 31.242 0.410 18400
2136 1 10 . 1 1 13 13 VAL H H 13 8.950 8.950 8.603 0.347 18400
2137 1 10 . 1 1 14 14 ASN N N 14 117.303 117.303 116.776 0.527 18400
2138 1 10 . 1 1 14 14 ASN HA H 14 4.781 4.781 4.640 0.141 18400
2139 1 10 . 1 1 14 14 ASN C C 14 176.606 176.606 175.545 1.061 18400
2140 1 10 . 1 1 14 14 ASN CB C 14 38.851 38.851 39.550 -0.699 18400
2141 1 10 . 1 1 14 14 ASN H H 14 8.011 8.011 8.110 -0.099 18400
2142 1 10 . 1 1 15 15 GLY N N 15 108.443 108.443 107.854 0.589 18400
2143 1 10 . 1 1 15 15 GLY C C 15 174.799 174.799 173.872 0.927 18400
2144 1 10 . 1 1 15 15 GLY CA C 15 45.246 45.246 44.930 0.316 18400
2145 1 10 . 1 1 15 15 GLY H H 15 8.288 8.288 7.410 0.878 18400
2146 1 10 . 1 1 16 16 GLU N N 16 122.005 122.005 119.898 2.107 18400
2147 1 10 . 1 1 16 16 GLU HA H 16 4.373 4.373 4.346 0.027 18400
2148 1 10 . 1 1 16 16 GLU C C 16 176.564 176.564 175.649 0.915 18400
2149 1 10 . 1 1 16 16 GLU CA C 16 55.798 55.798 56.509 -0.711 18400
2150 1 10 . 1 1 16 16 GLU CB C 16 30.932 30.932 30.072 0.860 18400
2151 1 10 . 1 1 16 16 GLU H H 16 8.045 8.045 8.267 -0.222 18400
2152 1 10 . 1 1 17 17 THR N N 17 120.458 120.458 111.837 8.621 18400
2153 1 10 . 1 1 17 17 THR HA H 17 4.583 4.583 5.245 -0.662 18400
2154 1 10 . 1 1 17 17 THR C C 17 174.583 174.583 173.713 0.870 18400
2155 1 10 . 1 1 17 17 THR CA C 17 63.471 63.471 61.410 2.061 18400
2156 1 10 . 1 1 17 17 THR CB C 17 69.004 69.004 69.228 -0.224 18400
2157 1 10 . 1 1 17 17 THR H H 17 8.758 8.758 8.223 0.535 18400
2158 1 10 . 1 1 18 18 LYS N N 18 129.000 129.000 123.424 5.576 18400
2159 1 10 . 1 1 18 18 LYS HA H 18 4.581 4.581 4.794 -0.213 18400
2160 1 10 . 1 1 18 18 LYS C C 18 174.995 174.995 174.540 0.455 18400
2161 1 10 . 1 1 18 18 LYS CB C 18 36.219 36.219 36.286 -0.067 18400
2162 1 10 . 1 1 18 18 LYS H H 18 8.848 8.848 8.124 0.724 18400
2163 1 10 . 1 1 19 19 THR N N 19 107.308 107.308 112.945 -5.637 18400
2164 1 10 . 1 1 19 19 THR HA H 19 5.662 5.662 4.720 0.942 18400
2165 1 10 . 1 1 19 19 THR C C 19 175.135 175.135 174.004 1.131 18400
2166 1 10 . 1 1 19 19 THR CA C 19 59.541 59.541 61.444 -1.903 18400
2167 1 10 . 1 1 19 19 THR CB C 19 72.571 72.571 69.610 2.961 18400
2168 1 10 . 1 1 19 19 THR H H 19 8.023 8.023 8.406 -0.383 18400
2169 1 10 . 1 1 20 20 TRP N N 20 120.113 120.113 126.989 -6.876 18400
2170 1 10 . 1 1 20 20 TRP HA H 20 5.793 5.793 4.599 1.194 18400
2171 1 10 . 1 1 20 20 TRP CA C 20 55.233 55.233 56.555 -1.322 18400
2172 1 10 . 1 1 20 20 TRP CB C 20 33.193 33.193 30.196 2.997 18400
2173 1 10 . 1 1 20 20 TRP H H 20 9.317 9.317 8.286 1.031 18400
2174 1 10 . 1 1 21 21 THR HA H 21 4.280 4.280 4.274 0.006 18400
2175 1 10 . 1 1 21 21 THR CA C 21 62.844 62.844 61.184 1.660 18400
2176 1 10 . 1 1 21 21 THR CB C 21 70.918 70.918 70.112 0.806 18400
2177 1 10 . 1 1 21 21 THR H H 21 8.449 8.449 7.720 0.729 18400
2178 1 10 . 1 1 22 22 GLY C C 22 172.841 172.841 173.425 -0.584 18400
2179 1 10 . 1 1 22 22 GLY CA C 22 44.229 44.229 44.510 -0.281 18400
2180 1 10 . 1 1 22 22 GLY H H 22 7.928 7.928 7.540 0.388 18400
2181 1 10 . 1 1 23 23 GLN N N 23 117.973 117.973 120.076 -2.103 18400
2182 1 10 . 1 1 23 23 GLN HA H 23 4.533 4.533 4.106 0.427 18400
2183 1 10 . 1 1 23 23 GLN C C 23 176.979 176.979 176.090 0.889 18400
2184 1 10 . 1 1 23 23 GLN CA C 23 54.099 54.099 57.869 -3.770 18400
2185 1 10 . 1 1 23 23 GLN CB C 23 30.565 30.565 29.639 0.926 18400
2186 1 10 . 1 1 23 23 GLN H H 23 7.141 7.141 7.357 -0.216 18400
2187 1 10 . 1 1 24 24 GLY N N 24 111.998 111.998 105.195 6.803 18400
2188 1 10 . 1 1 24 24 GLY C C 24 174.510 174.510 173.594 0.916 18400
2189 1 10 . 1 1 24 24 GLY CA C 24 44.906 44.906 45.237 -0.332 18400
2190 1 10 . 1 1 24 24 GLY H H 24 8.841 8.841 8.711 0.130 18400
2191 1 10 . 1 1 25 25 ARG N N 25 121.958 121.958 122.690 -0.732 18400
2192 1 10 . 1 1 25 25 ARG HA H 25 4.179 4.179 4.547 -0.368 18400
2193 1 10 . 1 1 25 25 ARG C C 25 177.025 177.025 175.294 1.731 18400
2194 1 10 . 1 1 25 25 ARG CA C 25 56.285 56.285 55.836 0.449 18400
2195 1 10 . 1 1 25 25 ARG CB C 25 29.885 29.885 30.957 -1.072 18400
2196 1 10 . 1 1 25 25 ARG H H 25 8.444 8.444 8.234 0.210 18400
2197 1 10 . 1 1 26 26 THR N N 26 122.468 122.468 118.094 4.374 18400
2198 1 10 . 1 1 26 26 THR HA H 26 3.226 3.226 4.720 -1.494 18400
2199 1 10 . 1 1 26 26 THR CA C 26 60.422 60.422 58.440 1.982 18400
2200 1 10 . 1 1 26 26 THR CB C 26 69.088 69.088 68.410 0.678 18400
2201 1 10 . 1 1 26 26 THR H H 26 8.369 8.369 8.453 -0.084 18400
2202 1 10 . 1 1 27 27 PRO HA H 27 3.867 3.867 4.172 -0.305 18400
2203 1 10 . 1 1 27 27 PRO C C 27 177.571 177.571 178.123 -0.552 18400
2204 1 10 . 1 1 27 27 PRO CA C 27 62.174 62.174 62.863 -0.689 18400
2205 1 10 . 1 1 27 27 PRO CB C 27 32.818 32.818 31.865 0.953 18400
2206 1 10 . 1 1 28 28 LYS N N 28 126.298 126.298 122.029 4.269 18400
2207 1 10 . 1 1 28 28 LYS HA H 28 3.925 3.925 3.973 -0.048 18400
2208 1 10 . 1 1 28 28 LYS CA C 28 60.815 60.815 60.743 0.072 18400
2209 1 10 . 1 1 28 28 LYS H H 28 8.903 8.903 8.820 0.083 18400
2210 1 10 . 1 1 29 29 PRO HA H 29 4.289 4.289 4.242 0.047 18400
2211 1 10 . 1 1 29 29 PRO C C 29 180.695 180.695 178.780 1.915 18400
2212 1 10 . 1 1 29 29 PRO CA C 29 65.875 65.875 65.341 0.534 18400
2213 1 10 . 1 1 29 29 PRO CB C 29 31.770 31.770 30.989 0.781 18400
2214 1 10 . 1 1 30 30 ILE N N 30 114.387 114.387 117.437 -3.050 18400
2215 1 10 . 1 1 30 30 ILE HA H 30 3.021 3.021 3.660 -0.639 18400
2216 1 10 . 1 1 30 30 ILE C C 30 176.633 176.633 178.143 -1.510 18400
2217 1 10 . 1 1 30 30 ILE CA C 30 63.949 63.949 63.577 0.372 18400
2218 1 10 . 1 1 30 30 ILE CB C 30 36.650 36.650 36.138 0.512 18400
2219 1 10 . 1 1 30 30 ILE H H 30 6.051 6.051 7.916 -1.865 18400
2220 1 10 . 1 1 31 31 ALA N N 31 123.060 123.060 122.382 0.678 18400
2221 1 10 . 1 1 31 31 ALA HA H 31 3.720 3.720 3.988 -0.268 18400
2222 1 10 . 1 1 31 31 ALA C C 31 181.571 181.571 179.562 2.009 18400
2223 1 10 . 1 1 31 31 ALA CA C 31 55.456 55.456 55.738 -0.282 18400
2224 1 10 . 1 1 31 31 ALA CB C 31 17.825 17.825 17.795 0.030 18400
2225 1 10 . 1 1 31 31 ALA H H 31 7.922 7.922 8.686 -0.764 18400
2226 1 10 . 1 1 32 32 GLN N N 32 117.568 117.568 119.310 -1.742 18400
2227 1 10 . 1 1 32 32 GLN HA H 32 3.934 3.934 4.045 -0.111 18400
2228 1 10 . 1 1 32 32 GLN C C 32 178.025 178.025 177.983 0.042 18400
2229 1 10 . 1 1 32 32 GLN CA C 32 58.424 58.424 58.875 -0.451 18400
2230 1 10 . 1 1 32 32 GLN CB C 32 28.285 28.285 28.531 -0.246 18400
2231 1 10 . 1 1 32 32 GLN H H 32 8.438 8.438 7.829 0.609 18400
2232 1 10 . 1 1 33 33 ALA N N 33 121.972 121.972 122.722 -0.750 18400
2233 1 10 . 1 1 33 33 ALA HA H 33 4.282 4.282 4.191 0.091 18400
2234 1 10 . 1 1 33 33 ALA C C 33 181.426 181.426 180.062 1.364 18400
2235 1 10 . 1 1 33 33 ALA CA C 33 55.082 55.082 55.165 -0.083 18400
2236 1 10 . 1 1 33 33 ALA CB C 33 18.720 18.720 18.613 0.107 18400
2237 1 10 . 1 1 33 33 ALA H H 33 7.099 7.099 7.561 -0.462 18400
2238 1 10 . 1 1 34 34 LEU N N 34 119.898 119.898 118.889 1.009 18400
2239 1 10 . 1 1 34 34 LEU HA H 34 4.297 4.297 4.791 -0.494 18400
2240 1 10 . 1 1 34 34 LEU C C 34 182.198 182.198 180.375 1.823 18400
2241 1 10 . 1 1 34 34 LEU CA C 34 57.310 57.310 57.656 -0.346 18400
2242 1 10 . 1 1 34 34 LEU CB C 34 40.490 40.490 41.523 -1.033 18400
2243 1 10 . 1 1 34 34 LEU H H 34 8.538 8.538 8.790 -0.252 18400
2244 1 10 . 1 1 35 35 ALA N N 35 122.660 122.660 122.517 0.143 18400
2245 1 10 . 1 1 35 35 ALA HA H 35 4.222 4.222 4.130 0.092 18400
2246 1 10 . 1 1 35 35 ALA C C 35 179.762 179.762 179.131 0.631 18400
2247 1 10 . 1 1 35 35 ALA CA C 35 54.226 54.226 54.690 -0.464 18400
2248 1 10 . 1 1 35 35 ALA CB C 35 17.744 17.744 18.298 -0.554 18400
2249 1 10 . 1 1 35 35 ALA H H 35 7.741 7.741 8.350 -0.609 18400
2250 1 10 . 1 1 36 36 GLU N N 36 116.640 116.640 116.537 0.103 18400
2251 1 10 . 1 1 36 36 GLU HA H 36 4.403 4.403 4.254 0.149 18400
2252 1 10 . 1 1 36 36 GLU C C 36 177.531 177.531 177.462 0.069 18400
2253 1 10 . 1 1 36 36 GLU CA C 36 55.856 55.856 56.841 -0.985 18400
2254 1 10 . 1 1 36 36 GLU CB C 36 29.741 29.741 30.037 -0.296 18400
2255 1 10 . 1 1 36 36 GLU H H 36 7.496 7.496 7.744 -0.248 18400
2256 1 10 . 1 1 37 37 GLY N N 37 106.885 106.885 106.426 0.459 18400
2257 1 10 . 1 1 37 37 GLY C C 37 176.072 176.072 174.507 1.565 18400
2258 1 10 . 1 1 37 37 GLY CA C 37 45.369 45.369 44.860 0.509 18400
2259 1 10 . 1 1 37 37 GLY H H 37 7.802 7.802 8.077 -0.275 18400
2260 1 10 . 1 1 38 38 LYS N N 38 120.419 120.419 121.261 -0.842 18400
2261 1 10 . 1 1 38 38 LYS HA H 38 4.479 4.479 4.547 -0.068 18400
2262 1 10 . 1 1 38 38 LYS C C 38 174.921 174.921 175.789 -0.868 18400
2263 1 10 . 1 1 38 38 LYS CA C 38 55.927 55.927 55.392 0.535 18400
2264 1 10 . 1 1 38 38 LYS CB C 38 31.850 31.850 33.870 -2.019 18400
2265 1 10 . 1 1 38 38 LYS H H 38 7.935 7.935 7.540 0.395 18400
2266 1 10 . 1 1 39 39 SER N N 39 114.172 114.172 114.255 -0.083 18400
2267 1 10 . 1 1 39 39 SER HA H 39 4.812 4.812 4.790 0.022 18400
2268 1 10 . 1 1 39 39 SER C C 39 176.690 176.690 175.597 1.093 18400
2269 1 10 . 1 1 39 39 SER CA C 39 56.473 56.473 57.065 -0.592 18400
2270 1 10 . 1 1 39 39 SER CB C 39 65.933 65.933 65.133 0.800 18400
2271 1 10 . 1 1 39 39 SER H H 39 8.579 8.579 8.284 0.295 18400
2272 1 10 . 1 1 40 40 LEU N N 40 126.212 126.212 122.168 4.044 18400
2273 1 10 . 1 1 40 40 LEU HA H 40 4.201 4.201 4.566 -0.365 18400
2274 1 10 . 1 1 40 40 LEU C C 40 179.329 179.329 177.675 1.654 18400
2275 1 10 . 1 1 40 40 LEU CA C 40 58.049 58.049 56.252 1.797 18400
2276 1 10 . 1 1 40 40 LEU CB C 40 41.038 41.038 42.064 -1.026 18400
2277 1 10 . 1 1 40 40 LEU H H 40 9.038 9.038 8.961 0.077 18400
2278 1 10 . 1 1 41 41 ASP N N 41 115.700 115.700 117.641 -1.941 18400
2279 1 10 . 1 1 41 41 ASP HA H 41 4.580 4.580 3.820 0.760 18400
2280 1 10 . 1 1 41 41 ASP C C 41 179.063 179.063 177.529 1.534 18400
2281 1 10 . 1 1 41 41 ASP CA C 41 56.353 56.353 56.358 -0.005 18400
2282 1 10 . 1 1 41 41 ASP CB C 41 40.217 40.217 40.116 0.101 18400
2283 1 10 . 1 1 41 41 ASP H H 41 8.217 8.217 8.119 0.098 18400
2284 1 10 . 1 1 42 42 ASP N N 42 119.466 119.466 119.505 -0.039 18400
2285 1 10 . 1 1 42 42 ASP HA H 42 4.422 4.422 4.283 0.139 18400
2286 1 10 . 1 1 42 42 ASP C C 42 177.484 177.484 176.561 0.923 18400
2287 1 10 . 1 1 42 42 ASP CB C 42 40.234 40.234 41.021 -0.787 18400
2288 1 10 . 1 1 42 42 ASP H H 42 7.959 7.959 7.448 0.511 18400
2289 1 10 . 1 1 43 43 PHE N N 43 117.109 117.109 115.374 1.735 18400
2290 1 10 . 1 1 43 43 PHE HA H 43 4.873 4.873 4.789 0.084 18400
2291 1 10 . 1 1 43 43 PHE C C 43 175.641 175.641 174.428 1.213 18400
2292 1 10 . 1 1 43 43 PHE CA C 43 58.196 58.196 54.911 3.285 18400
2293 1 10 . 1 1 43 43 PHE CB C 43 39.344 39.344 38.397 0.948 18400
2294 1 10 . 1 1 43 43 PHE H H 43 8.320 8.320 6.840 1.480 18400
2295 1 10 . 1 1 44 44 LEU N N 44 122.188 122.188 119.668 2.520 18400
2296 1 10 . 1 1 44 44 LEU HA H 44 4.428 4.428 4.312 0.116 18400
2297 1 10 . 1 1 44 44 LEU C C 44 178.294 178.294 176.962 1.332 18400
2298 1 10 . 1 1 44 44 LEU CA C 44 56.434 56.434 54.970 1.464 18400
2299 1 10 . 1 1 44 44 LEU CB C 44 42.835 42.835 41.021 1.814 18400
2300 1 10 . 1 1 44 44 LEU H H 44 7.387 7.387 7.127 0.260 18400
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 37 3.250 0.000 3.295 18400
2 1 1 "Average Difference" HA 47 0.660 -0.031 0.666 18400
3 1 1 "Average Difference" C 37 1.169 -0.829 0.835 18400
4 1 1 "Average Difference" CA 40 1.374 0.056 1.390 18400
5 1 1 "Average Difference" CB 38 1.209 -0.177 1.212 18400
6 1 1 "Average Difference" HN 39 0.607 -0.171 0.590 18400
7 1 2 "Average Difference" N 37 3.124 -0.015 3.167 18400
8 1 2 "Average Difference" HA 47 0.652 -0.042 0.658 18400
9 1 2 "Average Difference" C 37 1.156 -0.817 0.829 18400
10 1 2 "Average Difference" CA 40 1.272 0.097 1.284 18400
11 1 2 "Average Difference" CB 38 1.164 -0.102 1.175 18400
12 1 2 "Average Difference" HN 39 0.595 -0.169 0.577 18400
13 1 3 "Average Difference" N 37 3.177 0.261 3.210 18400
14 1 3 "Average Difference" HA 47 0.649 -0.028 0.655 18400
15 1 3 "Average Difference" C 37 1.293 -0.933 0.907 18400
16 1 3 "Average Difference" CA 40 1.265 -0.111 1.276 18400
17 1 3 "Average Difference" CB 38 1.345 -0.107 1.358 18400
18 1 3 "Average Difference" HN 39 0.667 -0.220 0.638 18400
19 1 4 "Average Difference" N 37 2.960 0.192 2.994 18400
20 1 4 "Average Difference" HA 47 0.656 -0.036 0.662 18400
21 1 4 "Average Difference" C 37 1.238 -0.868 0.895 18400
22 1 4 "Average Difference" CA 40 1.316 -0.023 1.332 18400
23 1 4 "Average Difference" CB 38 1.328 -0.217 1.328 18400
24 1 4 "Average Difference" HN 39 0.588 -0.148 0.577 18400
25 1 5 "Average Difference" N 37 3.111 0.168 3.149 18400
26 1 5 "Average Difference" HA 47 0.668 -0.042 0.674 18400
27 1 5 "Average Difference" C 37 1.211 -0.855 0.869 18400
28 1 5 "Average Difference" CA 40 1.331 0.056 1.347 18400
29 1 5 "Average Difference" CB 38 1.403 -0.083 1.419 18400
30 1 5 "Average Difference" HN 39 0.625 -0.182 0.606 18400
31 1 6 "Average Difference" N 37 3.061 0.329 3.085 18400
32 1 6 "Average Difference" HA 47 0.669 -0.096 0.669 18400
33 1 6 "Average Difference" C 37 1.218 -0.789 0.940 18400
34 1 6 "Average Difference" CA 40 1.139 0.119 1.147 18400
35 1 6 "Average Difference" CB 38 1.326 -0.192 1.330 18400
36 1 6 "Average Difference" HN 39 0.638 -0.180 0.620 18400
37 1 7 "Average Difference" N 37 3.390 -0.397 3.413 18400
38 1 7 "Average Difference" HA 47 0.676 -0.062 0.680 18400
39 1 7 "Average Difference" C 37 1.253 -0.892 0.892 18400
40 1 7 "Average Difference" CA 40 1.345 0.029 1.362 18400
41 1 7 "Average Difference" CB 38 1.313 -0.121 1.325 18400
42 1 7 "Average Difference" HN 39 0.676 -0.232 0.643 18400
43 1 8 "Average Difference" N 37 2.885 0.504 2.879 18400
44 1 8 "Average Difference" HA 47 0.675 -0.091 0.676 18400
45 1 8 "Average Difference" C 37 1.200 -0.801 0.907 18400
46 1 8 "Average Difference" CA 40 1.278 -0.038 1.294 18400
47 1 8 "Average Difference" CB 38 1.557 -0.217 1.563 18400
48 1 8 "Average Difference" HN 39 0.608 -0.176 0.590 18400
49 1 9 "Average Difference" N 37 2.856 0.457 2.859 18400
50 1 9 "Average Difference" HA 47 0.648 -0.044 0.653 18400
51 1 9 "Average Difference" C 37 1.163 -0.829 0.828 18400
52 1 9 "Average Difference" CA 40 1.188 0.122 1.197 18400
53 1 9 "Average Difference" CB 38 1.296 -0.123 1.308 18400
54 1 9 "Average Difference" HN 39 0.589 -0.154 0.576 18400
55 1 10 "Average Difference" N 37 3.362 -0.397 3.384 18400
56 1 10 "Average Difference" HA 47 0.659 -0.015 0.666 18400
57 1 10 "Average Difference" C 37 1.215 -0.876 0.853 18400
58 1 10 "Average Difference" CA 40 1.329 -0.048 1.345 18400
59 1 10 "Average Difference" CB 38 1.249 -0.165 1.254 18400
60 1 10 "Average Difference" HN 39 0.638 -0.180 0.620 18400
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 18400
_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 GLN N N 2 122.420 122.420 121.275 1.145 18400
2 1 . 1 1 2 2 GLN HA H 2 4.665 4.665 4.604 0.061 18400
3 1 . 1 1 2 2 GLN CA C 2 53.740 53.740 54.394 -0.653 18400
4 1 . 1 1 2 2 GLN CB C 2 28.509 28.509 29.425 -0.916 18400
5 1 . 1 1 2 2 GLN H H 2 8.573 8.573 8.079 0.494 18400
6 1 . 1 1 3 3 PRO HA H 3 4.464 4.464 4.532 -0.068 18400
7 1 . 1 1 3 3 PRO C C 3 177.173 177.173 175.891 1.282 18400
8 1 . 1 1 3 3 PRO CA C 3 62.946 62.946 62.117 0.829 18400
9 1 . 1 1 3 3 PRO CB C 3 32.109 32.109 32.505 -0.396 18400
10 1 . 1 1 4 4 ARG N N 4 122.684 122.684 120.840 1.844 18400
11 1 . 1 1 4 4 ARG HA H 4 4.578 4.578 4.220 0.358 18400
12 1 . 1 1 4 4 ARG CA C 4 53.646 53.646 55.644 -1.998 18400
13 1 . 1 1 4 4 ARG CB C 4 29.634 29.634 29.306 0.328 18400
14 1 . 1 1 4 4 ARG H H 4 8.438 8.438 8.496 -0.058 18400
15 1 . 1 1 5 5 PRO HA H 5 4.400 4.400 4.538 -0.138 18400
16 1 . 1 1 5 5 PRO C C 5 177.137 177.137 175.659 1.478 18400
17 1 . 1 1 5 5 PRO CA C 5 62.490 62.490 62.378 0.112 18400
18 1 . 1 1 5 5 PRO CB C 5 31.928 31.928 32.530 -0.602 18400
19 1 . 1 1 6 6 ALA N N 6 123.540 123.540 126.441 -2.901 18400
20 1 . 1 1 6 6 ALA HA H 6 3.919 3.919 4.310 -0.391 18400
21 1 . 1 1 6 6 ALA C C 6 176.845 176.845 176.069 0.776 18400
22 1 . 1 1 6 6 ALA CA C 6 53.270 53.270 51.166 2.104 18400
23 1 . 1 1 6 6 ALA CB C 6 19.045 19.045 19.883 -0.837 18400
24 1 . 1 1 6 6 ALA H H 6 8.360 8.360 8.076 0.284 18400
25 1 . 1 1 7 7 LYS N N 7 121.074 121.074 119.986 1.088 18400
26 1 . 1 1 7 7 LYS HA H 7 4.306 4.306 4.373 -0.067 18400
27 1 . 1 1 7 7 LYS C C 7 175.113 175.113 174.436 0.677 18400
28 1 . 1 1 7 7 LYS CA C 7 56.621 56.621 55.639 0.982 18400
29 1 . 1 1 7 7 LYS CB C 7 36.158 36.158 32.528 3.630 18400
30 1 . 1 1 7 7 LYS H H 7 7.691 7.691 7.894 -0.204 18400
31 1 . 1 1 8 8 TYR N N 8 117.325 117.325 121.478 -4.152 18400
32 1 . 1 1 8 8 TYR HA H 8 5.660 5.660 4.662 0.998 18400
33 1 . 1 1 8 8 TYR C C 8 175.278 175.278 174.207 1.071 18400
34 1 . 1 1 8 8 TYR CA C 8 56.011 56.011 56.462 -0.451 18400
35 1 . 1 1 8 8 TYR CB C 8 42.531 42.531 42.724 -0.193 18400
36 1 . 1 1 8 8 TYR H H 8 8.349 8.349 8.254 0.095 18400
37 1 . 1 1 9 9 LYS N N 9 120.812 120.812 122.239 -1.427 18400
38 1 . 1 1 9 9 LYS HA H 9 5.647 5.647 4.938 0.709 18400
39 1 . 1 1 9 9 LYS C C 9 174.978 174.978 175.229 -0.251 18400
40 1 . 1 1 9 9 LYS CA C 9 54.767 54.767 55.674 -0.907 18400
41 1 . 1 1 9 9 LYS CB C 9 36.033 36.033 34.374 1.659 18400
42 1 . 1 1 9 9 LYS H H 9 9.648 9.648 8.902 0.746 18400
43 1 . 1 1 10 10 PHE N N 10 118.595 118.595 124.665 -6.070 18400
44 1 . 1 1 10 10 PHE HA H 10 5.220 5.220 4.892 0.328 18400
45 1 . 1 1 10 10 PHE C C 10 172.698 172.698 172.474 0.224 18400
46 1 . 1 1 10 10 PHE CA C 10 55.854 55.854 56.402 -0.548 18400
47 1 . 1 1 10 10 PHE CB C 10 40.607 40.607 41.861 -1.254 18400
48 1 . 1 1 10 10 PHE H H 10 8.890 8.890 8.559 0.331 18400
49 1 . 1 1 11 11 THR N N 11 117.249 117.249 115.063 2.186 18400
50 1 . 1 1 11 11 THR HA H 11 4.745 4.745 4.266 0.479 18400
51 1 . 1 1 11 11 THR C C 11 175.071 175.071 172.882 2.189 18400
52 1 . 1 1 11 11 THR CA C 11 61.667 61.667 60.445 1.222 18400
53 1 . 1 1 11 11 THR CB C 11 69.324 69.324 69.450 -0.126 18400
54 1 . 1 1 11 11 THR H H 11 8.904 8.904 7.667 1.237 18400
55 1 . 1 1 12 12 ASP N N 12 127.813 127.813 126.061 1.752 18400
56 1 . 1 1 12 12 ASP HA H 12 4.903 4.903 3.943 0.960 18400
57 1 . 1 1 12 12 ASP C C 12 179.041 179.041 177.490 1.551 18400
58 1 . 1 1 12 12 ASP CA C 12 52.773 52.773 54.820 -2.048 18400
59 1 . 1 1 12 12 ASP CB C 12 38.879 38.879 41.729 -2.850 18400
60 1 . 1 1 12 12 ASP H H 12 8.993 8.993 8.118 0.876 18400
61 1 . 1 1 13 13 VAL N N 13 117.388 117.388 119.809 -2.421 18400
62 1 . 1 1 13 13 VAL HA H 13 3.990 3.990 3.760 0.229 18400
63 1 . 1 1 13 13 VAL C C 13 176.796 176.796 176.029 0.767 18400
64 1 . 1 1 13 13 VAL CA C 13 64.349 64.349 64.352 -0.003 18400
65 1 . 1 1 13 13 VAL CB C 13 31.652 31.652 31.886 -0.234 18400
66 1 . 1 1 13 13 VAL H H 13 8.950 8.950 8.514 0.436 18400
67 1 . 1 1 14 14 ASN N N 14 117.303 117.303 116.275 1.028 18400
68 1 . 1 1 14 14 ASN HA H 14 4.781 4.781 4.644 0.137 18400
69 1 . 1 1 14 14 ASN C C 14 176.606 176.606 175.507 1.099 18400
70 1 . 1 1 14 14 ASN CB C 14 38.851 38.851 39.133 -0.282 18400
71 1 . 1 1 14 14 ASN H H 14 8.011 8.011 8.079 -0.068 18400
72 1 . 1 1 15 15 GLY N N 15 108.443 108.443 108.011 0.432 18400
73 1 . 1 1 15 15 GLY C C 15 174.799 174.799 173.605 1.194 18400
74 1 . 1 1 15 15 GLY CA C 15 45.246 45.246 44.914 0.332 18400
75 1 . 1 1 15 15 GLY H H 15 8.288 8.288 7.555 0.733 18400
76 1 . 1 1 16 16 GLU N N 16 122.005 122.005 120.173 1.832 18400
77 1 . 1 1 16 16 GLU HA H 16 4.373 4.373 4.280 0.093 18400
78 1 . 1 1 16 16 GLU C C 16 176.564 176.564 175.534 1.030 18400
79 1 . 1 1 16 16 GLU CA C 16 55.798 55.798 56.429 -0.631 18400
80 1 . 1 1 16 16 GLU CB C 16 30.932 30.932 29.925 1.007 18400
81 1 . 1 1 16 16 GLU H H 16 8.045 8.045 8.079 -0.034 18400
82 1 . 1 1 17 17 THR N N 17 120.458 120.458 116.752 3.706 18400
83 1 . 1 1 17 17 THR HA H 17 4.583 4.583 5.101 -0.518 18400
84 1 . 1 1 17 17 THR C C 17 174.583 174.583 173.932 0.650 18400
85 1 . 1 1 17 17 THR CA C 17 63.471 63.471 61.596 1.875 18400
86 1 . 1 1 17 17 THR CB C 17 69.004 69.004 69.344 -0.341 18400
87 1 . 1 1 17 17 THR H H 17 8.758 8.758 8.344 0.414 18400
88 1 . 1 1 18 18 LYS N N 18 129.000 129.000 124.729 4.271 18400
89 1 . 1 1 18 18 LYS HA H 18 4.581 4.581 4.795 -0.214 18400
90 1 . 1 1 18 18 LYS C C 18 174.995 174.995 174.993 0.002 18400
91 1 . 1 1 18 18 LYS CB C 18 36.219 36.219 36.263 -0.044 18400
92 1 . 1 1 18 18 LYS H H 18 8.848 8.848 8.171 0.677 18400
93 1 . 1 1 19 19 THR N N 19 107.308 107.308 113.120 -5.812 18400
94 1 . 1 1 19 19 THR HA H 19 5.662 5.662 4.758 0.904 18400
95 1 . 1 1 19 19 THR C C 19 175.135 175.135 173.957 1.178 18400
96 1 . 1 1 19 19 THR CA C 19 59.541 59.541 62.206 -2.665 18400
97 1 . 1 1 19 19 THR CB C 19 72.571 72.571 69.310 3.260 18400
98 1 . 1 1 19 19 THR H H 19 8.023 8.023 8.347 -0.324 18400
99 1 . 1 1 20 20 TRP N N 20 120.113 120.113 127.410 -7.297 18400
100 1 . 1 1 20 20 TRP HA H 20 5.793 5.793 4.557 1.236 18400
101 1 . 1 1 20 20 TRP CA C 20 55.233 55.233 56.814 -1.581 18400
102 1 . 1 1 20 20 TRP CB C 20 33.193 33.193 30.856 2.337 18400
103 1 . 1 1 20 20 TRP H H 20 9.317 9.317 8.216 1.101 18400
104 1 . 1 1 21 21 THR HA H 21 4.280 4.280 4.270 0.010 18400
105 1 . 1 1 21 21 THR CA C 21 62.844 62.844 61.541 1.303 18400
106 1 . 1 1 21 21 THR CB C 21 70.918 70.918 70.253 0.665 18400
107 1 . 1 1 21 21 THR H H 21 8.449 8.449 7.651 0.798 18400
108 1 . 1 1 22 22 GLY C C 22 172.841 172.841 172.976 -0.135 18400
109 1 . 1 1 22 22 GLY CA C 22 44.229 44.229 44.490 -0.261 18400
110 1 . 1 1 22 22 GLY H H 22 7.928 7.928 7.353 0.575 18400
111 1 . 1 1 23 23 GLN N N 23 117.973 117.973 121.370 -3.397 18400
112 1 . 1 1 23 23 GLN HA H 23 4.533 4.533 4.211 0.322 18400
113 1 . 1 1 23 23 GLN C C 23 176.979 176.979 175.963 1.016 18400
114 1 . 1 1 23 23 GLN CA C 23 54.099 54.099 56.616 -2.517 18400
115 1 . 1 1 23 23 GLN CB C 23 30.565 30.565 29.372 1.193 18400
116 1 . 1 1 23 23 GLN H H 23 7.141 7.141 7.282 -0.141 18400
117 1 . 1 1 24 24 GLY N N 24 111.998 111.998 107.425 4.573 18400
118 1 . 1 1 24 24 GLY C C 24 174.510 174.510 173.866 0.644 18400
119 1 . 1 1 24 24 GLY CA C 24 44.906 44.906 45.330 -0.424 18400
120 1 . 1 1 24 24 GLY H H 24 8.841 8.841 8.603 0.238 18400
121 1 . 1 1 25 25 ARG N N 25 121.958 121.958 123.112 -1.154 18400
122 1 . 1 1 25 25 ARG HA H 25 4.179 4.179 4.373 -0.194 18400
123 1 . 1 1 25 25 ARG C C 25 177.025 177.025 175.400 1.625 18400
124 1 . 1 1 25 25 ARG CA C 25 56.285 56.285 56.405 -0.120 18400
125 1 . 1 1 25 25 ARG CB C 25 29.885 29.885 30.546 -0.661 18400
126 1 . 1 1 25 25 ARG H H 25 8.444 8.444 8.304 0.140 18400
127 1 . 1 1 26 26 THR N N 26 122.468 122.468 119.410 3.058 18400
128 1 . 1 1 26 26 THR HA H 26 3.226 3.226 4.760 -1.533 18400
129 1 . 1 1 26 26 THR CA C 26 60.422 60.422 59.097 1.325 18400
130 1 . 1 1 26 26 THR CB C 26 69.088 69.088 68.796 0.292 18400
131 1 . 1 1 26 26 THR H H 26 8.369 8.369 8.406 -0.037 18400
132 1 . 1 1 27 27 PRO HA H 27 3.867 3.867 4.178 -0.311 18400
133 1 . 1 1 27 27 PRO C C 27 177.571 177.571 178.154 -0.583 18400
134 1 . 1 1 27 27 PRO CA C 27 62.174 62.174 62.911 -0.737 18400
135 1 . 1 1 27 27 PRO CB C 27 32.818 32.818 31.970 0.848 18400
136 1 . 1 1 28 28 LYS N N 28 126.298 126.298 121.952 4.346 18400
137 1 . 1 1 28 28 LYS HA H 28 3.925 3.925 3.977 -0.052 18400
138 1 . 1 1 28 28 LYS CA C 28 60.815 60.815 61.302 -0.487 18400
139 1 . 1 1 28 28 LYS H H 28 8.903 8.903 8.840 0.063 18400
140 1 . 1 1 29 29 PRO HA H 29 4.289 4.289 4.267 0.022 18400
141 1 . 1 1 29 29 PRO C C 29 180.695 180.695 178.847 1.848 18400
142 1 . 1 1 29 29 PRO CA C 29 65.875 65.875 65.432 0.443 18400
143 1 . 1 1 29 29 PRO CB C 29 31.770 31.770 31.078 0.692 18400
144 1 . 1 1 30 30 ILE N N 30 114.387 114.387 117.952 -3.565 18400
145 1 . 1 1 30 30 ILE HA H 30 3.021 3.021 3.914 -0.893 18400
146 1 . 1 1 30 30 ILE C C 30 176.633 176.633 178.110 -1.477 18400
147 1 . 1 1 30 30 ILE CA C 30 63.949 63.949 63.640 0.309 18400
148 1 . 1 1 30 30 ILE CB C 30 36.650 36.650 36.637 0.013 18400
149 1 . 1 1 30 30 ILE H H 30 6.051 6.051 7.930 -1.879 18400
150 1 . 1 1 31 31 ALA N N 31 123.060 123.060 122.479 0.581 18400
151 1 . 1 1 31 31 ALA HA H 31 3.720 3.720 3.981 -0.261 18400
152 1 . 1 1 31 31 ALA C C 31 181.571 181.571 179.602 1.969 18400
153 1 . 1 1 31 31 ALA CA C 31 55.456 55.456 55.797 -0.342 18400
154 1 . 1 1 31 31 ALA CB C 31 17.825 17.825 17.855 -0.030 18400
155 1 . 1 1 31 31 ALA H H 31 7.922 7.922 8.828 -0.906 18400
156 1 . 1 1 32 32 GLN N N 32 117.568 117.568 119.077 -1.509 18400
157 1 . 1 1 32 32 GLN HA H 32 3.934 3.934 4.051 -0.117 18400
158 1 . 1 1 32 32 GLN C C 32 178.025 178.025 178.128 -0.103 18400
159 1 . 1 1 32 32 GLN CA C 32 58.424 58.424 58.835 -0.411 18400
160 1 . 1 1 32 32 GLN CB C 32 28.285 28.285 28.540 -0.255 18400
161 1 . 1 1 32 32 GLN H H 32 8.438 8.438 7.852 0.586 18400
162 1 . 1 1 33 33 ALA N N 33 121.972 121.972 122.798 -0.826 18400
163 1 . 1 1 33 33 ALA HA H 33 4.282 4.282 4.196 0.086 18400
164 1 . 1 1 33 33 ALA C C 33 181.426 181.426 179.824 1.602 18400
165 1 . 1 1 33 33 ALA CA C 33 55.082 55.082 55.070 0.012 18400
166 1 . 1 1 33 33 ALA CB C 33 18.720 18.720 18.541 0.179 18400
167 1 . 1 1 33 33 ALA H H 33 7.099 7.099 7.483 -0.384 18400
168 1 . 1 1 34 34 LEU N N 34 119.898 119.898 119.038 0.860 18400
169 1 . 1 1 34 34 LEU HA H 34 4.297 4.297 4.618 -0.321 18400
170 1 . 1 1 34 34 LEU C C 34 182.198 182.198 180.183 2.015 18400
171 1 . 1 1 34 34 LEU CA C 34 57.310 57.310 57.243 0.067 18400
172 1 . 1 1 34 34 LEU CB C 34 40.490 40.490 42.030 -1.540 18400
173 1 . 1 1 34 34 LEU H H 34 8.538 8.538 8.727 -0.189 18400
174 1 . 1 1 35 35 ALA N N 35 122.660 122.660 121.827 0.833 18400
175 1 . 1 1 35 35 ALA HA H 35 4.222 4.222 4.111 0.111 18400
176 1 . 1 1 35 35 ALA C C 35 179.762 179.762 179.076 0.686 18400
177 1 . 1 1 35 35 ALA CA C 35 54.226 54.226 54.681 -0.455 18400
178 1 . 1 1 35 35 ALA CB C 35 17.744 17.744 18.254 -0.510 18400
179 1 . 1 1 35 35 ALA H H 35 7.741 7.741 8.378 -0.637 18400
180 1 . 1 1 36 36 GLU N N 36 116.640 116.640 116.415 0.225 18400
181 1 . 1 1 36 36 GLU HA H 36 4.403 4.403 4.280 0.123 18400
182 1 . 1 1 36 36 GLU C C 36 177.531 177.531 177.430 0.101 18400
183 1 . 1 1 36 36 GLU CA C 36 55.856 55.856 56.766 -0.910 18400
184 1 . 1 1 36 36 GLU CB C 36 29.741 29.741 30.084 -0.343 18400
185 1 . 1 1 36 36 GLU H H 36 7.496 7.496 7.717 -0.221 18400
186 1 . 1 1 37 37 GLY N N 37 106.885 106.885 106.767 0.118 18400
187 1 . 1 1 37 37 GLY C C 37 176.072 176.072 174.390 1.682 18400
188 1 . 1 1 37 37 GLY CA C 37 45.369 45.369 44.913 0.456 18400
189 1 . 1 1 37 37 GLY H H 37 7.802 7.802 8.062 -0.260 18400
190 1 . 1 1 38 38 LYS N N 38 120.419 120.419 121.398 -0.979 18400
191 1 . 1 1 38 38 LYS HA H 38 4.479 4.479 4.546 -0.067 18400
192 1 . 1 1 38 38 LYS C C 38 174.921 174.921 175.744 -0.823 18400
193 1 . 1 1 38 38 LYS CA C 38 55.927 55.927 55.298 0.629 18400
194 1 . 1 1 38 38 LYS CB C 38 31.850 31.850 33.549 -1.699 18400
195 1 . 1 1 38 38 LYS H H 38 7.935 7.935 7.608 0.327 18400
196 1 . 1 1 39 39 SER N N 39 114.172 114.172 115.345 -1.173 18400
197 1 . 1 1 39 39 SER HA H 39 4.812 4.812 4.519 0.293 18400
198 1 . 1 1 39 39 SER C C 39 176.690 176.690 175.875 0.815 18400
199 1 . 1 1 39 39 SER CA C 39 56.473 56.473 57.164 -0.691 18400
200 1 . 1 1 39 39 SER CB C 39 65.933 65.933 64.291 1.642 18400
201 1 . 1 1 39 39 SER H H 39 8.579 8.579 8.496 0.083 18400
202 1 . 1 1 40 40 LEU N N 40 126.212 126.212 122.412 3.800 18400
203 1 . 1 1 40 40 LEU HA H 40 4.201 4.201 4.018 0.183 18400
204 1 . 1 1 40 40 LEU C C 40 179.329 179.329 177.817 1.512 18400
205 1 . 1 1 40 40 LEU CA C 40 58.049 58.049 56.034 2.015 18400
206 1 . 1 1 40 40 LEU CB C 40 41.038 41.038 41.639 -0.601 18400
207 1 . 1 1 40 40 LEU H H 40 9.038 9.038 8.930 0.108 18400
208 1 . 1 1 41 41 ASP N N 41 115.700 115.700 118.668 -2.968 18400
209 1 . 1 1 41 41 ASP HA H 41 4.580 4.580 3.984 0.596 18400
210 1 . 1 1 41 41 ASP C C 41 179.063 179.063 177.741 1.322 18400
211 1 . 1 1 41 41 ASP CA C 41 56.353 56.353 56.886 -0.533 18400
212 1 . 1 1 41 41 ASP CB C 41 40.217 40.217 40.108 0.109 18400
213 1 . 1 1 41 41 ASP H H 41 8.217 8.217 8.168 0.049 18400
214 1 . 1 1 42 42 ASP N N 42 119.466 119.466 119.171 0.295 18400
215 1 . 1 1 42 42 ASP HA H 42 4.422 4.422 4.393 0.029 18400
216 1 . 1 1 42 42 ASP C C 42 177.484 177.484 176.932 0.552 18400
217 1 . 1 1 42 42 ASP CB C 42 40.234 40.234 40.986 -0.752 18400
218 1 . 1 1 42 42 ASP H H 42 7.959 7.959 7.396 0.563 18400
219 1 . 1 1 43 43 PHE N N 43 117.109 117.109 116.206 0.903 18400
220 1 . 1 1 43 43 PHE HA H 43 4.873 4.873 4.721 0.152 18400
221 1 . 1 1 43 43 PHE C C 43 175.641 175.641 174.700 0.941 18400
222 1 . 1 1 43 43 PHE CA C 43 58.196 58.196 55.240 2.956 18400
223 1 . 1 1 43 43 PHE CB C 43 39.344 39.344 38.472 0.872 18400
224 1 . 1 1 43 43 PHE H H 43 8.320 8.320 7.152 1.168 18400
225 1 . 1 1 44 44 LEU N N 44 122.188 122.188 119.487 2.701 18400
226 1 . 1 1 44 44 LEU HA H 44 4.428 4.428 4.215 0.213 18400
227 1 . 1 1 44 44 LEU C C 44 178.294 178.294 177.015 1.279 18400
228 1 . 1 1 44 44 LEU CA C 44 56.434 56.434 55.066 1.368 18400
229 1 . 1 1 44 44 LEU CB C 44 42.835 42.835 41.383 1.452 18400
230 1 . 1 1 44 44 LEU H H 44 7.387 7.387 7.098 0.289 18400
stop_
save_